data_2lli_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2lli _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.68 -51.14 22.3 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 124.259 1.024 . . . . 0.0 113.289 165.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.44 -38.25 0.78 Allowed 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 122.616 2.211 . . . . 0.0 114.267 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.403 0.0 OUTLIER 49.73 -42.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 130.843 3.657 . . . . 0.0 118.537 -169.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.7 t -159.66 160.57 34.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.685 1.994 . . . . 0.0 111.693 174.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -71.01 -29.25 65.14 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 173.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -161.64 -35.67 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.9 m -76.19 -21.19 56.78 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.8 m 58.49 11.87 1.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 119.012 2.967 . . . . 0.0 119.012 171.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -133.08 -3.25 3.15 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 -175.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -126.14 160.39 30.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.383 1.473 . . . . 0.0 111.857 -172.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.01 -19.23 69.7 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.03 92.57 3.18 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -57.38 179.21 0.06 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.891 2.077 . . . . 0.0 114.049 170.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -63.8 0.53 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.489 1.916 . . . . 0.0 114.475 -170.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -79.22 -11.46 59.96 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.57 1.548 . . . . 0.0 114.887 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -81.04 -37.82 28.45 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.175 0.99 . . . . 0.0 111.475 176.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.2 t -58.34 -37.4 54.5 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo . . . . . 0 C--N 1.353 0.813 0 C-N-CA 122.777 2.318 . . . . 0.0 114.754 174.783 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 123.099 1.428 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.3 mm -87.88 133.87 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 127.442 2.297 . . . . 0.0 108.546 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 m -61.81 142.41 57.33 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.989 -0.444 . . . . 0.0 110.812 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 73.5 m -51.1 -30.35 15.92 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 -159.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -142.26 11.79 1.95 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 174.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 44.3 m -64.59 -48.52 74.67 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.58 -1.325 . . . . 0.0 113.03 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . 0.452 ' HA2' ' H ' ' A' ' 43' ' ' ILE . . . -165.79 178.45 40.54 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -153.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.63 138.8 47.69 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.36 1.464 . . . . 0.0 109.915 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 t -56.37 -19.24 13.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.959 1.704 . . . . 0.0 114.361 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -65.65 -19.26 65.84 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 172.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -139.23 -34.87 0.57 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.376 1.47 . . . . 0.0 114.485 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -66.51 123.97 21.5 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.144 1.778 . . . . 0.0 112.053 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -155.22 169.37 24.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.42 1.488 . . . . 0.0 110.673 -174.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -63.12 -13.15 33.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.003 1.721 . . . . 0.0 115.509 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -109.35 2.55 20.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.295 1.838 . . . . 0.0 113.652 170.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -136.55 0.71 2.52 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -172.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.3 t -37.29 -51.88 2.37 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.194 2.198 . . . . 0.0 114.93 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.87 -8.45 19.06 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.436 2.758 . . . . 0.0 116.066 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -102.1 5.99 40.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.362 1.865 . . . . 0.0 113.653 -173.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -86.81 -152.64 0.19 Allowed 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.122 1.369 . . . . 0.0 113.355 -173.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . 0.452 ' H ' ' HA2' ' A' ' 29' ' ' GLY . 95.3 mt -55.43 -40.37 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.621 1.569 . . . . 0.0 113.48 -169.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -118.74 154.33 32.96 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 24.6 p -83.29 -34.29 25.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.855 1.262 . . . . 0.0 114.031 -175.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.0 t -159.37 -155.77 0.48 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.097 1.359 . . . . 0.0 111.322 -170.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -62.79 -24.99 68.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 127.013 2.125 . . . . 0.0 112.692 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 24.4 p -89.82 155.08 19.41 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.045 1.338 . . . . 0.0 112.467 172.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -72.3 134.17 45.39 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -166.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 60.26 148.48 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 128.827 2.851 . . . . 0.0 117.006 176.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.6 m -71.8 -15.66 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 119.783 -1.823 . . . . 0.0 110.714 161.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.91 18.87 1.32 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 128.025 2.726 . . . . 0.0 116.457 -170.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.0 155.31 44.64 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.809 1.304 . . . . 0.0 112.171 174.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.9 t80 59.9 137.64 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 128.069 2.547 . . . . 0.0 115.722 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.99 148.58 20.98 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.483 1.113 . . . . 0.0 112.486 -175.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 m 57.32 32.68 22.15 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -168.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 54.96 45.88 25.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.625 1.97 . . . . 0.0 113.495 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.7 t . . . . . 0 CA--C 1.555 1.144 0 C-N-CA 126.881 2.072 . . . . 0.0 113.585 -175.875 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.5 t . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.649 0.261 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -69.98 -35.84 74.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.489 0.716 . . . . 0.0 112.019 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 22.2 m -76.55 156.74 32.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 123.688 1.709 . . . . 0.0 112.168 166.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 36.9 p -113.31 -15.26 12.71 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.673 2.389 . . . . 0.0 111.702 -161.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.19 -21.46 21.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.078 1.751 . . . . 0.0 111.861 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 76.0 m -99.5 -22.35 15.53 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.715 1.206 . . . . 0.0 114.222 -164.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.62 -55.48 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 129.617 3.167 . . . . 0.0 118.91 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 58.2 m -112.76 122.37 47.47 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -162.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt 56.54 -51.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.746 3.619 . . . . 0.0 119.24 168.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -80.33 151.03 29.69 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -160.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 54.84 177.68 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 119.241 3.052 . . . . 0.0 119.241 159.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 68.4 m -139.63 170.61 15.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 127.492 2.317 . . . . 0.0 111.39 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -56.87 -31.76 65.15 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -176.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -73.83 -19.31 60.78 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -102.01 -17.36 16.12 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.227 1.811 . . . . 0.0 112.97 174.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 43.8 t . . . . . 0 CA--C 1.553 1.085 0 C-N-CA 125.851 1.66 . . . . 0.0 112.471 176.216 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -68.09 134.13 50.09 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -172.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -150.68 161.75 42.0 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.776 1.63 . . . . 0.0 111.073 -175.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -59.51 156.47 13.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.006 1.322 . . . . 0.0 113.442 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -141.22 175.36 9.71 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 112.433 -176.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? 43.89 59.49 12.45 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 127.497 2.319 . . . . 0.0 115.835 174.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -76.8 70.8 6.37 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.272 3.314 . . . . 0.0 112.62 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -137.16 161.19 36.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.302 2.641 . . . . 0.0 111.104 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 26.9 m -65.1 148.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.141 0.976 . . . . 0.0 112.487 176.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.8 mt -84.92 156.6 60.81 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.281 1.032 . . . . 0.0 112.652 -177.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.25 159.6 30.17 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.798 2.999 . . . . 0.0 114.444 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.9 p90 . . . . . 0 CA--C 1.542 0.668 0 C-N-CA 124.324 1.05 . . . . 0.0 112.931 176.929 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.6 p . . . . . 0 CA--C 1.552 1.044 0 N-CA-C 119.397 3.11 . . . . 0.0 119.397 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.3 t80 60.94 6.46 1.22 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.619 2.367 . . . . 0.0 114.847 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -106.96 -25.02 11.81 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.716 1.607 . . . . 0.0 112.168 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.2 p -145.38 18.43 1.53 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.77 1.628 . . . . 0.0 113.963 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 162.62 -133.94 3.27 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.016 1.293 . . . . 0.0 113.292 175.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.31 -159.64 1.07 Allowed Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.908 1.718 . . . . 0.0 113.014 171.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -109.65 150.71 27.86 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.46 1.63 . . . . 0.0 112.941 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 154.57 -103.46 0.24 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 115.265 0.866 . . . . 0.0 115.265 -177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -70.67 151.31 45.07 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 -153.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 45.89 28.14 0.56 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.409 2.283 . . . . 0.0 116.835 164.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.21 -16.47 34.29 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.725 1.155 . . . . 0.0 115.669 -170.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.43 -33.64 76.0 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.754 1.621 . . . . 0.0 113.958 173.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -138.6 -21.14 1.02 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.951 1.301 . . . . 0.0 114.367 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.55 0.944 0 C-N-CA 125.524 1.53 . . . . 0.0 111.135 172.522 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.839 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.05 61.08 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 123.993 0.917 . . . . 0.0 112.061 164.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.42 -46.02 0.23 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.551 2.167 . . . . 0.0 113.196 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.252 1.8 pttm 41.98 -165.72 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.324 1.45 . . . . 0.0 112.45 -149.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 m -56.2 155.38 6.75 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.077 -1.64 . . . . 0.0 114.442 178.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -61.18 -44.33 97.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.439 1.496 . . . . 0.0 114.636 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -157.57 -34.61 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.335 2.654 . . . . 0.0 109.974 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.9 t -55.61 168.48 0.41 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.486 1.514 . . . . 0.0 111.309 153.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.2 m -134.54 76.51 1.64 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -175.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -132.92 161.01 35.38 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.268 1.427 . . . . 0.0 110.586 162.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -78.15 -32.82 50.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.933 1.293 . . . . 0.0 112.822 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -73.76 -177.64 35.85 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 124.666 1.127 . . . . 0.0 112.81 169.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.331 0.6 OUTLIER 21.62 64.92 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 128.006 2.523 . . . . 0.0 114.85 -176.181 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -178.28 0.18 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.438 1.895 . . . . 0.0 114.103 -174.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -22.72 -69.98 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 127.782 2.433 . . . . 0.0 115.068 -174.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -77.06 -14.29 59.84 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.059 1.744 . . . . 0.0 115.645 -178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.33 -26.34 16.61 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.567 1.947 . . . . 0.0 113.219 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -56.94 -46.7 99.84 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.057 1.343 . . . . 0.0 114.437 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo . . . . . 0 CA--C 1.543 0.972 0 C-N-CA 122.892 2.395 . . . . 0.0 113.822 178.847 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.5 mt . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.0 mt -118.98 58.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.426 1.49 . . . . 0.0 109.585 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.5 m 49.3 50.92 17.26 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.702 1.601 . . . . 0.0 113.541 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.1 m 56.51 46.52 20.44 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.709 1.204 . . . . 0.0 113.667 -173.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 12.1 t80 56.64 56.01 5.91 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.574 1.95 . . . . 0.0 113.558 -177.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 p -72.04 -30.09 64.83 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.052 -1.03 . . . . 0.0 112.48 173.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -177.69 -159.44 22.62 Favored Glycine 0 CA--C 1.53 0.986 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 -169.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.16 174.22 10.36 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.364 1.066 . . . . 0.0 111.613 173.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.2 t -110.12 -18.87 13.23 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -177.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -97.04 -39.2 9.45 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.862 -1.149 . . . . 0.0 113.829 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -85.86 11.73 10.66 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.766 1.227 . . . . 0.0 112.433 169.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -70.99 126.44 29.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.668 1.987 . . . . 0.0 112.681 -174.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -152.0 150.59 30.15 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.66 1.184 . . . . 0.0 111.031 171.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.1 m -61.35 -27.43 68.5 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.593 1.557 . . . . 0.0 114.616 -171.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -75.67 -29.96 59.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.797 1.239 . . . . 0.0 113.149 174.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.2 m170 -101.47 -28.39 12.59 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -170.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.3 m -5.03 -75.22 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 129.833 3.253 . . . . 0.0 117.7 -174.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -76.87 -12.76 17.87 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.12 2.546 . . . . 0.0 115.574 -172.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -92.52 33.03 1.14 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.478 1.911 . . . . 0.0 113.02 -172.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -110.51 -38.16 5.28 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -163.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 58.6 mt -128.19 126.73 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.87 0.868 . . . . 0.0 111.681 -167.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.89 158.09 43.95 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 127.135 2.174 . . . . 0.0 110.113 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.1 t -75.96 143.64 41.45 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.453 0.701 . . . . 0.0 110.96 173.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.1 p -61.13 -37.4 82.69 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.929 1.292 . . . . 0.0 114.034 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -122.14 -7.7 8.81 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.742 1.617 . . . . 0.0 114.619 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 39.7 m -117.03 8.04 13.27 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 61.65 0.6 0.5 Allowed 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 119.119 3.007 . . . . 0.0 119.119 166.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -141.64 148.5 39.26 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 120.78 1.627 . . . . 0.0 112.73 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.292 11.2 m 53.55 -9.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 1 N-CA-C 121.847 4.017 . . . . 0.0 121.847 164.229 . . . . . . . . 3 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 117.02 -177.22 16.59 Favored Glycine 0 N--CA 1.48 1.567 0 CA-C-N 121.136 1.789 . . . . 0.0 114.308 171.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -117.98 0.04 11.78 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 115.779 1.77 . . . . 0.0 115.779 -170.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -83.44 153.32 24.54 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.581 -1.324 . . . . 0.0 111.908 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -60.65 -24.85 65.89 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -167.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -80.48 -12.4 59.55 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -132.79 -19.02 2.35 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -172.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 13.4 t . . . . . 0 CA--C 1.548 0.88 0 CA-C-N 119.992 1.269 . . . . 0.0 112.021 179.051 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 N--CA 1.484 1.256 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 61.92 6.62 1.74 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 126.865 2.066 . . . . 0.0 115.753 177.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 71.0 m -88.37 0.8 55.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.594 1.158 . . . . 0.0 113.702 173.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.281 6.3 t 57.29 -42.94 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 129.452 3.101 . . . . 0.0 117.768 -169.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -101.35 7.9 42.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 178.224 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 71.9 m -112.26 147.4 36.34 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.186 0.994 . . . . 0.0 112.229 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -106.92 178.9 4.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.913 1.685 . . . . 0.0 110.371 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.1 p -66.29 -29.48 69.7 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -80.79 160.03 24.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.273 1.429 . . . . 0.0 112.77 171.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . 0.265 22.5 pttp 49.52 30.29 3.39 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.962 2.505 . . . . 0.0 116.202 174.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -109.16 120.17 41.74 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.076 0.95 . . . . 0.0 112.529 -174.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.3 m -144.05 139.85 29.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.229 1.412 . . . . 0.0 111.78 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.64 -38.93 89.5 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.121 0.968 . . . . 0.0 112.871 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -80.98 -10.03 59.77 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.365 1.066 . . . . 0.0 113.775 179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -108.49 -24.58 11.34 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.429 1.491 . . . . 0.0 113.716 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.9 t . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 125.139 1.376 . . . . 0.0 114.383 179.818 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.8 t70 . . . . . 0 CA--C 1.549 0.924 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.41 14.54 4.83 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 129.039 2.936 . . . . 0.0 115.494 176.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -137.61 152.42 49.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.096 1.758 . . . . 0.0 111.726 176.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -134.88 4.13 3.26 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.583 1.553 . . . . 0.0 114.75 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.21 154.44 23.37 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.028 1.331 . . . . 0.0 112.411 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -79.25 161.65 66.99 Favored Pre-proline 0 N--CA 1.476 0.836 0 C-N-CA 124.604 1.162 . . . . 0.0 112.665 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.46 162.98 19.0 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.312 2.675 . . . . 0.0 114.173 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -118.3 155.18 31.07 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.164 1.786 . . . . 0.0 111.172 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.2 t -128.17 138.03 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 125.145 1.378 . . . . 0.0 110.743 -176.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.509 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 60.5 tp -126.33 -49.26 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.743 1.617 . . . . 0.0 113.686 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.509 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 90.7 Cg_endo -73.15 162.36 40.89 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.064 1.842 . . . . 0.0 112.629 176.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 59.7 t80 . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.206 1.402 . . . . 0.0 111.721 -179.919 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 40.4 t . . . . . 0 CA--C 1.541 0.614 0 CA-C-O 121.27 0.557 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -69.85 -37.34 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -169.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -100.02 -33.77 10.36 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 68.4 m -95.05 -11.71 27.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -161.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 75.65 -20.64 2.19 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.056 1.312 . . . . 0.0 114.367 -169.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -76.15 177.56 50.37 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.2 1.381 . . . . 0.0 113.95 170.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -141.93 147.7 37.48 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.585 1.554 . . . . 0.0 111.609 -172.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.29 9.83 55.55 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 162.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.464 ' C ' ' H ' ' A' ' 118' ' ' GLY . 3.0 p80 -83.05 -154.35 0.14 Allowed 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.489 1.644 . . . . 0.0 112.103 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -65.05 25.96 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 126.572 1.949 . . . . 0.0 114.556 167.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -43.13 -29.43 0.94 Allowed Glycine 0 CA--C 1.538 1.482 0 C-N-CA 129.083 3.23 . . . . 0.0 115.044 168.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.83 -38.06 84.18 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.745 1.618 . . . . 0.0 114.08 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -102.85 -21.47 14.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.49 1.516 . . . . 0.0 112.36 176.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 24.9 t . . . . . 0 CA--C 1.554 1.116 0 C-N-CA 126.721 2.008 . . . . 0.0 111.097 169.762 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -80.95 -54.35 0.74 Allowed Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 123.824 0.849 . . . . 0.0 112.076 155.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -76.7 -48.32 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.382 2.055 . . . . 0.0 114.313 -177.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.262 7.0 pttm 42.17 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.571 1.549 . . . . 0.0 112.587 -148.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.8 m -54.13 148.74 10.56 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 119.848 -1.782 . . . . 0.0 113.8 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -60.33 -39.69 87.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.558 0.743 . . . . 0.0 112.0 174.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -136.81 -48.31 0.62 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -169.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.5 p -97.95 16.78 19.92 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -167.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.0 m 52.23 59.1 4.76 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 118.054 2.612 . . . . 0.0 118.054 164.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -129.67 164.76 23.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.897 1.279 . . . . 0.0 111.899 165.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -94.31 155.59 16.93 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.256 1.822 . . . . 0.0 111.828 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.77 -19.37 29.62 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 125.087 1.327 . . . . 0.0 115.958 170.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.279 11.8 p-80 -126.73 55.95 1.51 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 123.756 1.741 . . . . 0.0 109.925 170.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -179.4 0.18 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.528 2.331 . . . . 0.0 114.808 -173.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -14.81 -71.52 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 128.788 2.835 . . . . 0.0 115.74 -177.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -77.01 -20.56 55.87 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -94.34 -2.97 51.26 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.217 2.207 . . . . 0.0 113.243 175.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.9 t -61.76 -41.12 75.69 Favored Pre-proline 0 CA--C 1.557 1.223 0 C-N-CA 126.491 1.917 . . . . 0.0 114.329 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo . . . . . 0 C--N 1.359 1.097 0 C-N-CA 122.542 2.161 . . . . 0.0 112.926 171.081 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.4 pt -60.42 147.23 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 119.947 1.249 . . . . 0.0 112.876 177.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.0 m -73.08 -65.09 0.85 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 m -149.2 -61.54 0.22 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.274 1.03 . . . . 0.0 112.215 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -146.55 59.16 1.21 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.72 1.608 . . . . 0.0 110.267 -178.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.4 p -151.99 168.18 26.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.976 1.711 . . . . 0.0 111.112 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 52.09 -152.93 6.16 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.792 1.663 . . . . 0.0 113.454 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.89 146.41 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.202 1.401 . . . . 0.0 108.946 164.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.1 t -60.41 -23.77 64.63 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -92.85 -11.32 33.88 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.537 1.535 . . . . 0.0 113.991 175.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -156.26 100.03 1.97 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.268 1.427 . . . . 0.0 111.622 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -150.26 143.54 25.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.008 0.923 . . . . 0.0 112.857 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -165.57 170.9 13.77 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 128.668 2.787 . . . . 0.0 108.472 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.8 m -57.36 -32.41 66.73 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.343 -1.473 . . . . 0.0 114.545 177.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -96.5 3.83 52.47 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.86 1.264 . . . . 0.0 114.288 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -116.92 0.55 12.48 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.348 1.459 . . . . 0.0 113.354 173.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -37.28 -50.64 2.41 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.253 1.421 . . . . 0.0 112.445 155.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -82.1 23.57 0.77 Allowed 'Trans proline' 0 CA--C 1.552 1.376 0 C-N-CA 124.639 3.559 . . . . 0.0 116.437 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -75.19 -84.73 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.196 -1.565 . . . . 0.0 112.643 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.22 -12.22 30.75 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -167.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.0 mt -141.46 112.9 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.756 1.622 . . . . 0.0 107.09 -169.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.271 3.8 pm0 47.48 174.1 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.891 1.676 . . . . 0.0 115.072 -159.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 59.3 m -140.48 151.63 44.98 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 127.112 2.165 . . . . 0.0 109.483 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 p -71.76 -32.11 67.34 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.258 1.423 . . . . 0.0 113.192 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -99.81 -34.14 10.28 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.052 1.741 . . . . 0.0 113.004 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 3.1 m -103.67 -1.43 28.12 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.4 t0 58.45 -155.96 0.34 Allowed 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.402 1.481 . . . . 0.0 113.19 -171.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -42.51 8.27 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 C-N-CA 134.139 4.976 . . . . 0.0 121.123 -169.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -101.75 -36.01 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.527 1.531 . . . . 0.0 114.498 -161.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.44 164.83 6.45 Favored Glycine 0 CA--C 1.541 1.672 0 C-N-CA 124.351 0.977 . . . . 0.0 114.462 -174.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -87.12 28.61 0.91 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.899 1.28 . . . . 0.0 114.078 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -65.68 154.04 40.0 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.122 -0.986 . . . . 0.0 112.126 171.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -23.68 44.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.612 1.965 . . . . 0.0 114.946 -172.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.7 m -104.37 4.18 33.17 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -119.47 -37.92 3.09 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.992 1.717 . . . . 0.0 111.847 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 91.0 m . . . . . 0 CA--C 1.55 0.946 0 C-N-CA 126.582 1.953 . . . . 0.0 110.97 169.122 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -66.19 -30.58 71.07 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.729 0.412 . . . . 0.0 111.807 -175.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.3 m -74.32 170.24 16.01 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.764 1.745 . . . . 0.0 113.109 175.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.2 p -135.16 -23.29 1.51 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 127.796 2.438 . . . . 0.0 111.209 -162.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mp -78.39 -23.78 46.64 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.373 1.869 . . . . 0.0 111.441 165.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.2 m -104.28 155.51 18.69 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.708 1.203 . . . . 0.0 113.568 -163.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -81.86 164.77 21.37 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.736 1.215 . . . . 0.0 109.904 164.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 p -73.25 41.29 0.11 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.604 2.762 . . . . 0.0 114.501 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -98.08 163.13 12.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.424 2.29 . . . . 0.0 110.983 177.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -55.31 146.35 19.54 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.081 1.352 . . . . 0.0 112.643 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -133.77 160.73 36.72 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.079 1.752 . . . . 0.0 111.167 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.7 t -100.68 146.04 27.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.055 0.942 . . . . 0.0 112.565 164.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -62.2 -40.55 96.43 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.128 1.371 . . . . 0.0 113.499 -177.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.83 -19.81 19.31 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.985 1.105 . . . . 0.0 113.985 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -124.89 -2.34 7.77 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -167.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . 0.417 21.7 t . . . . . 0 CA--C 1.556 1.208 0 CA-C-O 115.165 -2.35 . . . . 0.0 114.745 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 . . . . . 0 CA--C 1.547 0.83 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -131.82 132.78 44.02 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.07 1.748 . . . . 0.0 110.954 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -78.56 -30.32 46.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.998 1.319 . . . . 0.0 113.465 -178.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -108.87 157.38 18.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.409 1.483 . . . . 0.0 114.098 -171.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.28 160.61 41.78 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.952 1.701 . . . . 0.0 111.472 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -70.81 134.17 86.05 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 124.112 0.965 . . . . 0.0 111.171 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -66.76 -28.46 43.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.853 2.369 . . . . 0.0 114.748 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -150.27 161.94 41.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.449 1.9 . . . . 0.0 112.126 -173.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.2 m -89.03 -5.97 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.481 1.112 . . . . 0.0 113.588 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.07 149.07 40.88 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.451 1.101 . . . . 0.0 111.8 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -63.42 175.29 2.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.937 3.091 . . . . 0.0 114.616 172.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 . . . . . 0 CA--C 1.548 0.866 0 C-N-CA 125.382 1.473 . . . . 0.0 113.935 173.499 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t . . . . . 0 CA--C 1.551 1.016 0 CA-C-O 120.763 0.316 . . . . 0.0 111.563 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -141.0 -23.27 0.77 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.932 1.693 . . . . 0.0 114.471 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -114.36 172.94 6.71 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.899 2.08 . . . . 0.0 111.827 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.326 14.5 p 51.65 12.36 0.17 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 128.809 2.844 . . . . 0.0 118.6 170.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 163.6 -165.79 36.99 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.45 1.5 . . . . 0.0 112.942 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -72.86 149.58 43.22 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 123.938 0.78 . . . . 0.0 112.823 172.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -62.43 -15.49 49.73 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -170.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -78.9 -22.0 67.1 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 118.563 -1.132 . . . . 0.0 115.83 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -79.67 134.74 36.43 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.13 1.965 . . . . 0.0 114.761 -162.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 31.62 36.25 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 130.378 3.471 . . . . 0.0 117.388 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.76 -17.67 43.13 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.859 1.219 . . . . 0.0 115.153 -170.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -63.39 -35.24 79.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.247 1.819 . . . . 0.0 113.799 172.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -131.51 -12.38 3.47 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.822 1.649 . . . . 0.0 113.816 -170.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 26.8 t . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 124.474 1.11 . . . . 0.0 111.454 177.767 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.52 28.6 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 0.0 113.229 164.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.78 -39.34 0.99 Allowed 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 122.707 2.271 . . . . 0.0 114.988 -175.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? 58.37 -57.77 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 128.441 2.696 . . . . 0.0 116.283 -170.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -155.22 159.47 40.11 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.257 2.223 . . . . 0.0 111.525 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -72.99 -30.16 63.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -161.23 -42.2 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.208 1.403 . . . . 0.0 112.74 -172.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.4 -12.75 60.6 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -168.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m 54.31 26.34 6.78 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.956 1.836 . . . . 0.0 115.956 -173.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -98.12 161.32 13.77 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.041 1.336 . . . . 0.0 112.717 175.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -72.28 161.33 30.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.63 1.572 . . . . 0.0 113.882 -175.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.05 -71.4 2.62 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.177 1.37 . . . . 0.0 114.174 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.278 0.6 OUTLIER -83.51 77.46 9.82 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 123.15 1.452 . . . . 0.0 112.9 -172.371 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -60.6 -179.4 0.12 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.261 2.225 . . . . 0.0 113.498 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.7 -62.84 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 126.164 1.786 . . . . 0.0 114.062 -171.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -80.41 -2.75 46.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.62 1.968 . . . . 0.0 115.419 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.31 -17.9 13.89 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.746 1.618 . . . . 0.0 113.664 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.6 t -48.91 -48.66 71.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -172.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo . . . . . 0 CA--C 1.544 1.016 0 C-N-CA 122.461 2.108 . . . . 0.0 114.545 179.52 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.4 pt -81.56 152.03 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.556 1.143 . . . . 0.0 112.109 173.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.6 p -134.79 152.85 52.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.484 1.514 . . . . 0.0 111.109 174.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.71 20.82 1.2 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.584 1.554 . . . . 0.0 115.028 176.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.2 t80 47.87 34.31 3.89 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.863 2.065 . . . . 0.0 114.45 -169.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 p -93.56 2.38 56.41 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 115.143 1.535 . . . . 0.0 115.143 -172.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -157.63 167.31 34.09 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 123.833 0.73 . . . . 0.0 114.639 -177.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.09 135.15 34.52 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.807 0.843 . . . . 0.0 110.736 172.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -64.6 -14.63 58.71 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -85.76 -18.11 33.93 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.931 1.292 . . . . 0.0 114.275 176.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -140.76 -5.29 1.18 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 116.477 2.029 . . . . 0.0 116.477 -174.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -63.48 142.29 58.45 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.419 1.087 . . . . 0.0 112.288 174.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -136.08 111.77 9.38 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.289 1.435 . . . . 0.0 109.189 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 61.9 p -64.27 -20.59 66.16 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -168.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -69.14 -24.83 64.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.388 1.475 . . . . 0.0 112.973 173.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -132.83 -34.02 1.16 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 -167.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 m 60.78 166.51 0.09 OUTLIER Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 126.89 2.076 . . . . 0.0 114.059 -166.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -119.6 -170.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 122.495 2.13 . . . . 0.0 114.365 -155.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.96 66.64 0.91 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.817 2.047 . . . . 0.0 109.48 167.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.05 -36.64 2.33 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -163.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.3 mt -126.93 35.04 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 126.832 2.053 . . . . 0.0 108.453 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -145.57 154.76 42.52 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.287 3.035 . . . . 0.0 107.817 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 31.3 p -70.46 170.32 12.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 122.027 0.918 . . . . 0.0 112.237 167.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -70.21 134.65 48.28 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.724 -0.61 . . . . 0.0 111.04 165.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.318 19.4 ptpt 53.65 136.94 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 129.62 3.168 . . . . 0.0 115.463 -165.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . 0.298 0.5 OUTLIER 55.55 179.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 126.355 1.862 . . . . 0.0 114.874 -160.498 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -120.06 32.27 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.301 1.841 . . . . 0.0 114.854 -158.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -133.24 162.19 32.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.379 1.472 . . . . 0.0 112.136 -176.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.7 t -69.06 129.88 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.353 1.461 . . . . 0.0 112.42 -174.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.98 -169.13 7.61 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 124.703 1.144 . . . . 0.0 115.046 174.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.79 2.36 4.43 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 168.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -71.0 158.74 35.99 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.699 0.8 . . . . 0.0 111.802 173.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -64.26 149.96 46.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.664 0.786 . . . . 0.0 110.607 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 m 63.96 -18.61 0.07 Allowed 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 116.645 2.091 . . . . 0.0 116.645 -170.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -86.64 -47.13 9.44 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.476 1.11 . . . . 0.0 110.93 169.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 27.9 t . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 126.289 1.836 . . . . 0.0 110.86 176.785 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.4 t . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 121.101 0.476 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -66.23 -25.21 66.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.491 1.117 . . . . 0.0 113.398 -169.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 60.6 m -76.49 -3.14 35.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.586 1.554 . . . . 0.0 114.906 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 10.8 t 58.64 -42.45 0.06 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.865 3.266 . . . . 0.0 118.072 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 pp -104.87 -9.41 18.02 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.994 1.717 . . . . 0.0 114.333 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.4 t -74.07 138.9 44.29 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.403 0.62 . . . . 0.0 112.468 -172.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -155.19 142.26 19.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.509 1.924 . . . . 0.0 109.356 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.3 m 58.16 34.85 24.56 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt 54.86 34.8 22.85 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.332 1.853 . . . . 0.0 114.53 174.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -69.44 152.11 45.29 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.973 0.909 . . . . 0.0 111.342 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 49.77 6.84 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.827 2.451 . . . . 0.0 117.359 -173.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.0 m -80.4 -22.4 41.29 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -155.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -57.79 117.5 4.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.86 0.864 . . . . 0.0 111.433 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 55.76 20.9 4.31 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.093 1.757 . . . . 0.0 115.138 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -115.33 -44.14 3.01 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.096 1.758 . . . . 0.0 112.541 171.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m . . . . . 0 CA--C 1.553 1.093 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -176.957 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.4 t0 . . . . . 0 CA--C 1.546 0.809 0 CA-C-O 120.944 0.402 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 61.72 164.73 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.115 2.566 . . . . 0.0 114.409 -174.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 55.0 32.18 17.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.765 2.026 . . . . 0.0 113.63 -175.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -111.94 -3.79 14.73 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.31 1.844 . . . . 0.0 114.816 -171.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.9 149.6 48.71 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -171.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -139.49 152.56 69.2 Favored Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 127.15 2.18 . . . . 0.0 110.668 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -68.68 -29.09 30.13 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 122.983 2.456 . . . . 0.0 113.073 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.274 60.8 pttt 52.52 174.9 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.773 3.229 . . . . 0.0 117.459 173.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -151.51 158.22 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 127.204 2.201 . . . . 0.0 109.556 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.38 109.19 62.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 124.734 1.214 . . . . 0.0 109.926 174.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -71.09 -12.42 30.31 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.5 2.8 . . . . 0.0 114.83 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 50.4 t80 . . . . . 0 CA--C 1.548 0.897 0 C-N-CA 125.414 1.486 . . . . 0.0 113.591 -178.281 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 13.6 t . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -76.11 145.08 40.27 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.287 171.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.3 t30 63.21 -53.32 0.19 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.863 2.465 . . . . 0.0 115.341 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 93.7 m -69.85 134.56 48.61 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.222 1.809 . . . . 0.0 112.874 -174.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -72.16 -14.54 76.53 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 123.849 0.738 . . . . 0.0 114.279 172.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.07 -11.69 79.12 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 125.132 1.349 . . . . 0.0 116.068 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt 43.67 -85.22 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.795 2.838 . . . . 0.0 116.166 169.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -73.57 7.03 14.28 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 126.203 1.858 . . . . 0.0 116.546 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.429 ' C ' ' H ' ' A' ' 118' ' ' GLY . 0.3 OUTLIER -75.37 -158.07 0.08 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 119.072 1.436 . . . . 0.0 112.442 175.458 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -61.42 20.48 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.824 2.049 . . . . 0.0 115.056 169.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . 0.429 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -58.14 -16.5 26.66 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 127.635 2.541 . . . . 0.0 116.378 -170.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.37 -35.79 71.22 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.195 1.398 . . . . 0.0 113.373 172.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -117.94 -16.97 9.84 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.936 2.094 . . . . 0.0 113.193 -167.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 21.2 p . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -169.561 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.582 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.66 21.31 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 123.966 0.906 . . . . 0.0 112.98 165.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -79.55 -35.23 0.84 Allowed 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 122.304 2.003 . . . . 0.0 113.942 -178.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt 48.04 -166.19 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.211 1.005 . . . . 0.0 111.431 -151.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.9 m -57.93 158.09 7.0 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 120.513 -1.367 . . . . 0.0 111.926 163.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -66.38 97.0 0.39 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.185 -0.947 . . . . 0.0 110.032 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 61.28 -33.86 0.09 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.529 2.732 . . . . 0.0 117.543 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.8 p -81.54 -2.6 50.5 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -172.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.4 p 49.34 0.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 120.003 3.334 . . . . 0.0 120.003 170.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -118.84 125.75 50.25 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.643 1.565 . . . . 0.0 113.695 -169.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.263 39.6 ptt180 50.22 122.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 130.983 3.713 . . . . 0.0 118.744 167.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 66.85 -143.82 44.16 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 124.148 0.88 . . . . 0.0 114.107 173.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -6.3 97.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 129.318 3.047 . . . . 0.0 117.609 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -62.33 -176.64 0.11 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.23 1.412 . . . . 0.0 114.187 170.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.3 -67.47 0.22 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.404 1.882 . . . . 0.0 114.377 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -74.55 -1.13 20.08 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.807 1.643 . . . . 0.0 115.111 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -98.69 -33.21 11.03 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.665 1.586 . . . . 0.0 111.886 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.6 m -46.63 -39.98 18.03 Favored Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo . . . . . 0 CA--C 1.544 0.993 0 CA-C-N 122.372 1.883 . . . . 0.0 115.37 -178.923 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.0 pp . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.2 pt -83.53 122.77 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.578 1.151 . . . . 0.0 111.434 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 p -84.5 143.52 29.3 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.309 0.644 . . . . 0.0 111.054 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.7 p 44.35 23.25 0.06 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 127.306 2.242 . . . . 0.0 116.752 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 50.18 32.82 6.39 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 126.135 1.774 . . . . 0.0 114.724 -171.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 p -79.32 -25.9 42.28 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.425 -1.422 . . . . 0.0 113.766 -173.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.32 172.35 18.71 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.854 1.692 . . . . 0.0 111.879 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.52 148.28 29.26 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.531 0.732 . . . . 0.0 110.99 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 t -66.02 -17.8 64.92 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.006 -1.059 . . . . 0.0 113.723 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.21 -4.53 29.29 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.202 1.401 . . . . 0.0 113.882 172.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -153.62 89.84 1.36 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 0.0 111.291 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -155.33 126.23 7.04 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.467 1.507 . . . . 0.0 109.426 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -149.7 152.9 36.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.473 0.709 . . . . 0.0 112.818 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.6 m -63.88 -26.35 68.57 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -168.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -103.21 145.81 29.36 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.816 0.847 . . . . 0.0 110.507 156.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.5 m170 67.46 -12.93 0.25 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.328 2.251 . . . . 0.0 116.48 -173.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.313 2.8 t 21.56 -75.6 0.0 OUTLIER Pre-proline 0 CA--C 1.56 1.351 0 C-N-CA 129.841 3.256 . . . . 0.0 118.409 152.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -79.47 -9.07 14.96 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.872 3.048 . . . . 0.0 116.555 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -86.04 22.63 1.68 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.499 1.52 . . . . 0.0 114.921 -166.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.62 0.14 9.82 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 38.4 mm -101.33 39.87 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 125.009 1.324 . . . . 0.0 109.559 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -151.46 160.33 43.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.237 1.415 . . . . 0.0 112.176 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 38.6 t -102.82 166.99 10.15 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.797 1.639 . . . . 0.0 110.602 170.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.7 m -50.97 135.01 25.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.328 1.051 . . . . 0.0 112.413 170.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.302 22.2 ptmt 47.74 22.36 0.34 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.127 2.171 . . . . 0.0 116.13 -170.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 58.0 m -118.61 154.82 32.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.226 1.811 . . . . 0.0 110.54 172.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -102.61 -6.05 23.19 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.762 1.225 . . . . 0.0 113.774 171.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -138.58 178.83 6.85 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.346 2.258 . . . . 0.0 109.187 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.8 m -75.54 58.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 120.423 -1.423 . . . . 0.0 110.686 165.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.76 -5.9 88.98 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 118.534 2.174 . . . . 0.0 118.534 -147.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -147.67 160.48 42.64 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.851 1.825 . . . . 0.0 112.4 177.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 38.1 t80 57.02 116.37 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.658 2.383 . . . . 0.0 115.459 -176.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 48.65 22.84 0.56 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 126.632 1.973 . . . . 0.0 114.329 -175.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.1 m 51.6 30.28 6.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 114.962 -170.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -143.17 -17.36 0.65 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.039 1.335 . . . . 0.0 113.887 -170.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 60.7 m . . . . . 0 CA--C 1.557 1.231 0 C-N-CA 124.43 1.092 . . . . 0.0 110.622 -161.995 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.304 7.5 p . . . . . 0 N--CA 1.488 1.427 0 N-CA-C 116.189 1.922 . . . . 0.0 116.189 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -69.66 -4.51 19.78 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.485 -1.384 . . . . 0.0 114.728 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.1 m -146.72 131.52 18.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.728 1.611 . . . . 0.0 111.974 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.6 t -52.22 -34.53 46.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.996 0.918 . . . . 0.0 112.924 163.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.91 -18.41 65.37 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.275 1.43 . . . . 0.0 114.66 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 55.8 m -88.48 6.73 36.32 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -50.97 109.28 0.31 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.902 1.281 . . . . 0.0 110.284 163.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.6 m 55.44 21.96 4.68 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -152.28 142.99 22.87 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.137 1.775 . . . . 0.0 110.667 -178.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.1 ttmm -128.01 134.88 49.28 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.585 1.154 . . . . 0.0 112.138 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -138.12 15.18 2.83 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.683 1.593 . . . . 0.0 113.548 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.9 m -66.75 -32.78 74.3 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -151.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -65.14 -23.68 67.19 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.152 0.981 . . . . 0.0 113.339 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -100.06 -17.53 17.43 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.044 1.338 . . . . 0.0 113.964 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -133.87 -36.28 0.94 Allowed 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -167.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m . . . . . 0 CA--C 1.543 0.698 0 CA-C-N 119.716 1.143 . . . . 0.0 112.342 -169.406 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -116.83 7.69 13.41 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.885 1.274 . . . . 0.0 114.317 -171.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -136.21 148.26 48.02 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.101 1.36 . . . . 0.0 111.524 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -135.67 143.99 45.76 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.742 2.017 . . . . 0.0 112.224 -172.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -92.47 161.01 14.8 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.511 1.124 . . . . 0.0 111.71 169.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -132.96 59.27 41.53 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 125.009 1.324 . . . . 0.0 112.905 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -71.31 144.82 46.89 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.09 2.527 . . . . 0.0 112.483 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -153.06 150.12 28.82 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.214 1.806 . . . . 0.0 111.163 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 44.4 t -131.86 136.35 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.472 1.509 . . . . 0.0 110.374 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.5 mt -132.81 94.64 20.9 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 125.994 1.717 . . . . 0.0 109.855 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -65.62 140.38 62.18 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 123.476 2.784 . . . . 0.0 114.563 -174.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 23.0 t80 . . . . . 0 CA--C 1.545 0.775 0 C-N-CA 125.826 1.65 . . . . 0.0 111.436 174.174 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 34.7 t . . . . . 0 CA--C 1.548 0.892 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -154.85 -16.96 0.12 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.6 m-20 -67.69 -18.4 64.91 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -172.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 19.1 p -134.12 32.32 3.46 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.843 1.257 . . . . 0.0 114.383 -173.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 81.55 16.06 74.39 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.699 1.44 . . . . 0.0 116.699 164.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -154.87 151.31 22.96 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.96 1.267 . . . . 0.0 112.026 176.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.18 -35.61 5.84 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 -168.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.58 11.96 50.48 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -171.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.267 1.2 p80 -99.89 -137.05 0.31 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.911 1.356 . . . . 0.0 114.078 -168.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -74.34 35.7 0.1 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 127.669 2.388 . . . . 0.0 113.139 -169.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.0 -18.35 8.79 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 128.05 2.738 . . . . 0.0 115.79 -172.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.21 -40.51 94.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.529 1.532 . . . . 0.0 113.304 170.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -130.51 -22.73 2.69 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -165.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 16.2 p . . . . . 0 CA--C 1.55 0.944 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -165.921 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.64 -46.54 60.79 Favored Pre-proline 0 CA--C 1.554 1.117 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 168.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -79.25 -42.37 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.931 0 C-N-CA 122.262 1.975 . . . . 0.0 114.093 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? 57.69 -56.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.923 2.889 . . . . 0.0 116.285 -171.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.8 t -156.96 160.02 38.65 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.58 2.352 . . . . 0.0 110.925 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -72.64 -24.57 61.07 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.026 -1.047 . . . . 0.0 113.703 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -159.28 -37.65 0.06 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.256 1.423 . . . . 0.0 112.978 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.9 m -77.3 -163.88 0.42 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.59 1.156 . . . . 0.0 111.489 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 78.2 p -136.73 19.31 3.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -115.56 143.57 45.13 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.318 1.047 . . . . 0.0 112.47 172.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ptt85 -78.69 -3.18 42.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.43 -20.82 71.98 Favored Glycine 0 CA--C 1.537 1.463 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -176.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.43 89.72 1.52 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.846 1.258 . . . . 0.0 112.14 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -60.96 -179.55 0.14 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.884 1.674 . . . . 0.0 113.445 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.31 -65.08 0.37 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 126.354 1.862 . . . . 0.0 114.675 -171.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ptmm? -76.21 -9.7 58.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 126.329 1.852 . . . . 0.0 115.303 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.17 -20.48 17.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.263 1.425 . . . . 0.0 112.723 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -66.0 -51.06 49.01 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 124.644 1.178 . . . . 0.0 113.835 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo . . . . . 0 C--N 1.353 0.773 0 C-N-CA 122.282 1.988 . . . . 0.0 112.481 174.532 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 CA--C 1.546 0.82 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.5 pt -73.14 161.66 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 126.631 1.972 . . . . 0.0 112.908 172.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 59.5 m -77.77 7.05 6.3 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m 64.24 130.64 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.453 2.301 . . . . 0.0 114.57 -164.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 52.18 25.76 3.5 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.707 1.603 . . . . 0.0 114.261 -172.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.2 t -153.93 113.01 3.71 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.444 1.897 . . . . 0.0 108.6 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.55 174.19 45.89 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.917 1.246 . . . . 0.0 115.441 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.67 139.11 47.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.342 1.457 . . . . 0.0 109.55 166.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.5 t -64.01 -22.93 67.14 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -89.07 -14.19 36.93 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -151.01 95.07 2.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.386 1.475 . . . . 0.0 111.707 -172.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -155.47 134.67 12.28 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -158.12 160.96 37.87 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.342 1.457 . . . . 0.0 110.6 172.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -58.47 -28.63 65.52 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.063 1.745 . . . . 0.0 115.055 -175.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -72.6 -24.89 61.15 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.794 1.238 . . . . 0.0 113.367 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -122.05 -0.58 9.45 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.524 1.529 . . . . 0.0 114.414 -171.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -25.03 -60.06 0.14 Allowed Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 129.034 2.934 . . . . 0.0 117.665 -177.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -80.49 54.51 5.26 Favored 'Trans proline' 0 CA--C 1.55 1.291 0 C-N-CA 123.571 2.847 . . . . 0.0 114.298 -168.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.41 171.53 8.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.608 1.963 . . . . 0.0 113.533 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.67 -60.89 0.17 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 128.565 2.746 . . . . 0.0 116.622 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.2 mt -106.93 49.2 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 123.245 1.498 . . . . 0.0 110.261 -164.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.0 mm-40 -148.19 165.15 31.77 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.939 2.496 . . . . 0.0 109.725 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 10.6 p -126.0 124.38 40.58 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.529 1.132 . . . . 0.0 111.405 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.4 p -71.32 -16.12 62.43 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -165.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -93.05 -13.02 29.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.578 1.151 . . . . 0.0 113.269 176.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.3 t -143.3 -20.79 0.62 Allowed 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -157.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 60.58 141.5 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 128.114 2.566 . . . . 0.0 114.666 -162.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.284 10.5 pt-20 46.54 126.23 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 131.298 3.839 . . . . 0.0 119.225 -175.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.47 -12.15 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 119.08 -2.262 . . . . 0.0 112.04 163.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.43 4.94 3.37 Favored Glycine 0 CA--C 1.541 1.715 0 C-N-CA 126.43 1.967 . . . . 0.0 116.986 -177.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.26 169.87 14.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.732 1.613 . . . . 0.0 112.075 173.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 53.42 88.21 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.055 1.742 . . . . 0.0 112.926 -172.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 53.64 26.05 5.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 126.349 1.86 . . . . 0.0 114.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.6 m 55.12 23.04 4.96 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.645 1.578 . . . . 0.0 114.733 -172.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -141.35 -17.05 0.81 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.288 1.435 . . . . 0.0 114.022 -169.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 35.4 m . . . . . 0 CA--C 1.555 1.141 0 C-N-CA 125.827 1.651 . . . . 0.0 114.09 -154.789 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.4 m . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 pp0? -68.17 -19.65 64.81 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -168.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.8 m -76.13 -20.23 57.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 172.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 61.47 -28.47 0.06 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.105 2.162 . . . . 0.0 115.155 -156.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 44.7 mt -89.72 -15.82 31.69 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.397 1.879 . . . . 0.0 114.533 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -176.25 2.47 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -174.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.7 tptt 66.7 -24.59 0.11 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 128.217 2.607 . . . . 0.0 115.177 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.8 t -73.59 150.9 41.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.815 1.246 . . . . 0.0 113.312 168.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -70.23 -22.44 62.9 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.612 1.965 . . . . 0.0 114.178 177.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -75.95 -44.1 41.62 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.345 1.058 . . . . 0.0 113.136 -175.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -77.05 -42.95 36.32 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -165.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.1 m -76.42 -11.59 59.91 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.184 1.92 . . . . 0.0 116.184 -158.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -51.52 124.7 12.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.292 1.437 . . . . 0.0 112.029 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . 0.285 10.0 pt-20 49.97 4.6 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 128.909 2.884 . . . . 0.0 118.486 -178.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -124.58 -24.23 4.24 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.198 1.399 . . . . 0.0 114.605 -177.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 86.5 m . . . . . 0 CA--C 1.549 0.918 0 C-N-CA 124.921 1.288 . . . . 0.0 112.007 168.232 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -79.98 151.36 30.07 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.553 1.141 . . . . 0.0 112.251 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -138.5 139.82 38.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.409 1.484 . . . . 0.0 111.716 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -108.58 150.12 27.94 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.817 1.647 . . . . 0.0 110.85 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -101.5 -16.18 16.89 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -82.34 137.64 45.38 Favored Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 124.023 0.929 . . . . 0.0 111.204 176.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.32 160.35 50.19 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.871 2.381 . . . . 0.0 113.081 173.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -85.02 -26.53 27.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.179 1.791 . . . . 0.0 112.949 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.7 t -124.46 145.53 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.997 1.719 . . . . 0.0 110.543 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -120.05 164.76 20.58 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 126.053 1.741 . . . . 0.0 111.739 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -58.28 156.48 30.12 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.821 3.014 . . . . 0.0 115.787 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 . . . . . 0 CA--C 1.542 0.659 0 C-N-CA 125.768 1.627 . . . . 0.0 112.799 -179.446 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 CA--C 1.549 0.924 0 CA-C-O 121.762 0.791 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -61.49 -9.3 5.45 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -176.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -64.96 -22.06 66.94 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.398 1.079 . . . . 0.0 113.119 170.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 95.6 m -105.95 176.03 5.3 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.972 2.109 . . . . 0.0 112.354 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.05 -7.76 38.98 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 124.937 1.256 . . . . 0.0 115.712 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -159.54 154.13 25.18 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.427 1.489 . . . . 0.0 112.47 172.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -86.16 -22.08 27.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -77.99 33.16 1.71 Allowed Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.825 1.679 . . . . 0.0 117.149 -163.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.99 151.17 31.7 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.827 1.314 . . . . 0.0 113.108 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 44.39 28.74 0.32 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.359 2.264 . . . . 0.0 116.905 154.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.93 -18.45 59.88 Favored Glycine 0 CA--C 1.536 1.348 0 O-C-N 121.017 -1.052 . . . . 0.0 114.898 -167.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.32 -46.42 41.09 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.37 1.468 . . . . 0.0 113.483 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -111.44 -20.85 12.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.764 1.626 . . . . 0.0 114.463 -162.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -170.721 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.698 0 CA-C-O 121.269 0.557 . . . . 0.0 112.221 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.97 -51.64 79.17 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 171.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.75 -35.44 0.53 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.482 2.122 . . . . 0.0 113.993 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.401 0.0 OUTLIER 51.87 -53.64 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 130.138 3.375 . . . . 0.0 117.482 -168.608 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 m -163.56 165.82 23.17 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 131.564 3.946 . . . . 0.0 109.623 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -72.84 -94.8 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.901 -1.125 . . . . 0.0 112.502 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -90.22 -22.3 21.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.527 1.131 . . . . 0.0 111.476 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -67.17 166.77 13.39 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.713 1.605 . . . . 0.0 110.792 165.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.5 p -134.52 15.56 3.71 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -165.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -84.14 164.28 19.27 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.693 0.797 . . . . 0.0 112.312 174.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.6 mtt-85 -91.67 111.82 23.49 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 170.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.25 152.33 16.34 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.522 1.534 . . . . 0.0 112.586 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.363 13.3 p-80 51.53 62.87 2.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-O 123.438 1.589 . . . . 0.0 111.644 -161.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -170.42 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.387 1.875 . . . . 0.0 114.391 -175.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -34.94 -64.75 0.25 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.504 1.922 . . . . 0.0 114.522 -169.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -74.68 -11.17 60.11 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.151 1.78 . . . . 0.0 115.437 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -99.98 -13.63 19.01 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.376 1.87 . . . . 0.0 113.635 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.9 m -65.1 167.32 10.05 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.74 1.216 . . . . 0.0 112.274 159.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 CA--C 1.54 0.815 0 C-N-CA 124.147 3.231 . . . . 0.0 114.759 176.586 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.8 pp . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.1 mt -68.76 127.23 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.121 1.369 . . . . 0.0 110.331 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.0 p -62.43 128.37 35.7 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 121.897 0.856 . . . . 0.0 112.204 -175.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.9 m 51.32 14.56 0.24 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.3 t80 45.65 35.89 2.37 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.777 1.631 . . . . 0.0 113.359 -166.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 p -86.5 -14.44 43.07 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.96 -173.0 18.55 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 114.977 0.751 . . . . 0.0 114.977 -174.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.0 -176.89 1.2 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.956 0.902 . . . . 0.0 111.731 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -119.69 -40.86 2.72 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 173.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -79.61 -24.84 41.69 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.3 p30 -133.39 32.96 3.6 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.304 1.842 . . . . 0.0 112.652 174.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 23.1 t-160 -46.42 -55.14 7.84 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.48 2.712 . . . . 0.0 115.427 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.23 -43.58 56.5 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 m -70.12 -16.71 63.15 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -167.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -77.72 22.78 0.25 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.682 1.593 . . . . 0.0 113.289 172.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.8 m80 50.99 58.2 5.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.83 1.252 . . . . 0.0 111.258 -163.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.348 32.2 t 34.38 -90.75 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 129.379 3.072 . . . . 0.0 115.93 176.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -73.13 -5.72 17.67 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 123.327 2.685 . . . . 0.0 115.768 -175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -90.5 36.05 0.88 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.471 1.508 . . . . 0.0 113.536 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -131.14 -13.71 3.49 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 117.188 2.292 . . . . 0.0 117.188 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.1 mm -120.18 45.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-N 120.49 1.496 . . . . 0.0 110.473 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.76 158.29 43.96 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 120.65 -1.281 . . . . 0.0 112.888 166.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 43.4 t -55.02 155.77 4.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.143 2.177 . . . . 0.0 112.064 169.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -62.22 -28.47 69.71 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.621 -1.3 . . . . 0.0 114.423 -174.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -131.74 4.11 4.19 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.74 1.616 . . . . 0.0 113.987 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 m -135.3 158.82 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.094 1.358 . . . . 0.0 111.333 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -88.56 0.19 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -160.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -122.49 153.08 39.63 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.954 -1.091 . . . . 0.0 113.375 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.6 t -6.32 -60.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.241 1 C-N-CA 132.581 4.352 . . . . 0.0 119.021 -167.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.03 165.26 32.61 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 124.872 1.225 . . . . 0.0 112.238 -169.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -79.62 9.48 4.96 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 116.717 2.118 . . . . 0.0 116.717 -159.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -61.27 151.34 32.08 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.503 -1.373 . . . . 0.0 112.301 174.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -0.02 1.48 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -175.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.8 p -127.47 3.63 6.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.368 1.867 . . . . 0.0 113.289 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -119.4 -27.23 5.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.266 1.826 . . . . 0.0 112.733 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 19.8 t . . . . . 0 CA--C 1.555 1.157 0 C-N-CA 125.932 1.693 . . . . 0.0 111.569 169.503 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.293 2.2 p . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 54.36 0.85 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.54 2.336 . . . . 0.0 116.264 -170.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.3 m -145.02 144.8 31.2 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.61 1.096 . . . . 0.0 112.662 -169.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.0 t -77.65 -24.62 49.38 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.674 0.79 . . . . 0.0 113.124 161.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.9 mt -74.55 -15.74 60.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.906 1.283 . . . . 0.0 113.966 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 87.4 m -112.51 159.39 18.83 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.671 1.189 . . . . 0.0 112.866 -169.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -126.27 154.09 43.87 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.086 1.754 . . . . 0.0 110.368 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 p -51.93 137.01 27.58 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.379 1.071 . . . . 0.0 112.483 176.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.304 8.8 ptpp? 48.23 20.23 0.26 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 127.978 2.511 . . . . 0.0 116.775 -171.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -133.59 30.95 3.75 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.894 2.078 . . . . 0.0 112.698 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -73.22 171.94 12.05 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.876 0.87 . . . . 0.0 112.809 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.2 m 66.59 -7.04 0.46 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 127.989 2.516 . . . . 0.0 117.532 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -53.66 151.21 6.29 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.587 1.555 . . . . 0.0 112.25 171.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 51.85 37.83 21.73 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.301 1.44 . . . . 0.0 113.135 -174.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? 53.44 62.59 2.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.761 2.025 . . . . 0.0 112.256 -177.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.561 1.377 0 C-N-CA 125.762 1.625 . . . . 0.0 114.322 177.674 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 51.9 30.41 7.14 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.372 1.869 . . . . 0.0 114.726 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -144.27 152.11 40.34 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.068 1.747 . . . . 0.0 111.146 -175.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -143.68 153.5 42.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.439 1.896 . . . . 0.0 112.915 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.38 -15.04 56.46 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -106.92 126.58 29.88 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 124.924 1.289 . . . . 0.0 112.215 -174.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -80.41 166.71 19.91 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.646 2.897 . . . . 0.0 112.583 173.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -138.69 125.23 20.64 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.653 1.581 . . . . 0.0 109.863 167.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.0 t -104.01 -35.74 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -162.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.1 tp -143.68 127.57 9.21 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.782 1.233 . . . . 0.0 110.757 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -91.2 -13.92 1.87 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.118 2.546 . . . . 0.0 114.415 -177.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 41.9 t80 . . . . . 0 N--CA 1.472 0.637 0 C-N-CA 125.028 1.331 . . . . 0.0 112.855 -171.741 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.9 m . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -77.35 -10.21 59.31 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 120.847 -1.158 . . . . 0.0 113.803 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -110.32 -20.63 12.56 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.0 p -154.79 164.89 38.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.239 1.016 . . . . 0.0 113.087 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -67.92 123.3 18.22 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.013 0.815 . . . . 0.0 113.994 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.78 142.26 1.08 Allowed Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.746 1.641 . . . . 0.0 114.514 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -80.28 56.38 2.47 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.935 1.694 . . . . 0.0 112.614 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -76.11 -12.38 84.13 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.177 1.37 . . . . 0.0 116.434 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -144.6 -161.29 1.26 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.028 1.414 . . . . 0.0 112.452 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -70.24 44.37 0.07 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.427 2.291 . . . . 0.0 113.023 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -43.84 -19.67 0.12 Allowed Glycine 0 CA--C 1.532 1.094 1 C-N-CA 131.359 4.314 . . . . 0.0 118.452 -170.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.78 -38.81 89.45 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.401 1.601 . . . . 0.0 112.352 169.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -112.44 -14.14 13.29 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.648 1.979 . . . . 0.0 113.007 171.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.543 0.695 0 C-N-CA 127.357 2.263 . . . . 0.0 114.78 166.145 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 120.866 0.365 . . . . 0.0 111.731 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.96 -52.18 1.61 Allowed Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.328 1.051 . . . . 0.0 112.947 165.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.14 -36.49 1.88 Allowed 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.763 2.308 . . . . 0.0 114.556 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 60.92 -64.84 0.06 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 127.91 2.484 . . . . 0.0 114.368 -169.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.5 t -159.55 161.29 35.21 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 128.416 2.686 . . . . 0.0 110.368 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -68.26 -35.45 77.91 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.063 -1.023 . . . . 0.0 112.933 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -145.4 -62.83 0.34 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 p -87.76 95.94 10.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.601 1.161 . . . . 0.0 111.934 -176.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.0 p -71.66 63.53 0.43 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 128.373 2.669 . . . . 0.0 115.887 -168.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 pp0? -121.09 148.16 44.55 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 127.376 2.27 . . . . 0.0 110.545 165.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.8 mtm180 -73.07 136.26 44.94 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.639 0.776 . . . . 0.0 111.727 -172.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 147.07 -37.67 1.15 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.798 1.19 . . . . 0.0 113.79 176.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -139.72 101.06 4.11 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.179 0.991 . . . . 0.0 112.992 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.86 -178.69 0.33 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.557 1.143 . . . . 0.0 112.938 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.83 -66.21 0.35 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.945 1.698 . . . . 0.0 113.802 -171.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -74.34 -11.1 60.16 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.865 1.431 . . . . 0.0 114.865 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -85.64 -26.76 25.83 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.347 1.059 . . . . 0.0 112.263 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.2 t -59.1 -42.34 93.06 Favored Pre-proline 0 CA--C 1.557 1.235 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo . . . . . 0 C--N 1.357 0.988 0 C-N-CA 122.442 2.095 . . . . 0.0 114.389 -173.369 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.4 pp . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 mt -113.86 145.36 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.163 1.385 . . . . 0.0 111.595 -170.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.7 t -43.22 117.47 1.11 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.853 2.061 . . . . 0.0 114.136 -174.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.7 m 51.58 20.34 1.04 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.661 1.984 . . . . 0.0 116.245 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.9 t80 52.15 26.38 3.85 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 125.298 1.439 . . . . 0.0 113.789 -167.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.4 p -115.48 -25.86 7.76 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.945 1.698 . . . . 0.0 113.627 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -96.99 155.5 20.74 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.688 1.613 . . . . 0.0 113.779 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -109.92 142.54 41.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.437 1.095 . . . . 0.0 110.849 166.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -59.62 -26.18 65.26 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.413 1.485 . . . . 0.0 114.875 -168.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.16 1.27 28.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -140.91 -13.59 0.94 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 115.931 1.826 . . . . 0.0 115.931 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -64.24 138.57 58.5 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.868 -1.145 . . . . 0.0 113.409 -176.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.46 133.75 46.56 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.799 1.639 . . . . 0.0 110.227 171.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.9 t -58.67 -29.68 66.77 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 171.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -62.93 -25.19 68.22 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.627 1.571 . . . . 0.0 114.087 174.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -131.64 -16.29 3.01 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -165.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.46 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.346 2.1 m 41.22 -98.18 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 128.057 2.543 . . . . 0.0 115.927 178.59 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.46 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 19.9 Cg_exo -77.33 -3.38 13.61 Favored 'Trans proline' 0 C--N 1.36 1.146 0 CA-C-N 123.544 2.301 . . . . 0.0 117.626 -155.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.75 -3.96 2.75 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -171.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.3 -23.38 17.23 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.031 1.332 . . . . 0.0 114.148 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.5 mt -128.51 -15.75 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.266 1.427 . . . . 0.0 112.623 -176.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -128.81 173.28 10.5 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.725 -1.234 . . . . 0.0 111.625 155.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 28.0 p -117.3 -176.67 3.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.51 1.524 . . . . 0.0 110.392 167.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.1 p -75.99 -17.93 59.5 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -176.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -96.1 -31.81 12.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.571 1.148 . . . . 0.0 113.768 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -156.09 167.56 30.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.795 1.238 . . . . 0.0 112.263 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.96 18.38 0.18 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.378 1.871 . . . . 0.0 114.853 -169.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -132.09 158.12 42.42 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.86 1.664 . . . . 0.0 112.359 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.99 121.75 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 125.032 1.333 . . . . 0.0 113.465 -165.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 54.44 -150.77 15.58 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 124.786 1.184 . . . . 0.0 115.776 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.3 m80 -139.46 10.37 2.5 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.096 1.358 . . . . 0.0 113.705 170.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -72.09 148.98 45.22 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.129 -0.982 . . . . 0.0 112.146 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.0 tpt85 -60.68 -23.21 64.65 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.715 1.606 . . . . 0.0 114.266 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -90.92 -8.09 50.32 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.287 1.835 . . . . 0.0 114.45 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -119.61 -42.14 2.65 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.966 1.306 . . . . 0.0 113.944 -171.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 CA--C 1.543 0.687 0 C-N-CA 123.891 0.876 . . . . 0.0 112.211 -171.785 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -12.27 33.5 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.4 m -87.15 99.91 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.428 0.691 . . . . 0.0 112.451 -172.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.4 p 33.23 -79.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 117.483 2.401 . . . . 0.0 117.483 136.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 pp -109.65 -10.03 14.84 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.63 2.772 . . . . 0.0 114.729 -170.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.26 161.39 26.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.423 1.089 . . . . 0.0 113.1 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -125.73 148.31 49.1 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.157 1.783 . . . . 0.0 109.662 171.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.8 p -58.33 137.22 57.35 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.476 1.511 . . . . 0.0 112.197 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.4 tttt 53.45 23.55 3.47 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.294 1.837 . . . . 0.0 114.798 -174.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -132.14 12.07 4.65 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.19 1.396 . . . . 0.0 114.386 -175.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -147.83 171.1 16.25 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.904 0.882 . . . . 0.0 111.966 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.9 t -129.26 153.6 47.63 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . 0.446 ' C ' ' H ' ' A' ' 79' ' ' ARG . 56.7 mtmt -66.33 -4.23 7.56 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.851 2.06 . . . . 0.0 114.046 165.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -66.99 43.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 126.54 1.936 . . . . 0.0 111.676 155.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . 0.446 ' H ' ' C ' ' A' ' 77' ' ' LYS . 62.9 mmt-85 48.94 50.4 17.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 129.829 3.252 . . . . 0.0 115.423 175.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m . . . . . 0 CA--C 1.556 1.193 0 C-N-CA 126.118 1.767 . . . . 0.0 115.602 166.663 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -123.04 157.43 32.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.142 1.377 . . . . 0.0 112.944 -173.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 60.96 161.47 0.06 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.776 2.431 . . . . 0.0 116.305 -177.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -129.19 161.3 30.45 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.597 2.359 . . . . 0.0 110.574 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -136.01 152.91 51.41 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.316 1.046 . . . . 0.0 113.182 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.49 158.6 60.12 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.594 2.358 . . . . 0.0 110.435 170.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.45 154.58 58.11 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.129 2.553 . . . . 0.0 114.103 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -87.44 22.49 2.16 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.804 1.642 . . . . 0.0 113.105 174.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -149.85 150.61 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 127.218 2.207 . . . . 0.0 110.008 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -130.16 146.31 61.0 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.252 1.421 . . . . 0.0 111.214 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.03 -13.72 19.24 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.81 3.007 . . . . 0.0 114.127 -176.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 31.9 t80 . . . . . 0 CA--C 1.547 0.838 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -172.913 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 120.954 0.407 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -137.46 11.54 2.98 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.898 1.279 . . . . 0.0 112.925 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -142.88 158.18 43.87 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.415 1.886 . . . . 0.0 110.157 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 p 52.64 -5.4 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 119.684 3.216 . . . . 0.0 119.684 173.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.68 -167.94 39.66 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.29 1.424 . . . . 0.0 114.002 -178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.77 161.78 48.79 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.648 1.118 . . . . 0.0 113.954 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -65.28 -19.0 65.76 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -166.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.27 -37.22 15.45 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 116.293 1.277 . . . . 0.0 116.293 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.28 141.77 30.71 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.382 1.591 . . . . 0.0 115.016 -164.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 37.71 31.78 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 129.486 3.114 . . . . 0.0 117.17 164.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.54 -11.41 41.51 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.302 1.43 . . . . 0.0 115.441 -165.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.16 -35.27 73.88 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.671 1.588 . . . . 0.0 113.747 173.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -143.99 -27.54 0.53 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -159.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.0 p . . . . . 0 N--CA 1.475 0.775 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -175.744 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -45.64 -47.44 38.15 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 173.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 -40.36 0.33 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 122.056 1.838 . . . . 0.0 114.067 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm 40.63 -158.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.693 1.197 . . . . 0.0 111.773 -146.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.1 t -59.77 157.7 11.69 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.408 -1.433 . . . . 0.0 112.834 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -63.58 -35.8 81.68 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.272 -0.892 . . . . 0.0 111.763 168.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -150.15 -48.08 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -166.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 55.6 m -70.25 -40.24 74.52 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.743 1.156 . . . . 0.0 113.924 -170.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.8 m 56.8 21.71 6.28 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 117.446 2.387 . . . . 0.0 117.446 176.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -129.26 8.55 5.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.313 1.445 . . . . 0.0 112.9 175.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -143.49 150.68 39.32 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.629 1.572 . . . . 0.0 111.707 -172.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -68.31 -10.83 60.65 Favored Glycine 0 CA--C 1.533 1.215 0 N-CA-C 116.19 1.236 . . . . 0.0 116.19 -170.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.58 92.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.124 1.462 . . . . 0.0 112.432 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -59.02 175.57 0.27 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.089 1.356 . . . . 0.0 113.169 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -32.79 -68.98 0.09 Allowed 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 126.751 2.02 . . . . 0.0 114.45 -173.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -78.49 -8.03 58.1 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -27.32 26.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.046 1.339 . . . . 0.0 111.821 171.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.09 139.49 95.99 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.257 1.423 . . . . 0.0 112.013 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 CA--C 1.541 0.844 0 C-N-CA 123.574 2.849 . . . . 0.0 114.995 178.107 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.0 pt . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 121.105 0.479 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.9 mt 54.69 22.97 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 126.678 1.991 . . . . 0.0 113.585 175.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.1 m 46.82 27.58 0.71 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.136 1.774 . . . . 0.0 114.616 -174.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . 0.299 5.7 p 42.07 79.58 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.588 1.955 . . . . 0.0 113.315 -162.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 68.54 17.09 9.08 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.454 2.702 . . . . 0.0 116.984 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -109.09 66.1 0.63 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 108.434 164.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 164.29 -162.6 35.45 Favored Glycine 0 CA--C 1.524 0.631 0 O-C-N 121.195 -0.94 . . . . 0.0 114.0 173.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -136.41 158.03 45.39 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.617 1.567 . . . . 0.0 108.597 163.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.5 t -67.41 -24.76 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -175.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -119.63 -39.09 2.9 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -107.82 61.95 0.61 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.153 0.981 . . . . 0.0 112.959 -171.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -153.76 134.95 14.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.241 1.416 . . . . 0.0 111.031 -176.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -156.12 171.22 20.53 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.227 1.011 . . . . 0.0 112.648 -172.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -53.69 -32.08 50.38 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.083 1.753 . . . . 0.0 114.564 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -84.9 -8.96 58.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.015 1.726 . . . . 0.0 113.649 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -131.78 -0.55 3.85 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.839 1.656 . . . . 0.0 114.699 -170.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 t -27.96 -52.84 0.24 Allowed Pre-proline 0 CA--C 1.557 1.222 0 C-N-CA 127.969 2.508 . . . . 0.0 117.25 -175.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -65.41 -18.49 60.17 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 122.701 2.267 . . . . 0.0 116.167 -178.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -73.16 128.08 34.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.782 1.233 . . . . 0.0 110.692 174.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.73 138.96 21.3 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -172.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 35.9 mm 58.38 139.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 130.51 3.524 . . . . 0.0 116.709 165.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -162.24 158.94 25.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.345 1.858 . . . . 0.0 112.858 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.6 t -99.49 162.34 13.09 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.079 1.352 . . . . 0.0 110.14 159.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.5 p -56.2 140.46 44.39 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 120.938 -1.101 . . . . 0.0 111.692 177.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt 56.94 6.71 0.34 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.639 1.976 . . . . 0.0 115.687 -174.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.5 m -93.85 -36.44 12.24 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.225 1.01 . . . . 0.0 112.523 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 60.01 -20.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 128.087 2.555 . . . . 0.0 116.769 -176.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -136.58 127.58 27.72 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.959 2.103 . . . . 0.0 110.021 162.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.274 13.5 m 40.78 -62.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.026 1 C-N-CA 132.575 4.35 . . . . 0.0 118.949 178.943 . . . . . . . . 3 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 166.26 155.37 8.8 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.981 1.276 . . . . 0.0 114.051 -172.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -77.26 113.64 15.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.287 1.435 . . . . 0.0 112.602 175.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.6 t80 66.02 154.53 0.08 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.794 2.038 . . . . 0.0 115.662 -173.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 48.84 16.49 0.12 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 128.383 2.673 . . . . 0.0 114.982 -167.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.0 m 50.13 28.23 2.94 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.119 1.768 . . . . 0.0 114.515 -170.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -157.94 -14.79 0.08 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 115.861 1.8 . . . . 0.0 115.861 -174.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 CA--C 1.556 1.192 0 C-N-CA 127.793 2.437 . . . . 0.0 115.998 -172.897 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -81.02 -19.07 44.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.481 1.112 . . . . 0.0 113.076 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.0 m -97.89 148.35 23.52 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.042 0.937 . . . . 0.0 111.943 178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.2 t -74.72 -35.21 62.67 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -95.23 -25.2 16.46 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -171.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.72 147.06 39.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.92 0.888 . . . . 0.0 112.853 -169.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -103.85 -31.4 9.8 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.608 1.163 . . . . 0.0 112.676 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.4 m -79.57 160.67 26.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.291 1.036 . . . . 0.0 113.542 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.49 163.7 22.1 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.857 1.663 . . . . 0.0 112.712 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.4 tppt? 56.53 31.25 18.67 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.467 1.907 . . . . 0.0 113.385 -173.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -89.72 158.84 17.37 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.724 1.609 . . . . 0.0 113.265 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.4 p -162.37 -65.27 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 176.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -56.04 147.64 19.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.7 2.0 . . . . 0.0 113.718 -161.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 55.93 27.31 10.92 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.851 1.66 . . . . 0.0 113.72 -171.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.5 mmt85 50.38 50.65 18.33 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 126.526 1.93 . . . . 0.0 111.917 -169.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m . . . . . 0 CA--C 1.549 0.93 0 C-N-CA 129.096 2.958 . . . . 0.0 113.681 -162.075 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.9 t70 . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.85 107.3 13.54 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.26 -0.9 . . . . 0.0 110.988 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.71 -11.54 59.61 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -173.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -121.27 119.44 32.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.435 1.494 . . . . 0.0 111.343 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -138.81 19.87 2.67 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.838 1.655 . . . . 0.0 112.136 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -91.77 153.33 43.74 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 126.203 1.801 . . . . 0.0 113.172 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.94 164.61 35.1 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.26 2.64 . . . . 0.0 112.943 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -123.76 168.31 12.88 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.604 1.962 . . . . 0.0 111.373 174.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.31 -2.3 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -168.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -104.16 144.82 29.47 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.882 1.273 . . . . 0.0 113.738 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -82.59 169.42 13.72 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.093 3.196 . . . . 0.0 113.94 -176.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 40.1 t80 . . . . . 0 CA--C 1.548 0.88 0 C-N-CA 125.902 1.681 . . . . 0.0 112.385 178.015 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 66.5 m . . . . . 0 CA--C 1.539 0.546 0 CA-C-O 121.374 0.607 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -72.18 172.7 9.72 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.873 -0.517 . . . . 0.0 111.068 159.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 56.0 t30 65.52 -61.71 0.24 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.555 2.342 . . . . 0.0 115.991 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.94 -21.79 26.04 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -170.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.51 -5.59 28.39 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 124.758 1.17 . . . . 0.0 115.457 -173.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -78.8 -171.81 40.56 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.866 1.222 . . . . 0.0 112.789 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -144.34 146.08 32.35 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.881 1.672 . . . . 0.0 110.697 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.47 17.71 48.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 162.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -140.01 132.64 28.83 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.547 1.673 . . . . 0.0 113.23 168.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 40.16 30.55 0.07 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 128.225 2.61 . . . . 0.0 117.141 168.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.7 -31.38 37.67 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.794 1.188 . . . . 0.0 115.514 -164.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.13 -38.34 86.01 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.022 1.729 . . . . 0.0 114.284 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -106.74 -19.98 13.49 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.728 2.011 . . . . 0.0 112.894 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 48.2 t . . . . . 0 CA--C 1.547 0.846 0 C-N-CA 126.684 1.994 . . . . 0.0 112.425 174.962 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.643 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.05 -51.91 25.5 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.371 1.068 . . . . 0.0 113.223 167.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.86 -39.73 1.68 Allowed 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.447 2.098 . . . . 0.0 113.763 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER 61.1 -55.05 0.1 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 128.251 2.62 . . . . 0.0 115.956 -176.377 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -158.92 158.72 33.89 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.3 2.24 . . . . 0.0 110.809 174.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -67.79 -39.06 84.06 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 112.923 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -160.03 -34.71 0.06 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.934 1.694 . . . . 0.0 113.391 -177.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.5 m -68.44 -30.17 68.98 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -171.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 m 53.2 22.63 2.72 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 170.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -134.82 6.06 3.4 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.298 1.039 . . . . 0.0 113.45 177.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 -141.02 154.93 46.23 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.971 1.708 . . . . 0.0 112.091 -164.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -72.07 -18.01 77.56 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 116.374 1.31 . . . . 0.0 116.374 -169.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.22 95.82 0.79 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 118.448 1.124 . . . . 0.0 111.921 172.073 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.32 178.15 0.57 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.138 1.375 . . . . 0.0 112.688 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.83 -64.56 0.48 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.149 1.779 . . . . 0.0 114.323 -170.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -74.67 -15.46 60.8 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.897 1.679 . . . . 0.0 115.075 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.26 -20.02 30.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.704 1.202 . . . . 0.0 111.773 178.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.98 154.09 90.86 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 124.18 0.992 . . . . 0.0 112.243 157.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo . . . . . 0 CA--C 1.54 0.796 0 C-N-CA 123.317 2.678 . . . . 0.0 111.585 177.188 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.8 mt . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 122.761 1.267 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.0 mt -101.1 120.03 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.72 1.608 . . . . 0.0 108.728 -174.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 p -62.66 126.82 28.64 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.449 1.022 . . . . 0.0 110.298 -176.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.0 m 46.87 29.02 0.93 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -175.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 t80 55.03 30.89 15.04 Favored 'General case' 0 CA--C 1.552 1.058 0 C-N-CA 126.704 2.002 . . . . 0.0 115.195 -172.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 91.4 m -73.87 106.63 5.68 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.545 1.538 . . . . 0.0 112.783 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.44 -151.28 50.55 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.538 -0.726 . . . . 0.0 113.951 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -105.12 139.62 39.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.669 1.188 . . . . 0.0 110.202 170.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.3 t -55.17 -27.34 45.03 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -172.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.89 -35.3 22.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -99.53 -13.02 19.64 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -63.9 130.27 43.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.849 1.66 . . . . 0.0 111.745 174.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -147.24 149.42 32.86 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.841 1.256 . . . . 0.0 109.804 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.4 p -64.97 -21.11 66.79 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -163.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.9 ptt180 -73.78 -19.41 60.78 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -108.5 -35.66 6.42 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.921 1.688 . . . . 0.0 112.323 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.413 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.449 1.6 t 47.72 -114.45 0.0 OUTLIER Pre-proline 0 CA--C 1.563 1.454 0 C-N-CA 128.063 2.545 . . . . 0.0 113.973 174.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.413 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 56.0 Cg_endo -79.99 -11.52 13.64 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 CA-C-N 124.491 2.64 . . . . 0.0 116.276 -167.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -83.48 54.87 2.98 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.212 1.405 . . . . 0.0 114.321 -165.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.07 -11.46 0.75 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 177.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 mm -119.12 11.55 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 125.565 1.546 . . . . 0.0 112.56 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -133.06 160.06 38.27 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -173.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -65.57 165.34 12.46 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.638 1.175 . . . . 0.0 111.61 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 m -71.48 -31.29 66.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -134.61 19.74 3.59 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.06 1.744 . . . . 0.0 113.012 -176.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.0 t -153.13 169.13 23.73 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 126.632 1.973 . . . . 0.0 109.881 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -70.04 -174.43 0.78 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 125.335 1.454 . . . . 0.0 113.822 178.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -40.59 128.29 2.49 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.406 2.282 . . . . 0.0 114.967 -172.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m -66.85 -7.88 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 O-C-N 120.953 -1.092 . . . . 0.0 112.374 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 -15.51 31.18 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.928 1.251 . . . . 0.0 114.848 167.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.91 -178.12 6.5 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.289 1.544 . . . . 0.0 114.333 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.6 173.31 2.82 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 118.237 2.68 . . . . 0.0 118.237 -158.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 44.19 95.74 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.834 3.254 . . . . 0.0 115.114 161.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.5 m 61.46 22.06 12.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 52.72 72.52 0.41 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.916 1.286 . . . . 0.0 111.024 -167.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.0 t . . . . . 0 CA--C 1.553 1.095 0 C-N-CA 128.186 2.594 . . . . 0.0 112.237 -162.861 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 121.167 0.508 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -87.1 -12.03 48.34 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 46.2 m -84.18 150.62 25.37 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.29 1.036 . . . . 0.0 112.169 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.5 t -78.97 -36.04 42.06 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.828 1.251 . . . . 0.0 113.601 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -93.9 -9.36 37.45 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -172.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 72.2 m -89.28 148.93 23.3 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.022 0.929 . . . . 0.0 112.325 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -79.48 169.35 18.18 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.542 1.137 . . . . 0.0 111.081 166.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.0 m -82.48 26.92 0.53 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.369 1.068 . . . . 0.0 113.528 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.8 tppt? -150.1 162.06 41.15 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.119 2.168 . . . . 0.0 109.805 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 55.84 39.22 30.69 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.471 1.509 . . . . 0.0 113.113 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -119.6 160.49 22.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.646 1.578 . . . . 0.0 111.924 -174.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 p -152.5 158.86 43.16 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.403 1.081 . . . . 0.0 113.067 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -69.28 171.03 9.13 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.968 1.307 . . . . 0.0 112.912 -176.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 57.87 37.65 26.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.993 1.317 . . . . 0.0 112.826 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? 59.18 60.39 2.4 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.134 2.174 . . . . 0.0 112.851 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.6 p . . . . . 0 CA--C 1.556 1.206 0 C-N-CA 127.768 2.427 . . . . 0.0 116.895 171.403 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.9 p30 . . . . . 0 CA--C 1.549 0.911 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.311 0.5 OUTLIER 55.83 19.31 3.42 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 170.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -89.84 147.65 23.66 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.216 0.916 . . . . 0.0 111.595 166.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -135.95 -178.87 5.33 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.78 1.632 . . . . 0.0 113.233 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 68.67 134.43 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 129.004 2.922 . . . . 0.0 115.131 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -147.38 97.68 4.04 Favored Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 127.415 2.286 . . . . 0.0 108.941 -178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.63 -14.86 7.62 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.951 2.434 . . . . 0.0 113.952 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -76.72 152.14 35.81 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.529 1.132 . . . . 0.0 113.419 -175.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -139.01 160.82 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.691 1.597 . . . . 0.0 111.415 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.2 mt -111.39 86.24 6.43 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 125.921 1.689 . . . . 0.0 109.097 173.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -83.57 170.07 11.84 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.613 2.875 . . . . 0.0 113.905 -167.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 . . . . . 0 CA--C 1.548 0.894 0 C-N-CA 126.021 1.728 . . . . 0.0 115.254 170.252 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 12.7 t . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -144.2 -43.17 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -80.1 -30.9 39.25 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -164.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 24.2 p -149.6 139.71 22.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.886 1.274 . . . . 0.0 110.782 -176.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 67.14 20.83 71.42 Favored Glycine 0 CA--C 1.541 1.665 0 O-C-N 121.415 -0.803 . . . . 0.0 114.459 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 61.07 -134.08 48.98 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-N 118.088 0.944 . . . . 0.0 112.168 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -92.26 -1.41 57.12 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.866 1.266 . . . . 0.0 114.084 169.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.25 -156.35 27.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.626 1.584 . . . . 0.0 115.355 -173.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.7 p80 45.53 -157.14 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.593 2.757 . . . . 0.0 115.516 -178.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -71.61 28.76 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.951 1.701 . . . . 0.0 113.097 168.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . 0.414 ' HA2' ' SG ' ' A' ' 121' ' ' CYS . . . -52.36 -24.52 16.82 Favored Glycine 0 CA--C 1.541 1.69 0 C-N-CA 127.962 2.696 . . . . 0.0 115.58 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -67.04 -40.25 87.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.267 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -98.09 -17.57 19.02 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.318 1.847 . . . . 0.0 113.176 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . 0.414 ' SG ' ' HA2' ' A' ' 118' ' ' GLY . 1.8 p . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 115.033 1.494 . . . . 0.0 115.033 -174.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.628 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.72 37.86 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.747 1.219 . . . . 0.0 113.58 165.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -46.16 0.36 Allowed 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.044 1.829 . . . . 0.0 114.029 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt 41.71 -163.31 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.95 1.3 . . . . 0.0 112.816 -149.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 m -58.52 150.13 23.58 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.08 -1.637 . . . . 0.0 113.129 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -64.43 -44.95 89.6 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.691 0.797 . . . . 0.0 112.277 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -121.72 -58.25 1.76 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.63 1.172 . . . . 0.0 112.249 -167.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.5 p -79.48 -166.37 0.95 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.684 0.793 . . . . 0.0 110.931 167.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 62.3 p -134.61 23.47 3.68 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -69.19 171.66 8.06 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.774 -0.579 . . . . 0.0 111.631 168.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.58 149.32 39.85 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.787 1.235 . . . . 0.0 111.964 168.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 122.03 -93.28 0.5 Allowed Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.093 1.33 . . . . 0.0 110.716 -169.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.08 74.8 2.95 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 121.956 0.884 . . . . 0.0 113.047 176.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 173.86 1.0 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.865 1.266 . . . . 0.0 113.008 173.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -16.03 -73.63 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.776 2.83 . . . . 0.0 115.44 -171.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -67.46 -26.26 66.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.309 1.843 . . . . 0.0 115.65 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.94 -20.52 24.39 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.201 1.8 . . . . 0.0 112.828 176.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -56.92 -40.93 88.64 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.243 1.817 . . . . 0.0 114.56 -173.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo . . . . . 0 C--N 1.354 0.819 0 C-N-CA 122.865 2.377 . . . . 0.0 112.474 173.026 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.5 mt . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.16 155.65 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 126.8 2.04 . . . . 0.0 110.553 -176.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 73.9 m -87.05 1.05 54.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.093 1.357 . . . . 0.0 113.853 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.437 ' C ' ' H ' ' A' ' 28' ' ' CYS . 51.0 m 63.66 126.13 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.343 2.257 . . . . 0.0 114.065 -163.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 40.2 t80 57.83 -21.09 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 127.412 2.285 . . . . 0.0 116.012 -164.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.437 ' H ' ' C ' ' A' ' 26' ' ' SER . 4.0 t -110.82 138.15 47.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.378 2.271 . . . . 0.0 111.036 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.55 -178.14 51.47 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.047 1.308 . . . . 0.0 114.864 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -140.03 144.66 37.01 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.51 1.524 . . . . 0.0 110.229 171.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.0 t -69.98 -16.04 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -172.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.2 -21.69 15.42 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.663 1.585 . . . . 0.0 114.006 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.83 108.61 4.03 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.533 1.133 . . . . 0.0 111.841 -175.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -148.4 143.19 26.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.871 1.269 . . . . 0.0 110.799 -178.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -135.99 105.47 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 -167.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.2 m 54.76 -160.01 0.17 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.533 1.533 . . . . 0.0 114.527 167.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.6 2.07 23.75 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 166.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -80.13 -40.54 27.23 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.71 1.204 . . . . 0.0 111.733 177.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.9 m 63.85 166.04 0.11 Allowed Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 128.121 2.568 . . . . 0.0 114.83 -178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -118.42 -153.78 0.0 OUTLIER 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.481 2.788 . . . . 0.0 112.814 -160.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -66.95 -15.58 63.79 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.064 1.746 . . . . 0.0 115.446 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 58.35 -166.39 0.16 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.008 1.723 . . . . 0.0 115.148 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.3 mt -83.43 52.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.123 1.769 . . . . 0.0 112.095 -163.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -150.32 148.83 29.31 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.579 1.552 . . . . 0.0 113.661 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.3 t -81.13 133.22 35.43 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.88 2.072 . . . . 0.0 109.503 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.7 p -67.16 -21.6 65.8 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -77.09 -26.22 53.14 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.917 1.287 . . . . 0.0 113.059 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.7 p -153.56 -92.91 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -136.67 -164.55 1.59 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.52 1.928 . . . . 0.0 111.772 -166.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -45.71 139.47 4.01 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.702 1.601 . . . . 0.0 113.946 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.0 m -64.83 -8.61 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 121.176 -0.952 . . . . 0.0 112.585 173.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.88 -8.14 2.02 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 127.159 2.314 . . . . 0.0 115.754 171.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -147.41 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.921 1.688 . . . . 0.0 112.445 163.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -52.64 126.16 18.87 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.814 -1.179 . . . . 0.0 112.732 176.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.4 mmt-85 -66.41 160.24 25.25 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.897 2.079 . . . . 0.0 112.852 -171.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m 55.71 36.66 27.67 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.441 1.096 . . . . 0.0 113.076 -166.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.271 10.6 pt20 42.12 90.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.941 2.896 . . . . 0.0 115.843 -178.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 CA--C 1.556 1.201 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 164.377 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.438 HG13 ' H ' ' A' ' 67' ' ' CYS . 21.6 t . . . . . 0 N--CA 1.476 0.827 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -77.81 -0.39 26.99 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . 0.438 ' H ' HG13 ' A' ' 65' ' ' VAL . 80.8 m -124.63 165.58 17.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.965 1.706 . . . . 0.0 111.443 170.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.2 p -127.73 -28.48 2.71 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.061 2.144 . . . . 0.0 110.852 -159.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.4 -37.79 87.16 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.114 1.766 . . . . 0.0 110.501 161.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.9 m -82.79 129.55 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.01 1.324 . . . . 0.0 111.677 -173.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -114.59 14.57 17.69 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.488 1.515 . . . . 0.0 113.49 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.3 t -140.95 161.79 37.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.421 1.888 . . . . 0.0 112.401 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.6 -18.66 59.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.0 1.32 . . . . 0.0 114.262 173.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -79.18 147.05 32.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.085 0.954 . . . . 0.0 111.074 168.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -142.65 146.3 34.33 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.506 1.122 . . . . 0.0 111.878 -175.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.8 m -133.85 105.25 6.67 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -168.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -66.03 -17.35 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.144 1.377 . . . . 0.0 114.242 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -85.74 -9.77 56.61 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.077 0.951 . . . . 0.0 113.389 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -119.81 -43.6 2.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.533 1.533 . . . . 0.0 113.792 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 t . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -171.038 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.8 t0 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -110.97 144.2 40.44 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.574 1.549 . . . . 0.0 112.461 -175.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -134.45 138.94 45.16 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.241 1.416 . . . . 0.0 111.481 176.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -154.07 159.65 41.63 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.1 1.76 . . . . 0.0 112.416 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -114.14 167.11 10.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.628 1.571 . . . . 0.0 112.758 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -132.6 134.9 25.29 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.785 1.634 . . . . 0.0 112.089 -176.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -80.85 -177.54 3.81 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.371 3.381 . . . . 0.0 113.124 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -64.55 160.86 18.6 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 113.304 175.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.07 143.15 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 126.42 1.888 . . . . 0.0 108.778 166.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 146.34 99.02 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -173.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.41 140.65 9.7 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.336 2.69 . . . . 0.0 112.788 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.8 p90 . . . . . 0 CA--C 1.548 0.867 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 172.244 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.9 t . . . . . 0 CA--C 1.548 0.883 0 CA-C-O 121.333 0.587 . . . . 0.0 112.011 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -58.93 -18.21 31.53 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -168.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -62.63 -29.63 70.77 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.492 1.517 . . . . 0.0 114.802 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 22.8 p -150.68 -2.07 0.37 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.63 -169.09 46.59 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.809 1.195 . . . . 0.0 113.279 -171.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.58 0.64 87.81 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.289 0.947 . . . . 0.0 115.088 -174.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt 28.87 99.06 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 129.849 3.26 . . . . 0.0 116.256 170.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 98.06 3.9 57.79 Favored Glycine 0 CA--C 1.534 1.255 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 167.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -91.51 121.4 33.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.991 . . . . 0.0 112.008 169.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 38.73 35.63 0.12 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.656 2.382 . . . . 0.0 115.274 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.32 -33.17 52.46 Favored Glycine 0 N--CA 1.476 1.307 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 -150.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.35 -48.64 49.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.242 1.417 . . . . 0.0 113.282 177.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -77.28 -26.82 52.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.142 1.377 . . . . 0.0 112.269 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 126.271 1.828 . . . . 0.0 113.382 -179.986 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -86.66 -51.03 0.46 Allowed Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.344 1.457 . . . . 0.0 113.404 158.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.15 -31.52 7.67 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 123.032 2.488 . . . . 0.0 115.314 -173.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . 0.469 ' HD3' ' H ' ' A' ' 12' ' ' GLN 0.264 1.4 tmmt? 62.25 -60.93 0.12 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 128.115 2.566 . . . . 0.0 117.011 176.783 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -164.54 152.58 12.23 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.738 2.815 . . . . 0.0 109.54 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -68.53 -34.39 75.78 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -144.92 -39.98 0.25 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.254 1.421 . . . . 0.0 113.223 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.6 p -88.0 -156.4 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.731 1.612 . . . . 0.0 111.364 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -146.25 143.78 29.42 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -172.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.469 ' H ' ' HD3' ' A' ' 6' ' ' LYS . 41.2 mt-30 58.71 46.21 14.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.752 2.021 . . . . 0.0 115.004 160.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -126.54 14.25 7.6 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.979 1.711 . . . . 0.0 113.858 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.62 -41.73 1.92 Allowed Glycine 0 N--CA 1.477 1.39 0 C-N-CA 125.543 1.544 . . . . 0.0 115.704 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.54 84.4 0.43 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.265 1.426 . . . . 0.0 111.935 172.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -179.66 0.36 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.678 1.591 . . . . 0.0 113.529 176.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.03 -68.08 0.06 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 127.171 2.189 . . . . 0.0 114.97 -171.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -73.96 -22.57 59.59 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.339 1.856 . . . . 0.0 115.386 -179.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.15 -26.92 26.53 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.58 1.552 . . . . 0.0 112.339 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.44 -50.85 83.81 Favored Pre-proline 0 CA--C 1.546 0.798 0 C-N-CA 125.789 1.636 . . . . 0.0 114.86 -173.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 C--N 1.355 0.905 0 C-N-CA 121.86 1.706 . . . . 0.0 112.014 -177.472 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.1 mt . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 122.344 1.069 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.2 mt -135.25 146.4 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.22 2.208 . . . . 0.0 109.285 172.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.1 t -71.16 125.55 27.23 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.344 0.658 . . . . 0.0 111.091 173.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 10.0 t -65.63 127.25 31.14 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -164.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 50.51 31.74 5.9 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.146 1.778 . . . . 0.0 114.329 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.8 t -135.39 -21.48 1.56 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.625 1.17 . . . . 0.0 113.868 -167.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.96 170.7 37.7 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.593 1.092 . . . . 0.0 113.13 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -100.96 158.6 15.87 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.557 1.543 . . . . 0.0 110.763 170.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.8 t -59.95 -31.28 69.72 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -100.13 -7.69 24.55 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.901 1.28 . . . . 0.0 113.705 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -149.21 87.57 1.54 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.496 1.119 . . . . 0.0 112.27 -173.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . 0.453 ' CG ' ' H ' ' A' ' 35' ' ' TYR . 46.9 t-80 -153.34 174.6 14.12 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.03 2.132 . . . . 0.0 110.009 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.453 ' H ' ' CG ' ' A' ' 34' ' ' HIS 0.297 1.7 p90 59.06 -30.24 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 131.157 3.783 . . . . 0.0 117.994 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 86.6 p -60.83 163.56 5.59 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.487 1.039 . . . . 0.0 111.423 162.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.9 ttt-85 54.98 24.72 6.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.587 1.155 . . . . 0.0 112.508 -164.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 46.24 96.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.043 2.537 . . . . 0.0 114.263 -167.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.431 6.4 t 73.18 -105.02 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.236 0 C-N-CA 127.984 2.514 . . . . 0.0 115.602 177.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -66.75 138.96 50.79 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.695 2.264 . . . . 0.0 113.773 -166.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -143.62 -29.19 0.52 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -171.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.46 174.67 13.6 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -173.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.276 2.7 mt 64.15 63.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 127.48 2.312 . . . . 0.0 114.174 169.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -128.83 168.74 15.47 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.478 1.511 . . . . 0.0 113.095 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 83.9 m -70.91 163.48 27.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.792 0.806 . . . . 0.0 112.237 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m -74.32 -24.02 59.14 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -120.64 -5.65 9.72 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.6 p -148.53 158.72 44.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.579 1.151 . . . . 0.0 111.995 178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -74.37 137.92 43.08 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.562 1.145 . . . . 0.0 113.202 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.05 155.41 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 128.538 2.735 . . . . 0.0 115.203 -172.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m -88.4 -10.52 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 O-C-N 120.571 -1.33 . . . . 0.0 111.164 157.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.06 40.26 0.7 Allowed Glycine 0 CA--C 1.537 1.449 0 C-N-CA 128.593 2.996 . . . . 0.0 117.174 -164.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.06 -138.03 0.22 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.533 2.333 . . . . 0.0 111.33 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -51.92 121.91 7.46 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 124.957 1.303 . . . . 0.0 113.194 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 47.75 23.28 0.42 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.062 2.545 . . . . 0.0 114.562 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.28 77.3 p 44.63 27.99 0.29 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.807 2.443 . . . . 0.0 114.906 -166.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -145.67 -13.33 0.5 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -171.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.315 1.7 t . . . . . 0 CA--C 1.557 1.222 0 N-CA-C 118.987 2.958 . . . . 0.0 118.987 173.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.9 p . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -94.77 -4.29 47.56 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.986 0.915 . . . . 0.0 113.36 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 78.0 m -112.58 1.15 15.69 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.663 1.585 . . . . 0.0 114.879 -166.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.263 11.0 t 55.7 -46.72 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 129.292 3.037 . . . . 0.0 118.266 -171.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 pp -90.92 -18.04 25.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.958 1.703 . . . . 0.0 114.23 -176.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.05 166.63 23.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.153 0.981 . . . . 0.0 112.265 177.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.18 150.34 43.85 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.487 -0.758 . . . . 0.0 111.921 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.2 p -74.92 28.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 128.461 2.705 . . . . 0.0 116.064 -176.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -122.09 156.35 33.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.508 1.923 . . . . 0.0 110.48 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -65.26 116.42 6.58 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.728 0.811 . . . . 0.0 110.87 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 49.6 p-80 -137.71 2.82 2.45 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.131 1.772 . . . . 0.0 112.861 -174.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.7 m -81.28 34.61 0.37 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.029 1.731 . . . . 0.0 115.568 -156.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -54.15 139.16 36.31 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.274 1.43 . . . . 0.0 112.224 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 45.92 45.98 12.09 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.905 1.282 . . . . 0.0 113.522 -170.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.7 mtm180 58.26 38.75 26.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.374 1.87 . . . . 0.0 113.45 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.7 t . . . . . 0 CA--C 1.551 1.01 0 C-N-CA 129.085 2.954 . . . . 0.0 113.394 -165.176 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.7 t0 . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -78.65 136.19 37.4 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.519 1.128 . . . . 0.0 111.88 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -103.42 157.72 16.84 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.634 1.173 . . . . 0.0 113.229 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -78.3 128.56 33.88 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.27 1.028 . . . . 0.0 111.024 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -133.82 -0.93 3.09 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -176.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -88.07 147.91 41.78 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.522 1.129 . . . . 0.0 112.15 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.88 155.03 51.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.399 2.733 . . . . 0.0 114.204 175.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 100' ' ' VAL . 27.2 tptt -149.65 -172.8 4.24 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.251 1.82 . . . . 0.0 111.07 177.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . 0.416 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 10.5 p -53.05 144.32 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.068 1.347 . . . . 0.0 112.886 177.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.63 159.73 82.56 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.352 1.061 . . . . 0.0 112.51 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -59.42 -23.01 68.6 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.575 2.85 . . . . 0.0 115.064 177.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 60.0 t80 . . . . . 0 CA--C 1.537 0.467 0 C-N-CA 125.531 1.532 . . . . 0.0 110.244 172.678 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 43.5 t . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 121.513 0.673 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -70.63 -22.69 62.5 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.103 0.961 . . . . 0.0 113.538 -178.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -83.0 -19.62 36.65 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -171.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 31.5 p -150.08 10.12 0.69 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.07 3.71 85.21 Favored Glycine 0 CA--C 1.537 1.443 0 O-C-N 121.033 -1.042 . . . . 0.0 115.199 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -81.4 -159.76 23.95 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.758 1.171 . . . . 0.0 113.874 176.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.36 169.07 25.56 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 112.272 176.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 70.31 22.3 77.53 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 117.055 1.582 . . . . 0.0 117.055 158.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . 0.454 ' C ' ' H ' ' A' ' 118' ' ' GLY . 1.7 p80 -138.81 -165.45 1.83 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.845 1.323 . . . . 0.0 112.145 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -66.04 30.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.259 1.823 . . . . 0.0 113.998 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . 0.454 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -53.42 -25.75 28.04 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 128.232 2.825 . . . . 0.0 114.869 -178.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.9 -40.24 94.75 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.298 1.839 . . . . 0.0 113.533 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -111.61 -15.35 13.49 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.056 1.742 . . . . 0.0 113.027 -172.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 1.6 p . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 121.809 0.814 . . . . 0.0 112.698 178.022 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 120.253 0.073 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.73 -48.31 93.82 Favored Pre-proline 0 CA--C 1.551 1.017 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 170.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -41.47 0.54 Allowed 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.63 2.22 . . . . 0.0 113.988 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? 59.01 -54.03 0.05 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 128.778 2.831 . . . . 0.0 116.122 -171.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 167.95 28.94 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.828 2.451 . . . . 0.0 111.703 175.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -74.48 -34.03 63.0 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -153.89 -47.32 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.966 1.306 . . . . 0.0 112.879 -175.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.9 p -79.06 -164.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.284 1.034 . . . . 0.0 111.96 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 t -139.15 29.26 2.25 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -162.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -94.83 156.33 16.41 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.966 1.306 . . . . 0.0 111.512 175.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -76.29 161.25 28.9 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.17 1.788 . . . . 0.0 112.49 178.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.22 -11.73 41.96 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.652 1.821 . . . . 0.0 117.652 162.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.253 0.6 OUTLIER -134.82 72.6 1.46 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.591 1.696 . . . . 0.0 111.744 173.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.75 177.9 0.1 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.129 2.172 . . . . 0.0 113.858 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.24 -68.84 0.06 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 127.184 2.194 . . . . 0.0 115.271 -173.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -75.5 -18.54 59.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -92.09 -21.97 20.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.837 1.655 . . . . 0.0 113.114 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.1 t -56.97 -43.66 99.49 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.58 1.552 . . . . 0.0 114.934 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo . . . . . 0 C--N 1.355 0.9 0 C-N-CA 122.519 2.146 . . . . 0.0 117.044 -168.937 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.6 tt . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mt -104.85 129.62 57.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.421 1.888 . . . . 0.0 109.414 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 p -75.95 133.44 40.47 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.416 -0.803 . . . . 0.0 110.375 168.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 p -57.71 120.61 8.67 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.658 1.583 . . . . 0.0 113.774 -164.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 55.3 -13.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.358 2.663 . . . . 0.0 116.984 -171.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -87.63 46.34 1.37 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 110.941 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.23 159.73 10.24 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 120.594 -1.316 . . . . 0.0 114.864 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.58 134.14 53.05 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.034 1.333 . . . . 0.0 109.524 163.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.7 t -66.77 -9.54 37.94 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -162.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -104.08 -10.27 18.14 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.278 1.431 . . . . 0.0 114.519 172.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.94 -17.91 8.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.043 1.737 . . . . 0.0 113.682 -174.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -87.47 145.07 26.42 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.833 1.653 . . . . 0.0 112.922 -173.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -150.66 155.43 39.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.504 1.522 . . . . 0.0 109.855 174.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.1 p -61.43 -30.26 70.46 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -173.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.6 mtp-105 -82.79 -28.65 30.15 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.145 1.378 . . . . 0.0 112.915 171.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -85.94 -9.35 57.03 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.314 1.446 . . . . 0.0 113.448 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.5 t -17.51 -61.87 0.04 OUTLIER Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 130.558 3.543 . . . . 0.0 117.3 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -63.57 -21.76 70.54 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.757 2.305 . . . . 0.0 115.982 -174.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -83.93 112.1 19.85 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.803 1.183 . . . . 0.0 110.165 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.77 -155.8 0.66 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.838 1.255 . . . . 0.0 112.331 -159.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.5 87.29 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 124.709 1.204 . . . . 0.0 109.511 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -128.38 160.37 32.45 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.181 1.792 . . . . 0.0 113.154 -171.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.62 -4.11 35.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.379 2.271 . . . . 0.0 113.63 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 48.2 m 64.66 -28.75 0.1 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 128.102 2.561 . . . . 0.0 117.471 -171.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -124.45 3.84 8.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.155 1.782 . . . . 0.0 113.71 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.3 t -154.44 47.3 0.58 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.896 1.278 . . . . 0.0 111.031 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 49.39 -159.11 0.06 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.864 1.266 . . . . 0.0 114.203 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.415 ' HG2' ' H ' ' A' ' 52' ' ' GLY . 21.0 tt0 -48.17 140.17 7.59 Favored 'General case' 0 CA--C 1.552 1.054 0 O-C-N 120.018 -1.677 . . . . 0.0 113.193 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.4 m -63.73 -23.21 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 119.742 -1.849 . . . . 0.0 111.507 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . 0.415 ' H ' ' HG2' ' A' ' 50' ' ' GLU . . . -81.13 -13.94 80.02 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.962 1.744 . . . . 0.0 116.294 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -79.86 -17.7 52.55 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.098 1.949 . . . . 0.0 115.152 -168.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -131.74 144.16 50.77 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.904 1.282 . . . . 0.0 110.922 169.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -58.84 152.8 18.43 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.392 1.477 . . . . 0.0 112.395 -173.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.7 m 58.91 40.81 22.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 113.175 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.275 18.7 pt20 48.14 49.16 17.82 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.809 2.044 . . . . 0.0 114.454 -175.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 CA--C 1.552 1.02 0 C-N-CA 128.362 2.665 . . . . 0.0 115.762 -170.595 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.2 p . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 120.642 0.258 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 8.5 tm0? -84.03 24.62 0.9 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.039 1.336 . . . . 0.0 113.298 -173.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.8 m -137.05 154.36 50.38 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.783 1.633 . . . . 0.0 110.701 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -70.5 -177.37 1.47 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 122.098 -0.376 . . . . 0.0 110.588 149.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.305 2.9 pp 55.25 9.92 0.39 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.865 2.466 . . . . 0.0 116.805 173.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 46.7 m -116.43 164.21 14.89 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.577 1.551 . . . . 0.0 114.022 -171.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 59.78 1.55 0.31 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.989 2.916 . . . . 0.0 118.353 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.0 p -72.67 -32.71 66.02 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.124 0.969 . . . . 0.0 112.137 156.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -139.25 -179.03 5.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.011 2.925 . . . . 0.0 110.23 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -54.97 148.44 13.51 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.424 1.49 . . . . 0.0 113.107 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -85.11 114.83 22.53 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.96 0.904 . . . . 0.0 111.882 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.9 m -77.25 78.04 3.78 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.443 1.497 . . . . 0.0 112.759 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -57.15 -28.27 62.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.336 1.455 . . . . 0.0 114.1 -174.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.06 -9.91 59.76 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -131.72 -31.28 1.56 Allowed 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -169.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 49.8 t . . . . . 0 CA--C 1.55 0.952 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -175.981 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -102.23 14.23 32.53 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -170.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -67.53 122.41 17.94 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.421 -1.424 . . . . 0.0 111.243 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -83.02 -26.92 30.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 57.64 -19.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 128.68 2.792 . . . . 0.0 118.295 -179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 46.4 71.69 1.49 Allowed Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 128.256 2.623 . . . . 0.0 113.587 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -63.6 150.4 88.58 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.284 1.99 . . . . 0.0 110.929 168.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -131.16 154.29 48.51 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.38 1.472 . . . . 0.0 111.735 -176.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.5 m -110.86 13.35 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.889 1.676 . . . . 0.0 112.906 176.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.5 tp -66.96 -30.95 3.5 Favored Pre-proline 0 CA--C 1.553 1.058 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 172.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -58.94 162.1 14.15 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 122.862 2.375 . . . . 0.0 113.779 171.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.5 t80 . . . . . 0 CA--C 1.545 0.766 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -177.261 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 CA--C 1.546 0.814 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -130.14 -41.42 1.27 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.621 1.168 . . . . 0.0 113.317 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -79.74 4.19 17.05 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.736 1.214 . . . . 0.0 113.524 175.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 36.0 t -139.01 145.54 39.79 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.091 2.157 . . . . 0.0 108.785 168.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.25 164.64 40.47 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.559 1.076 . . . . 0.0 115.191 -175.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.5 -13.29 23.09 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.35 1.452 . . . . 0.0 116.269 174.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . 0.278 64.4 pttt 45.92 31.41 1.08 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 127.804 2.442 . . . . 0.0 116.411 172.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.26 -17.07 19.02 Favored Glycine 0 CA--C 1.537 1.443 0 N-CA-C 117.095 1.598 . . . . 0.0 117.095 -168.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -151.53 156.19 40.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.211 1.505 . . . . 0.0 114.508 -166.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 19.3 t80 46.71 33.67 2.2 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.269 2.227 . . . . 0.0 115.33 166.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.74 -14.54 30.03 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.653 1.597 . . . . 0.0 116.73 -166.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.95 -34.49 78.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.575 1.15 . . . . 0.0 113.523 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -141.79 -11.21 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -172.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 46.5 t . . . . . 0 CA--C 1.545 0.783 0 O-C-N 121.017 -1.052 . . . . 0.0 113.374 -174.445 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -72.92 -54.63 4.48 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.134 0.974 . . . . 0.0 112.798 172.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -80.42 -27.71 3.3 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.0 2.466 . . . . 0.0 114.132 178.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 tptt 57.61 -67.92 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.31 2.644 . . . . 0.0 115.524 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 36.0 t -166.17 154.88 11.08 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 129.145 2.978 . . . . 0.0 108.675 177.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -67.32 -55.28 14.51 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.85 -1.156 . . . . 0.0 112.747 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -121.13 -58.59 1.79 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.835 0.854 . . . . 0.0 113.056 -168.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.5 p -86.81 -159.05 0.47 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.896 1.279 . . . . 0.0 111.194 172.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 61.4 m -149.9 169.37 21.29 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.606 1.162 . . . . 0.0 113.646 -174.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 61.55 27.11 16.68 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.184 1.793 . . . . 0.0 115.418 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.8 mtp85 -120.3 6.02 10.7 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.343 1.457 . . . . 0.0 114.837 -177.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.51 -33.69 0.98 Allowed Glycine 0 CA--C 1.536 1.377 0 C-N-CA 125.44 1.495 . . . . 0.0 115.71 175.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -71.13 96.29 1.34 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.387 1.094 . . . . 0.0 112.263 175.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.03 179.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 127.186 2.195 . . . . 0.0 113.404 169.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.2 -64.37 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.506 1.522 . . . . 0.0 114.077 -169.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.95 -1.8 41.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.81 1.644 . . . . 0.0 115.29 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -94.53 -26.89 16.23 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.101 1.361 . . . . 0.0 111.166 172.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.5 t -62.81 149.73 88.95 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 125.555 1.542 . . . . 0.0 110.958 173.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo . . . . . 0 CA--C 1.541 0.873 0 C-N-CA 122.748 2.299 . . . . 0.0 115.888 -161.913 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.547 0.689 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.5 mm -62.53 136.14 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 125.776 1.631 . . . . 0.0 110.334 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.4 p -69.06 -43.38 74.73 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.178 -0.951 . . . . 0.0 113.562 -173.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.7 p -159.72 171.15 20.05 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 128.808 2.843 . . . . 0.0 108.851 162.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -76.34 37.74 0.17 Allowed 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -173.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.5 p -99.15 -31.54 11.7 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.144 2.177 . . . . 0.0 112.706 167.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 174.41 170.84 38.09 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 115.392 0.917 . . . . 0.0 115.392 -177.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.52 106.92 3.62 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 67.3 -150.09 0.18 Allowed 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 114.577 -1.192 . . . . 0.0 113.496 135.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -92.57 1.49 57.23 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.419 -1.426 . . . . 0.0 113.182 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -86.64 -31.31 21.18 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -173.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.86 157.13 24.5 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.814 0.846 . . . . 0.0 112.351 171.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -115.83 179.21 4.04 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.167 1.387 . . . . 0.0 111.409 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.7 m -69.44 16.67 0.05 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.283 2.233 . . . . 0.0 116.111 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -125.75 -3.47 7.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.962 2.105 . . . . 0.0 113.156 166.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.01 4.7 3.81 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.491 2.316 . . . . 0.0 113.324 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.0 t -47.75 -48.32 60.51 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 125.06 1.344 . . . . 0.0 113.012 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -85.02 80.35 2.14 Favored 'Trans proline' 0 CA--C 1.55 1.317 0 C-N-CA 123.296 2.664 . . . . 0.0 112.512 167.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -151.99 153.39 33.96 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.04 1.336 . . . . 0.0 112.401 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.24 -31.64 0.1 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.159 2.584 . . . . 0.0 117.202 -175.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 16.2 mm -112.78 55.52 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 126.143 1.777 . . . . 0.0 109.527 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . 0.43 ' HA ' ' C ' ' A' ' 50' ' ' GLU . 5.5 pm0 -140.91 148.29 40.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.525 1.13 . . . . 0.0 112.246 174.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 29.7 p -86.98 167.39 14.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.092 0.957 . . . . 0.0 111.718 170.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.9 t -58.66 133.7 56.13 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt 55.47 19.15 3.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.819 2.048 . . . . 0.0 114.441 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.4 m -130.14 178.51 6.51 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.473 1.909 . . . . 0.0 112.522 -175.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -111.65 -15.91 13.35 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -166.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.43 ' C ' ' HA ' ' A' ' 44' ' ' GLN . 47.4 mt-10 -134.19 167.32 20.89 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.766 2.027 . . . . 0.0 108.996 173.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.6 -11.3 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.408 -1.432 . . . . 0.0 113.99 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.93 140.18 3.04 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 127.153 2.311 . . . . 0.0 109.936 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -125.73 -3.96 7.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.763 1.625 . . . . 0.0 112.525 -176.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -134.53 141.9 46.84 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 126.546 1.938 . . . . 0.0 108.884 163.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.68 47.52 2.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.037 1.735 . . . . 0.0 112.855 178.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 m 64.16 -30.52 0.11 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -139.12 -4.26 1.53 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.826 1.651 . . . . 0.0 114.071 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.292 18.1 p . . . . . 0 CA--C 1.557 1.221 0 C-N-CA 128.789 2.836 . . . . 0.0 116.914 -172.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 N--CA 1.476 0.87 0 CA-C-O 120.729 0.299 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -72.4 -17.82 61.77 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 77.0 m -87.11 -28.95 22.2 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 58.1 -36.28 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 127.482 2.313 . . . . 0.0 116.081 -151.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.3 tp -70.55 -15.68 62.8 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 129.907 3.283 . . . . 0.0 114.12 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.7 t -107.03 156.77 18.39 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.625 1.17 . . . . 0.0 112.587 -170.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -115.52 1.03 13.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.681 1.592 . . . . 0.0 114.418 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.7 t -87.34 147.97 25.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -111.17 2.07 17.6 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.532 2.333 . . . . 0.0 115.115 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -112.75 -8.33 13.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.543 1.937 . . . . 0.0 113.599 -172.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -78.09 165.3 24.16 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -165.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.3 t -69.59 145.66 52.36 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.9 -22.71 65.95 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 127.265 2.226 . . . . 0.0 114.965 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -77.25 33.76 0.16 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 125.117 1.367 . . . . 0.0 112.519 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 46.19 47.47 13.26 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.485 2.314 . . . . 0.0 112.815 -165.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 27.6 p . . . . . 0 CA--C 1.552 1.053 0 C-N-CA 127.707 2.403 . . . . 0.0 116.204 168.262 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.7 t70 . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -143.8 159.54 42.33 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.452 1.501 . . . . 0.0 112.004 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.36 -5.88 6.53 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -174.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -138.56 159.67 41.51 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.824 1.25 . . . . 0.0 113.591 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.75 165.08 30.72 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.946 1.699 . . . . 0.0 111.529 175.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.58 146.59 42.4 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.243 1.417 . . . . 0.0 112.273 172.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -64.5 160.59 38.85 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.262 2.642 . . . . 0.0 114.023 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -134.78 157.16 47.45 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.186 1.794 . . . . 0.0 111.477 173.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.6 m -90.28 -10.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 124.918 1.287 . . . . 0.0 114.301 -177.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.9 tp -73.33 -35.15 2.56 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -61.8 148.69 92.53 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.031 2.487 . . . . 0.0 114.578 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 24.7 p90 . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.754 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 57.3 m . . . . . 0 CA--C 1.548 0.902 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 63.42 -26.91 0.07 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 118.132 2.642 . . . . 0.0 118.132 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -133.16 -12.04 2.85 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -176.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 28.4 p -151.26 172.27 16.12 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.348 0.976 . . . . 0.0 112.915 -173.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -62.31 161.29 30.38 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 124.203 0.906 . . . . 0.0 113.695 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.29 172.07 39.58 Favored Glycine 0 CA--C 1.537 1.425 0 CA-C-O 121.677 0.598 . . . . 0.0 112.797 -165.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -125.58 -20.84 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -165.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -171.43 22.18 0.08 OUTLIER Glycine 0 CA--C 1.535 1.337 0 N-CA-C 117.538 1.775 . . . . 0.0 117.538 -175.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -66.97 -51.0 60.53 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 120.183 1.991 . . . . 0.0 112.459 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -135.29 30.52 3.25 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.395 2.278 . . . . 0.0 108.716 161.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -16.25 22.99 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 127.18 2.324 . . . . 0.0 115.258 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -63.26 -37.27 86.6 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.459 1.504 . . . . 0.0 113.542 171.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -141.97 -4.16 1.07 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -166.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.7 p . . . . . 0 CA--C 1.555 1.15 0 O-C-N 120.329 -1.482 . . . . 0.0 114.922 176.047 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.71 0 CA-C-O 120.84 0.353 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.66 -50.54 71.47 Favored Pre-proline 0 CA--C 1.552 1.027 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 175.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.43 -44.35 0.12 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.023 1.815 . . . . 0.0 113.773 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? 61.48 -55.09 0.11 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 128.047 2.539 . . . . 0.0 114.612 -167.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -153.8 159.83 42.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.656 2.782 . . . . 0.0 111.359 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -76.3 -53.17 8.6 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.614 -0.679 . . . . 0.0 109.945 157.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -134.84 161.54 34.91 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.632 1.973 . . . . 0.0 110.207 176.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . 0.318 14.6 p 47.02 -159.39 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 126.397 1.879 . . . . 0.0 112.967 -161.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -145.43 28.96 1.17 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -163.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -91.29 145.62 24.5 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.287 1.035 . . . . 0.0 112.357 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.19 -28.79 66.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -165.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -81.81 -13.65 79.26 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 116.169 1.227 . . . . 0.0 116.169 -164.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -142.65 81.85 1.75 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.642 1.221 . . . . 0.0 113.437 -169.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.12 -178.33 0.16 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.224 1.41 . . . . 0.0 113.211 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.63 -68.81 0.11 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 126.495 1.918 . . . . 0.0 114.81 -166.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -68.9 -20.63 64.25 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -91.7 -24.53 19.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.746 1.618 . . . . 0.0 113.103 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.7 t -57.06 -43.99 99.58 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.657 1.583 . . . . 0.0 114.83 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo . . . . . 0 CA--C 1.544 1.013 0 C-N-CA 122.554 2.169 . . . . 0.0 115.454 -174.701 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 12.4 pt -83.98 142.34 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.041 1.336 . . . . 0.0 112.774 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.37 101.99 12.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.215 1.006 . . . . 0.0 110.2 171.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m 44.39 49.72 8.07 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.232 1.813 . . . . 0.0 115.681 170.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.9 t80 57.85 32.72 22.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.976 1.71 . . . . 0.0 115.255 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 52.8 t -66.61 -19.73 65.84 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.191 1.396 . . . . 0.0 112.791 170.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -166.58 -171.09 32.3 Favored Glycine 0 CA--C 1.531 1.09 0 O-C-N 120.695 -1.253 . . . . 0.0 114.688 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -88.41 127.92 35.51 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.419 1.087 . . . . 0.0 111.98 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -58.15 -22.54 51.62 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -83.78 -11.47 57.04 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -141.18 -1.32 1.37 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -169.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -83.97 142.8 30.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.82 -1.175 . . . . 0.0 113.345 -175.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -156.45 159.48 38.7 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.074 1.349 . . . . 0.0 111.116 175.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.1 m -60.47 -29.96 69.38 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -169.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.93 4.47 34.76 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 173.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -108.44 -19.05 13.59 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.886 1.674 . . . . 0.0 112.941 176.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 m -14.35 -65.55 0.03 OUTLIER Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 130.198 3.399 . . . . 0.0 117.191 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -67.63 -17.44 48.05 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.927 2.418 . . . . 0.0 115.802 -171.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -100.53 53.43 0.87 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.468 1.507 . . . . 0.0 112.143 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -134.42 -107.67 0.23 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.954 1.302 . . . . 0.0 112.253 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.262 33.4 mt -96.54 22.5 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 125.37 1.468 . . . . 0.0 110.736 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -133.5 153.79 51.35 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.318 -1.489 . . . . 0.0 112.031 165.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 19.7 p -102.17 169.32 8.8 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 112.125 174.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.3 m -59.63 143.33 50.79 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt 58.63 11.02 1.6 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.351 1.86 . . . . 0.0 114.716 -173.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 73.0 m -138.79 174.72 10.23 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.915 1.686 . . . . 0.0 112.843 -170.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -114.5 5.04 15.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.413 1.485 . . . . 0.0 114.088 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -153.2 150.51 29.09 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.472 1.509 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.8 m -77.75 13.64 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.666 -1.271 . . . . 0.0 111.858 168.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.72 -136.29 0.13 Allowed Glycine 0 CA--C 1.531 1.062 0 C-N-CA 127.833 2.635 . . . . 0.0 114.359 -172.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 57.0 -147.38 0.53 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.095 0.958 . . . . 0.0 111.532 -173.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.9 p90 -93.37 176.49 6.37 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.805 1.242 . . . . 0.0 113.764 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -23.36 134.13 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 130.618 3.567 . . . . 0.0 116.133 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.1 m 55.59 47.52 20.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.657 1.583 . . . . 0.0 113.918 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.255 14.4 pt20 50.39 43.86 26.79 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.725 2.01 . . . . 0.0 114.593 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.555 1.138 0 C-N-CA 127.527 2.331 . . . . 0.0 115.267 -171.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.477 0.909 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.1 pm0 -108.83 -2.41 18.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.476 1.91 . . . . 0.0 114.372 -173.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 57.1 m -77.31 -5.17 48.51 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -163.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.284 10.9 t 59.34 -39.47 0.07 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 129.034 2.934 . . . . 0.0 118.211 -174.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -81.35 -1.96 47.39 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.575 -1.328 . . . . 0.0 113.558 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.3 m -107.84 177.84 4.7 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.719 1.608 . . . . 0.0 111.994 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.9 tptt 68.5 138.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.867 2.067 . . . . 0.0 111.32 -156.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 t 54.95 -171.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.34 -143.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 62.7 mttm 60.91 -8.94 0.07 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 129.047 2.939 . . . . 0.0 116.301 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 83.0 tttt 57.81 111.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 128.302 2.641 . . . . 0.0 112.508 -161.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -76.45 148.73 37.05 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.6 p -133.59 113.95 12.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.916 1.686 . . . . 0.0 110.891 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -66.9 140.05 57.76 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.116 -0.99 . . . . 0.0 111.419 -175.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 60.22 10.18 2.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 126.903 2.081 . . . . 0.0 116.115 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtm180 -130.43 -50.18 1.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.289 1.436 . . . . 0.0 113.14 -175.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 85.0 m . . . . . 0 CA--C 1.554 1.125 0 C-N-CA 128.538 2.735 . . . . 0.0 114.468 -170.749 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 CA--C 1.541 0.633 0 CA-C-O 120.8 0.333 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -142.9 154.79 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.276 1.43 . . . . 0.0 111.642 -177.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -136.92 143.69 43.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.258 1.823 . . . . 0.0 111.164 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -132.85 157.9 43.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.881 1.672 . . . . 0.0 112.327 176.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.76 -177.75 2.9 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.196 0.999 . . . . 0.0 112.145 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -57.29 150.83 40.48 Favored Pre-proline 0 N--CA 1.478 0.936 0 C-N-CA 124.011 0.924 . . . . 0.0 111.192 171.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 149.37 88.21 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.355 2.703 . . . . 0.0 113.348 -173.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -69.79 160.62 31.39 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -170.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.2 t -121.72 151.88 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.023 2.129 . . . . 0.0 108.506 169.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 99.1 mt -57.28 142.1 76.27 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 123.803 0.841 . . . . 0.0 112.607 -174.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -77.27 -15.16 16.16 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.302 2.668 . . . . 0.0 113.606 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 125.22 1.408 . . . . 0.0 112.019 -179.974 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.552 1.034 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -63.56 -16.11 59.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 -166.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -63.91 -20.12 65.62 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.181 1.392 . . . . 0.0 114.545 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.1 p -107.63 8.13 28.95 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.638 1.575 . . . . 0.0 113.819 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.51 131.83 1.94 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 126.017 1.77 . . . . 0.0 112.284 -166.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.85 112.99 0.26 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.25 1.405 . . . . 0.0 113.232 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -69.84 -9.3 54.26 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -174.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 179.96 124.08 0.87 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.801 1.191 . . . . 0.0 111.638 170.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -144.16 -46.15 0.26 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.614 0.766 . . . . 0.0 113.045 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -130.3 37.31 3.89 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.23 1.812 . . . . 0.0 109.266 165.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.44 -17.9 27.55 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 126.815 2.15 . . . . 0.0 115.077 -170.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.62 -34.56 67.38 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.497 1.519 . . . . 0.0 113.455 171.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -129.07 -25.26 2.78 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.722 1.609 . . . . 0.0 113.675 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 CA--C 1.551 1.007 0 C-N-CA 124.619 1.168 . . . . 0.0 113.699 -177.404 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.675 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.36 -51.5 13.13 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 123.957 0.903 . . . . 0.0 112.783 165.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.64 -29.95 2.65 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.811 2.34 . . . . 0.0 114.328 178.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 58.76 -63.78 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.438 2.695 . . . . 0.0 115.962 -175.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -158.11 164.34 36.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 128.07 2.548 . . . . 0.0 110.302 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -68.28 -31.42 70.86 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.997 -1.064 . . . . 0.0 113.171 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.79 -51.02 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.653 1.581 . . . . 0.0 112.466 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 p -91.11 63.07 4.99 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.64 1.576 . . . . 0.0 113.387 -172.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.6 m -35.92 89.46 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.665 3.586 . . . . 0.0 117.387 -172.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -137.67 143.09 41.17 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.998 2.119 . . . . 0.0 108.68 164.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -74.39 158.25 34.24 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -169.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.25 -23.54 23.87 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 125.567 1.556 . . . . 0.0 115.145 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.264 13.9 p-80 -123.9 78.16 1.6 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 123.235 1.493 . . . . 0.0 111.756 173.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.63 -179.54 0.38 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.613 1.965 . . . . 0.0 113.472 174.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.47 -66.55 0.19 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.967 2.107 . . . . 0.0 114.512 -174.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -74.76 -16.49 60.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -94.78 -14.14 24.97 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.374 1.47 . . . . 0.0 113.203 -177.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -64.0 143.54 98.21 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 124.409 1.084 . . . . 0.0 111.607 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo . . . . . 0 CA--C 1.54 0.802 0 C-N-CA 122.862 2.375 . . . . 0.0 115.591 -164.629 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.7 tt . . . . . 0 N--CA 1.47 0.54 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.6 mt 56.04 -74.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 127.642 2.377 . . . . 0.0 112.708 -172.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 38.9 t -156.03 78.71 0.97 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.28 2.632 . . . . 0.0 106.955 172.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m 49.75 51.51 16.38 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 8.8 t80 61.51 42.94 10.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.065 2.146 . . . . 0.0 113.908 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -102.54 172.63 6.75 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.122 1.369 . . . . 0.0 112.374 169.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.93 -171.64 38.33 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.829 1.491 . . . . 0.0 116.829 158.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -123.86 5.82 8.72 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.585 1.554 . . . . 0.0 112.684 174.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.303 5.0 t 53.88 154.71 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.716 2.006 . . . . 0.0 115.133 -150.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.1 t70 59.21 -52.58 0.06 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 129.984 3.314 . . . . 0.0 115.085 -168.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -94.98 67.1 3.08 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.231 2.212 . . . . 0.0 111.021 176.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -147.85 138.66 23.25 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.739 1.615 . . . . 0.0 110.646 177.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -150.75 157.42 42.92 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.928 1.291 . . . . 0.0 110.394 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.2 p -60.18 -22.04 62.45 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.455 1.902 . . . . 0.0 115.031 -175.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -72.6 -25.93 61.51 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.932 1.293 . . . . 0.0 112.724 173.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -112.95 -34.15 5.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.959 1.303 . . . . 0.0 114.435 -169.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.335 64.6 m 36.07 -101.69 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.163 0 C-N-CA 128.354 2.662 . . . . 0.0 116.485 172.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -76.48 -17.33 16.47 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.14 1.893 . . . . 0.0 115.124 -165.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.44 -1.83 14.54 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -162.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -20.81 53.55 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.421 1.488 . . . . 0.0 114.659 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.67 64.01 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.476 1.51 . . . . 0.0 109.199 -169.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -170.11 163.72 9.19 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.867 2.067 . . . . 0.0 111.041 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 81.3 m -131.5 173.41 11.13 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.644 1.577 . . . . 0.0 110.282 168.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -78.95 -42.52 26.66 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.009 1.724 . . . . 0.0 114.054 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.44 -27.78 22.51 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.876 1.27 . . . . 0.0 112.493 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 6.6 p -129.59 124.4 33.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.166 1.386 . . . . 0.0 110.995 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -84.39 149.69 25.84 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.226 1.41 . . . . 0.0 114.107 -168.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 62.32 9.8 3.5 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.4 m -134.82 137.29 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.851 1.26 . . . . 0.0 113.437 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.71 160.64 26.63 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.82 1.2 . . . . 0.0 112.474 170.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -75.08 81.05 2.25 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -174.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -136.31 160.3 39.14 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 127.48 2.312 . . . . 0.0 110.872 170.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 146.21 36.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.118 0.485 . . . . 0.0 110.256 169.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 21.2 m 61.67 -2.5 0.26 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -171.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -102.25 -53.51 2.9 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.383 1.073 . . . . 0.0 111.184 170.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.4 m . . . . . 0 CA--C 1.558 1.278 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -178.587 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.9 t . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -96.36 4.88 51.94 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.016 1.726 . . . . 0.0 113.13 -171.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 85.3 m -85.18 -16.21 41.1 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.256 7.1 t 56.8 -46.66 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 129.35 3.06 . . . . 0.0 117.809 -168.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -85.07 -22.62 28.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.455 1.502 . . . . 0.0 113.186 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 58.1 m -82.97 131.09 35.2 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.801 0.841 . . . . 0.0 110.799 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -115.19 2.01 13.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 83.8 p -78.94 169.68 17.84 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.441 1.496 . . . . 0.0 113.43 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -95.71 8.96 41.98 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.497 1.519 . . . . 0.0 114.425 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.05 -148.32 0.38 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.077 2.151 . . . . 0.0 109.783 177.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . 0.409 ' CG ' ' H ' ' A' ' 76' ' ' SER . 44.8 t60 58.01 -123.39 1.49 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.025 1.33 . . . . 0.0 113.292 172.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' SER . . . . . 0.409 ' H ' ' CG ' ' A' ' 75' ' ' HIS . 1.3 t 59.32 -47.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.95 2.5 . . . . 0.0 115.936 -159.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.4 tptp 51.65 40.33 27.05 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.978 2.511 . . . . 0.0 113.86 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 57.08 61.31 2.62 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.958 1.303 . . . . 0.0 113.222 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 61.0 56.08 2.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.192 2.197 . . . . 0.0 114.593 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t . . . . . 0 CA--C 1.556 1.193 0 C-N-CA 126.529 1.932 . . . . 0.0 115.816 164.574 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 N--CA 1.475 0.785 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.7 t30 61.09 6.66 1.32 Allowed 'General case' 0 CA--C 1.56 1.356 0 N-CA-C 118.008 2.596 . . . . 0.0 118.008 175.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -131.44 -23.22 2.39 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -176.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 85.7 mttt 66.12 149.53 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 130.041 3.336 . . . . 0.0 115.634 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -88.82 156.65 18.82 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.413 1.085 . . . . 0.0 113.11 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -150.98 152.67 31.98 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.487 1.915 . . . . 0.0 111.83 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.87 -15.06 12.14 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.35 2.7 . . . . 0.0 114.358 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt 60.53 -5.52 0.1 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.093 2.557 . . . . 0.0 116.688 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 20.2 m -133.72 145.63 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 127.045 2.138 . . . . 0.0 109.86 166.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -147.6 99.78 3.81 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 123.815 0.846 . . . . 0.0 112.233 -173.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -65.74 148.06 86.34 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.495 2.797 . . . . 0.0 112.295 167.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.5 p90 . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 177.734 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 25.1 p . . . . . 0 CA--C 1.545 0.77 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -40.26 -37.16 0.61 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 127.984 2.514 . . . . 0.0 116.31 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -92.81 -12.5 31.01 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -166.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 12.1 p -131.28 179.33 6.09 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.331 1.052 . . . . 0.0 113.245 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -58.84 154.22 28.21 Favored Glycine 0 CA--C 1.538 1.523 0 C-N-CA 124.155 0.883 . . . . 0.0 114.054 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.57 -36.15 1.82 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 125.096 1.332 . . . . 0.0 114.701 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt 45.88 48.56 12.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.571 2.348 . . . . 0.0 113.69 171.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 174.0 17.5 0.02 OUTLIER Glycine 0 CA--C 1.536 1.385 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 -174.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -141.13 144.31 34.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.54 1.67 . . . . 0.0 113.106 -176.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 35.08 40.55 0.06 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 128.202 2.601 . . . . 0.0 116.571 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.23 -19.9 41.23 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 116.225 1.25 . . . . 0.0 116.225 -165.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -78.63 -44.18 24.5 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.097 1.359 . . . . 0.0 113.438 173.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -103.43 -20.75 13.95 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.898 1.679 . . . . 0.0 113.883 -165.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 15.9 p . . . . . 0 CA--C 1.545 0.766 0 C-N-CA 124.742 1.217 . . . . 0.0 114.243 178.667 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.667 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.8 -47.24 62.76 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.436 1.094 . . . . 0.0 113.553 164.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -77.88 -31.44 3.13 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.667 2.245 . . . . 0.0 114.033 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 59.83 -65.99 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 128.278 2.631 . . . . 0.0 114.488 -169.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -160.68 170.15 21.39 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 128.078 2.551 . . . . 0.0 110.746 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -73.82 -31.98 63.5 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.808 -1.183 . . . . 0.0 114.15 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -157.58 -58.72 0.08 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.768 1.227 . . . . 0.0 112.201 -177.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.1 p -77.3 130.7 37.53 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.468 0.707 . . . . 0.0 111.657 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.4 m -81.15 42.37 0.65 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.632 1.716 . . . . 0.0 115.632 -165.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -95.22 150.89 19.73 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.954 1.702 . . . . 0.0 111.45 176.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 ptm85 -76.01 171.56 14.24 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 113.871 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.8 -78.72 1.98 Allowed Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.839 1.209 . . . . 0.0 112.692 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -79.93 85.9 5.51 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -54.69 176.71 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.047 1.739 . . . . 0.0 113.669 168.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.58 -66.19 0.21 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.945 2.098 . . . . 0.0 114.444 -174.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -78.07 -5.46 51.56 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -89.94 -37.4 14.4 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.127 1.371 . . . . 0.0 111.939 175.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.8 t -56.13 -47.58 98.55 Favored Pre-proline 0 CA--C 1.549 0.914 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--N 1.354 0.859 0 C-N-CA 122.294 1.996 . . . . 0.0 115.473 -164.773 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.6 pp . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.88 148.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 125.204 1.402 . . . . 0.0 110.757 172.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.8 m -68.54 158.58 33.59 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.64 -0.662 . . . . 0.0 112.033 163.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -67.19 105.29 1.67 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.26 1.024 . . . . 0.0 112.492 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.5 t80 61.15 5.2 1.0 Allowed 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 117.999 2.592 . . . . 0.0 117.999 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 20.3 p -106.1 1.14 26.06 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -150.41 154.35 25.59 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.43 1.014 . . . . 0.0 114.937 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -113.44 20.44 16.07 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.887 1.675 . . . . 0.0 113.896 -174.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.277 2.8 t 60.44 -29.46 0.05 Allowed 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 129.608 3.163 . . . . 0.0 118.036 174.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.22 -24.81 27.69 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.506 1.522 . . . . 0.0 113.796 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -132.39 5.67 4.08 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.954 1.302 . . . . 0.0 114.049 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -89.86 148.5 23.13 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.139 -0.975 . . . . 0.0 113.383 -171.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -147.46 132.51 18.24 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.117 0.967 . . . . 0.0 111.725 170.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.9 m -58.7 -26.04 63.49 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.161 1.784 . . . . 0.0 114.677 -173.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -70.7 -21.32 62.58 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.068 1.347 . . . . 0.0 113.744 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -125.14 -19.8 5.05 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.809 1.244 . . . . 0.0 114.313 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.383 63.3 m 47.77 -106.92 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 127.822 2.449 . . . . 0.0 115.602 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -62.33 102.41 0.27 Allowed 'Trans proline' 0 C--N 1.356 0.962 0 CA-C-N 123.503 2.287 . . . . 0.0 113.771 -164.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -135.67 -15.37 1.84 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.662 1.985 . . . . 0.0 113.181 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -133.52 177.52 7.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.891 1.676 . . . . 0.0 111.409 -178.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 76.6 mt 65.1 -76.25 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 127.219 2.208 . . . . 0.0 111.687 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -59.54 162.82 4.63 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.643 0.777 . . . . 0.0 112.519 162.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 7.8 t -109.08 123.9 49.9 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.332 1.053 . . . . 0.0 109.284 163.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m 41.91 37.55 0.83 Allowed 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 165.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt 55.08 26.17 7.88 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.95 2.5 . . . . 0.0 115.221 -175.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.7 p -81.32 -61.73 1.86 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.154 0.888 . . . . 0.0 111.687 170.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.417 ' C ' ' H ' ' A' ' 51' ' ' VAL . 15.5 m-20 -153.68 168.79 25.08 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.301 1.84 . . . . 0.0 111.329 172.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -56.61 4.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 130.89 3.676 . . . . 0.0 117.337 -175.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 49' ' ' ASP . 1.5 m -164.82 -30.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.859 1 C-N-CA 132.04 4.136 . . . . 0.0 108.807 179.457 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.49 -157.95 19.37 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 127.181 2.324 . . . . 0.0 113.526 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -75.44 64.24 1.56 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.781 2.033 . . . . 0.0 112.609 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.6 t80 49.15 -128.53 2.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.96 2.904 . . . . 0.0 112.851 178.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 52.47 43.63 30.8 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.854 1.661 . . . . 0.0 113.06 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.5 m 52.03 63.44 2.24 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.916 1.686 . . . . 0.0 113.836 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 58.5 41.38 22.7 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.796 1.639 . . . . 0.0 113.172 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 79.2 m . . . . . 0 CA--C 1.551 0.998 0 C-N-CA 129.202 3.001 . . . . 0.0 116.533 -179.937 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 120.887 0.375 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.98 -21.43 66.49 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 24.9 m -87.18 134.59 33.51 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.155 0.982 . . . . 0.0 111.697 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.2 t -63.31 -31.06 72.11 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . 0.444 HD22 ' H ' ' A' ' 69' ' ' LEU . 2.6 pt? -104.55 18.78 21.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.889 1.676 . . . . 0.0 115.24 -172.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 61.9 m -127.98 158.96 36.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.132 1.373 . . . . 0.0 111.25 176.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -151.23 112.82 4.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.436 1.094 . . . . 0.0 110.899 169.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m 57.24 12.22 1.3 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 118.028 2.603 . . . . 0.0 118.028 168.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -141.89 152.59 43.72 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.496 1.918 . . . . 0.0 110.754 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -84.29 157.56 21.5 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.244 1.018 . . . . 0.0 112.2 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 33.8 p80 -135.81 178.78 6.78 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.095 2.158 . . . . 0.0 111.028 -172.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.2 t -114.7 166.33 11.86 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.779 1.232 . . . . 0.0 112.841 173.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -61.66 -17.88 57.25 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 127.732 2.413 . . . . 0.0 114.159 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -67.99 -25.77 65.58 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 169.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -92.72 -57.83 2.54 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.762 1.625 . . . . 0.0 110.873 172.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 24.2 p . . . . . 0 CA--C 1.549 0.932 0 C-N-CA 124.986 1.315 . . . . 0.0 112.136 169.717 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -85.76 -14.97 43.61 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.45 55.53 3.22 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.046 1.338 . . . . 0.0 112.467 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -66.47 155.25 38.08 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.693 1.597 . . . . 0.0 113.441 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.05 164.27 30.49 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.634 1.574 . . . . 0.0 111.739 178.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -67.57 158.48 82.47 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 124.36 1.064 . . . . 0.0 112.199 178.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -64.77 -16.03 53.27 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.367 2.712 . . . . 0.0 116.659 -174.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.302 21.8 ptmt 52.72 -1.81 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 129.479 3.112 . . . . 0.0 118.679 179.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 70.0 t -83.32 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.979 1.312 . . . . 0.0 109.709 168.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . 0.45 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 3.2 tm? -124.06 -46.83 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.37 1.468 . . . . 0.0 114.364 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . 0.45 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 85.6 Cg_endo -73.45 158.77 47.58 Favored 'Trans proline' 0 C--N 1.355 0.906 0 CA-C-N 122.097 1.785 . . . . 0.0 113.347 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 125.671 1.588 . . . . 0.0 112.758 -175.422 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 17.6 t . . . . . 0 CA--C 1.55 0.948 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -136.52 24.32 3.17 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.802 1.641 . . . . 0.0 112.488 172.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -139.3 167.61 21.69 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.22 1.808 . . . . 0.0 111.725 -171.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.285 18.6 p 47.25 23.65 0.35 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.999 2.52 . . . . 0.0 117.341 173.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.54 -31.64 2.01 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.707 1.622 . . . . 0.0 114.283 178.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 138.24 -161.33 25.61 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.977 1.275 . . . . 0.0 114.719 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -77.39 -176.74 4.32 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.222 1.809 . . . . 0.0 114.377 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.14 -53.53 4.87 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.153 1.358 . . . . 0.0 114.742 173.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -77.69 142.28 38.88 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 40.79 22.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 129.767 3.227 . . . . 0.0 117.877 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.25 -23.31 52.76 Favored Glycine 0 CA--C 1.536 1.353 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 -161.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -61.18 -44.6 97.05 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.054 1.342 . . . . 0.0 112.963 173.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -105.76 -30.73 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.259 1.824 . . . . 0.0 113.031 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 53.6 t . . . . . 0 CA--C 1.538 0.487 0 C-N-CA 124.728 1.211 . . . . 0.0 110.445 179.697 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.29 -55.63 0.88 Allowed Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.304 1.041 . . . . 0.0 112.421 162.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.16 -37.03 3.68 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.949 2.432 . . . . 0.0 113.927 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.336 0.0 OUTLIER 53.12 -31.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 131.51 3.924 . . . . 0.0 118.271 -171.235 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.58 -179.79 8.53 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.488 1.915 . . . . 0.0 111.522 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -101.47 146.41 27.67 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.692 -0.63 . . . . 0.0 109.33 144.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.4 t30 59.45 -69.88 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 165.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.1 p -86.13 -15.35 41.38 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.611 1.565 . . . . 0.0 115.167 -170.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 m 55.92 30.73 16.53 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 160.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -142.62 19.79 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 175.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -144.59 143.08 30.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.166 1.386 . . . . 0.0 111.202 -177.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.98 -12.98 61.02 Favored Glycine 0 N--CA 1.475 1.244 0 N-CA-C 116.826 1.49 . . . . 0.0 116.826 -162.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -68.97 93.38 0.56 Allowed 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.576 1.188 . . . . 0.0 112.37 171.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -53.49 175.62 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.987 1.715 . . . . 0.0 113.595 172.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -62.01 0.94 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.943 1.297 . . . . 0.0 114.061 -165.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.48 -9.18 59.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -84.56 -31.55 24.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.075 1.35 . . . . 0.0 111.974 173.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.4 t -64.64 136.81 96.92 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.843 1.657 . . . . 0.0 111.073 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 CA--C 1.537 0.667 0 C-N-CA 123.797 2.998 . . . . 0.0 114.713 -170.851 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.9 pp . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.0 mt -125.14 137.15 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 111.027 -167.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 32.8 t -61.35 109.37 1.13 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.17 1.388 . . . . 0.0 111.708 170.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.6 m 47.38 16.97 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 127.722 2.409 . . . . 0.0 116.724 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 48.45 34.18 4.58 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.98 1.312 . . . . 0.0 113.347 -168.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.7 p -96.93 -22.77 16.67 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -164.61 157.69 30.16 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.851 1.215 . . . . 0.0 112.151 177.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.56 121.89 14.97 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.318 1.059 . . . . 0.0 112.631 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.5 t -59.13 -26.89 65.11 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -75.27 -22.16 57.99 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -141.41 -18.25 0.79 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 -168.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 149.92 45.74 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.077 1.308 . . . . 0.0 112.85 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -147.08 167.74 23.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.589 1.556 . . . . 0.0 110.029 176.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.7 t -38.81 -45.64 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.986 2.115 . . . . 0.0 115.899 -172.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -73.59 -15.89 61.26 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -127.38 0.55 6.32 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.104 1.762 . . . . 0.0 113.539 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.8 t -40.3 -50.99 6.41 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 128.005 2.522 . . . . 0.0 115.81 -172.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -79.33 -2.83 12.61 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 123.192 2.595 . . . . 0.0 116.483 -176.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -128.83 11.29 6.1 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -162.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.27 24.14 4.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.2 mt -128.77 62.96 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 126.578 1.951 . . . . 0.0 108.742 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -145.4 150.26 36.22 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.265 -1.522 . . . . 0.0 113.99 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -76.25 168.0 20.84 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.258 1.023 . . . . 0.0 112.042 174.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 21.2 m -85.1 -18.95 32.69 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.2 tppt? -127.95 -9.01 5.46 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.043 1.337 . . . . 0.0 114.37 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 p -145.55 167.33 23.28 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.033 1.333 . . . . 0.0 111.776 174.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -76.89 132.19 38.98 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.43 -0.794 . . . . 0.0 112.566 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.63 141.85 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.836 2.454 . . . . 0.0 116.186 179.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.2 m -80.33 -21.41 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 O-C-N 120.451 -1.405 . . . . 0.0 110.797 157.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.92 -6.48 24.85 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.949 1.738 . . . . 0.0 116.399 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . 0.263 0.7 OUTLIER -87.64 -132.49 0.07 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.746 1.273 . . . . 0.0 113.122 172.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -61.6 126.42 27.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -157.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 45.85 30.84 0.93 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.647 2.379 . . . . 0.0 113.761 -175.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.1 p 49.8 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.805 3.642 . . . . 0.0 119.061 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -147.34 8.55 0.92 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.696 1.998 . . . . 0.0 112.982 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.8 m . . . . . 0 CA--C 1.563 1.48 0 N-CA-C 117.306 2.335 . . . . 0.0 117.306 -170.928 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 -70.26 -12.66 61.74 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.412 1.485 . . . . 0.0 113.238 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.3 m -111.8 166.83 10.85 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.22 1.408 . . . . 0.0 112.131 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 57.1 p -116.09 -3.43 12.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.894 1.677 . . . . 0.0 112.882 -158.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 pp -132.15 -3.42 3.52 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.063 2.145 . . . . 0.0 113.252 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 67.3 m -86.7 157.15 19.71 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.575 1.15 . . . . 0.0 112.191 -177.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptt -133.99 7.23 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.7 t -149.27 154.4 38.98 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.676 1.19 . . . . 0.0 112.138 175.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -83.3 -28.05 29.37 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.283 1.433 . . . . 0.0 114.454 -174.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -88.82 70.22 8.67 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.517 1.127 . . . . 0.0 111.942 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.9 p-80 -139.55 175.56 9.46 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.083 1.353 . . . . 0.0 112.322 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -133.49 165.34 25.1 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.691 1.597 . . . . 0.0 111.336 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -58.56 -32.61 69.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.204 1.402 . . . . 0.0 112.981 175.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -74.47 -23.06 58.83 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.646 1.178 . . . . 0.0 112.985 173.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -103.85 -12.24 17.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.388 1.875 . . . . 0.0 114.059 -173.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 46.3 m . . . . . 0 CA--C 1.55 0.961 0 C-N-CA 125.346 1.458 . . . . 0.0 111.55 176.96 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 . . . . . 0 CA--C 1.547 0.86 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -75.93 172.8 12.1 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.314 1.046 . . . . 0.0 111.844 176.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -61.84 122.74 16.17 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.349 -0.845 . . . . 0.0 111.286 176.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -146.33 147.77 31.69 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.19 1.796 . . . . 0.0 111.567 -173.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 53.98 -176.66 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.397 1.479 . . . . 0.0 113.773 -165.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.15 161.8 33.04 Favored Pre-proline 0 N--CA 1.476 0.838 0 C-N-CA 125.354 1.461 . . . . 0.0 112.436 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.37 -172.66 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 124.296 3.331 . . . . 0.0 113.819 168.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -66.8 9.73 0.17 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 126.84 2.056 . . . . 0.0 115.278 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t 65.12 121.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 128.891 2.877 . . . . 0.0 113.489 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -72.05 151.75 92.71 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.003 0.921 . . . . 0.0 112.623 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -64.9 128.42 20.77 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.401 2.068 . . . . 0.0 113.025 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 . . . . . 0 N--CA 1.473 0.684 0 C-N-CA 124.071 0.948 . . . . 0.0 112.26 169.696 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 31.9 t . . . . . 0 CA--C 1.539 0.52 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -138.54 -10.11 1.41 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -176.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -90.11 -44.82 9.54 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -161.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.8 p -119.06 5.11 11.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.266 1.826 . . . . 0.0 113.558 177.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 170.8 -172.28 44.18 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.428 1.966 . . . . 0.0 111.44 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -75.92 177.3 50.24 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 123.545 0.593 . . . . 0.0 113.341 170.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -54.27 140.19 33.81 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.378 1.471 . . . . 0.0 111.908 173.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 156.83 -9.34 0.25 Allowed Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.776 1.87 . . . . 0.0 117.776 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -137.49 -167.26 2.09 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.955 1.877 . . . . 0.0 112.942 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -69.42 45.39 0.06 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.313 1.845 . . . . 0.0 113.236 173.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -53.46 -21.14 12.64 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 128.188 2.804 . . . . 0.0 115.573 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -75.57 -44.56 42.6 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.304 1.052 . . . . 0.0 112.825 171.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -88.3 -11.42 46.5 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.511 1.524 . . . . 0.0 113.167 -177.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 2.1 p . . . . . 0 CA--C 1.548 0.892 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -176.308 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.71 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -84.16 -49.18 0.66 Allowed Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 125.092 1.357 . . . . 0.0 113.19 159.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.2 -29.83 6.06 Favored 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.796 2.331 . . . . 0.0 114.857 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? 62.33 -63.45 0.1 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.968 2.507 . . . . 0.0 114.647 -172.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.4 t -156.82 172.3 18.88 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.758 2.423 . . . . 0.0 111.245 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -73.51 -39.62 64.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.13 -0.981 . . . . 0.0 113.417 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -155.97 -58.34 0.1 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.9 1.28 . . . . 0.0 113.105 -171.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.9 p -79.01 -9.74 59.62 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 46.62 51.76 11.77 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 159.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -143.84 6.12 1.38 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -175.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -150.41 157.52 43.13 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.295 1.838 . . . . 0.0 110.273 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.14 -9.52 42.1 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.267 1.267 . . . . 0.0 116.267 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -72.97 94.49 1.87 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.962 1.381 . . . . 0.0 113.098 175.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -54.75 175.75 0.05 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.857 2.063 . . . . 0.0 113.79 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.01 -63.66 0.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.827 2.051 . . . . 0.0 114.433 -172.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -82.6 -12.47 57.67 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.324 1.85 . . . . 0.0 115.382 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -83.47 -23.42 32.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.619 1.168 . . . . 0.0 111.992 171.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.9 t -61.25 -52.8 68.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 120.908 -1.12 . . . . 0.0 113.386 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo . . . . . 0 CA--C 1.542 0.922 0 C-N-CA 122.849 2.366 . . . . 0.0 111.936 168.222 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.4 mt . . . . . 0 CA--C 1.543 0.679 0 CA-C-O 121.165 0.507 . . . . 0.0 110.095 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.4 pt -54.69 128.68 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.877 1.271 . . . . 0.0 112.623 178.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 17.3 p -78.99 -21.98 46.21 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 t -157.39 -162.63 1.23 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.125 2.17 . . . . 0.0 110.014 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.18 49.29 0.67 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.285 1.834 . . . . 0.0 112.253 174.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.3 p -147.85 150.51 34.3 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.636 1.974 . . . . 0.0 110.954 177.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.11 -179.12 28.75 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 124.958 1.266 . . . . 0.0 113.363 -167.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -107.3 145.95 32.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.426 1.49 . . . . 0.0 110.662 172.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.1 t -66.88 -5.28 11.82 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -114.03 -11.17 12.78 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 126.267 1.827 . . . . 0.0 114.178 170.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -157.27 105.7 2.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.532 1.533 . . . . 0.0 111.205 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -130.83 -21.34 2.74 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -64.23 -40.31 95.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.691 1.132 . . . . 0.0 112.143 173.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t 50.03 -152.78 0.15 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.673 1.189 . . . . 0.0 111.878 -170.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.8 mmp_? -80.43 -38.59 29.86 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.592 -1.318 . . . . 0.0 110.283 150.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -136.92 87.67 2.3 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.324 1.45 . . . . 0.0 111.784 177.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t 17.04 -74.1 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 129.572 3.149 . . . . 0.0 117.654 157.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -71.09 72.89 2.06 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 124.612 3.541 . . . . 0.0 112.995 177.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 tptm -134.33 -173.34 3.25 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.526 2.33 . . . . 0.0 110.958 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.09 -41.36 0.19 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 128.481 2.713 . . . . 0.0 116.956 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.1 mt -133.61 93.7 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.68 1.592 . . . . 0.0 109.285 -174.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -139.59 167.45 22.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.661 1.584 . . . . 0.0 111.86 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 94.5 m -70.34 161.49 30.32 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.292 1.044 . . . . 0.0 111.996 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.4 m -71.41 -20.78 62.08 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -134.41 2.35 3.24 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -175.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.8 p -152.37 165.95 33.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.769 1.227 . . . . 0.0 112.288 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.7 134.1 39.32 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.557 1.543 . . . . 0.0 113.807 -172.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 59.23 156.99 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 127.225 2.21 . . . . 0.0 115.296 -172.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.2 m -88.85 -22.76 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 120.222 -1.549 . . . . 0.0 110.196 153.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.83 -20.11 63.91 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 126.402 1.953 . . . . 0.0 115.512 -173.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -79.87 -14.35 58.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -169.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -150.77 124.4 9.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.974 0.91 . . . . 0.0 111.793 174.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 52.97 12.05 0.25 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 126.854 2.062 . . . . 0.0 115.138 -173.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.304 33.0 p 48.4 23.95 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.917 2.087 . . . . 0.0 115.183 -161.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -147.35 -36.11 0.23 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 25.4 t . . . . . 0 CA--C 1.556 1.178 0 C-N-CA 126.548 1.939 . . . . 0.0 114.2 -178.522 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.5 t . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 62.6 -36.37 0.13 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 128.226 2.61 . . . . 0.0 115.809 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.5 m -78.59 -1.11 32.55 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.519 1.927 . . . . 0.0 114.902 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 15.0 t 56.36 -51.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 129.657 3.183 . . . . 0.0 118.59 -177.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 pp -86.37 -13.94 44.95 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.503 1.521 . . . . 0.0 113.828 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 96.7 m -79.67 168.79 18.88 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.308 1.043 . . . . 0.0 112.381 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -111.0 -30.33 7.55 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 177.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.2 p -87.27 172.89 9.54 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.388 1.475 . . . . 0.0 112.906 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 162.61 7.54 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.129 0.972 . . . . 0.0 113.376 174.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -52.82 147.05 9.51 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -173.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -148.19 17.34 1.07 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.564 1.545 . . . . 0.0 112.914 172.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.7 p -75.22 -38.77 60.5 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -152.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 47.89 34.78 4.24 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.657 1.583 . . . . 0.0 113.248 -169.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 56.73 18.04 3.51 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 126.546 1.938 . . . . 0.0 115.528 -172.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.3 tpt85 -125.08 -30.14 3.24 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.217 2.207 . . . . 0.0 114.136 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.8 t . . . . . 0 CA--C 1.553 1.081 0 C-N-CA 125.543 1.537 . . . . 0.0 112.441 -166.914 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 34.6 t0 . . . . . 0 CA--C 1.545 0.752 0 CA-C-O 120.929 0.395 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -110.96 157.42 19.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.23 1.812 . . . . 0.0 112.236 -174.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.92 163.87 31.19 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.592 1.557 . . . . 0.0 112.51 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 56.19 23.96 7.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.54 1.936 . . . . 0.0 114.893 176.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.41 156.9 29.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.362 1.065 . . . . 0.0 112.949 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -139.47 136.7 17.98 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 126.563 1.945 . . . . 0.0 110.57 178.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.91 143.37 54.77 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.731 2.287 . . . . 0.0 111.734 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -126.54 113.33 16.65 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.942 1.297 . . . . 0.0 110.824 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.12 19.21 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 126.391 1.876 . . . . 0.0 112.267 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.9 mt -72.56 155.76 90.79 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 125.49 1.516 . . . . 0.0 112.409 -176.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -62.13 152.9 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.062 2.508 . . . . 0.0 112.397 172.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 . . . . . 0 N--CA 1.47 0.535 0 C-N-CA 124.045 0.938 . . . . 0.0 112.794 -177.19 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.4 t . . . . . 0 CA--C 1.548 0.891 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -56.66 -35.84 68.86 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.294 -1.504 . . . . 0.0 114.084 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.05 -13.76 62.37 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -86.34 -6.43 58.95 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.985 1.714 . . . . 0.0 112.743 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 114.99 -7.64 21.56 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.313 1.911 . . . . 0.0 114.384 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 165.14 149.65 5.92 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-N 118.614 1.207 . . . . 0.0 113.89 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -65.2 -17.91 64.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.491 1.917 . . . . 0.0 114.257 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -71.86 -5.4 61.18 Favored Glycine 0 CA--C 1.538 1.482 0 N-CA-C 118.602 2.201 . . . . 0.0 118.602 -164.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -147.35 150.68 35.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.897 2.349 . . . . 0.0 115.535 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 39.16 29.44 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 129.978 3.311 . . . . 0.0 117.658 164.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.34 -11.7 35.09 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.961 1.267 . . . . 0.0 115.025 -174.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -67.86 -33.51 74.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.499 1.519 . . . . 0.0 113.92 174.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -151.39 -26.66 0.2 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -166.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 14.9 p . . . . . 0 CA--C 1.544 0.734 0 CA-C-N 120.579 1.536 . . . . 0.0 113.535 -168.306 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.568 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -75.41 -51.4 3.3 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.001 0.92 . . . . 0.0 112.471 159.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -76.05 -41.39 0.51 Allowed 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.548 2.166 . . . . 0.0 114.74 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.295 0.1 OUTLIER 50.85 -33.95 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 131.343 3.857 . . . . 0.0 119.286 -171.98 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.9 t -157.79 164.49 36.97 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.416 1.886 . . . . 0.0 112.652 171.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -74.54 -40.21 61.86 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.515 1.126 . . . . 0.0 113.307 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -158.37 -31.3 0.07 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.741 1.617 . . . . 0.0 113.101 -171.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 m -73.21 -163.82 0.16 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.856 0.862 . . . . 0.0 110.654 169.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.1 p -135.87 155.69 49.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.893 -1.129 . . . . 0.0 112.9 170.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 56.51 -173.59 0.07 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.87 2.068 . . . . 0.0 114.716 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.265 9.1 ttp180 65.6 27.19 11.52 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.2 2.2 . . . . 0.0 115.659 172.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.48 -17.02 0.66 Allowed Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.907 1.923 . . . . 0.0 117.907 160.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -81.14 77.63 8.01 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.202 1.501 . . . . 0.0 111.142 -178.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -56.99 178.74 0.05 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 128.107 2.563 . . . . 0.0 113.693 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.21 -64.44 0.32 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.616 1.966 . . . . 0.0 114.252 -171.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -78.71 -13.97 59.54 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.083 1.753 . . . . 0.0 115.296 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.87 -14.78 31.08 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.336 1.454 . . . . 0.0 113.139 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.94 -53.91 45.12 Favored Pre-proline 0 CA--C 1.549 0.923 0 CA-C-O 118.08 -0.962 . . . . 0.0 113.018 171.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo . . . . . 0 CA--C 1.543 0.933 0 C-N-CA 122.199 1.932 . . . . 0.0 111.68 169.636 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.8 mm -107.17 134.62 48.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.645 1.578 . . . . 0.0 110.631 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.7 p -87.59 141.61 28.48 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.323 1.059 . . . . 0.0 112.272 173.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.2 p -70.17 137.5 51.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.314 1.446 . . . . 0.0 114.119 -164.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 50.66 14.29 0.17 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.121 1.768 . . . . 0.0 115.217 -169.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -150.39 29.49 0.7 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.183 0.993 . . . . 0.0 112.159 -163.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.7 153.99 24.86 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 120.297 -1.502 . . . . 0.0 114.863 -176.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -142.58 140.72 31.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.557 1.543 . . . . 0.0 110.101 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -21.54 64.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -171.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -138.84 15.0 2.68 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -138.7 -1.06 1.87 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -172.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 37.0 t-80 -106.37 150.19 26.25 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.068 1.347 . . . . 0.0 113.226 -172.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -142.37 147.21 35.88 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.158 1.383 . . . . 0.0 111.188 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.5 t -54.62 -40.95 69.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.692 1.597 . . . . 0.0 114.47 -172.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -79.13 -13.38 59.77 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -104.49 -18.21 14.46 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.218 1.407 . . . . 0.0 113.42 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' CYS . . . . . 0.437 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.288 1.2 m 24.43 -88.63 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 129.989 3.316 . . . . 0.0 116.561 172.44 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.437 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 25.0 Cg_exo -70.17 -19.95 33.54 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.284 1.851 . . . . 0.0 116.709 -158.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.03 1.91 22.36 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -174.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.52 60.59 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -175.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 mt -130.21 141.22 46.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.813 1.645 . . . . 0.0 108.854 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -147.6 161.44 41.13 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.0 t -67.04 156.91 34.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.525 1.53 . . . . 0.0 112.036 168.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.4 m -65.71 -17.72 64.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.18 1.392 . . . . 0.0 114.63 174.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -129.63 -2.57 4.81 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.33 1.452 . . . . 0.0 114.696 -171.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 31.1 p -149.27 156.01 41.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.368 1.067 . . . . 0.0 111.835 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.39 151.52 45.11 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.647 -0.658 . . . . 0.0 112.163 174.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 59.18 175.06 0.07 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.739 1.216 . . . . 0.0 113.278 -170.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.8 m -75.94 71.14 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 O-C-N 119.813 -1.805 . . . . 0.0 109.66 167.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.39 -116.29 0.09 OUTLIER Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.458 1.98 . . . . 0.0 117.132 -159.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -67.9 -7.92 32.4 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 117.704 2.483 . . . . 0.0 117.704 -154.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -128.93 118.67 23.04 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.475 1.034 . . . . 0.0 112.24 176.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 43.98 26.16 0.13 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.724 2.81 . . . . 0.0 116.66 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.0 m 52.66 30.25 8.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.31 1.444 . . . . 0.0 114.786 -172.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -145.02 -34.34 0.35 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.127 1.371 . . . . 0.0 113.38 -174.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 86.7 m . . . . . 0 CA--C 1.555 1.17 0 C-N-CA 126.189 1.796 . . . . 0.0 114.813 -174.835 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 121.061 0.457 . . . . 0.0 112.044 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -103.69 6.7 37.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.285 1.434 . . . . 0.0 113.735 -173.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.4 m -74.11 -17.67 60.91 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 62.86 -47.76 0.2 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.212 2.605 . . . . 0.0 117.608 -166.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -86.36 0.07 54.8 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 91.8 m -111.37 156.28 21.83 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.866 1.266 . . . . 0.0 112.854 -178.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -114.48 160.95 18.62 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 126.027 1.731 . . . . 0.0 109.619 161.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.8 m -76.04 -20.83 57.44 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.638 1.347 . . . . 0.0 114.638 -172.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -66.84 134.13 51.47 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.521 0.728 . . . . 0.0 112.262 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.2 tttp 47.61 35.22 4.18 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.764 2.025 . . . . 0.0 114.221 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -82.51 131.61 35.21 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.824 0.85 . . . . 0.0 112.668 -171.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.8 m -94.3 110.96 22.68 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.914 0.886 . . . . 0.0 111.956 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.86 135.45 57.33 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.782 0.833 . . . . 0.0 111.578 -177.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 54.52 20.07 2.67 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.355 1.862 . . . . 0.0 115.669 -173.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -130.87 -40.04 1.2 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.43 1.492 . . . . 0.0 113.356 177.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.8 m . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 128.655 2.782 . . . . 0.0 115.667 -179.41 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -150.4 170.91 17.93 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.101 1.761 . . . . 0.0 112.087 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -97.28 141.91 29.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.387 1.075 . . . . 0.0 112.296 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -137.15 -59.2 0.7 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 125.25 1.42 . . . . 0.0 112.869 -172.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.66 157.04 36.02 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.973 0.909 . . . . 0.0 112.945 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -148.58 146.43 22.36 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.624 1.57 . . . . 0.0 112.347 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -70.69 -33.86 12.4 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.741 2.294 . . . . 0.0 114.822 -178.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -138.17 158.35 44.48 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.414 1.885 . . . . 0.0 111.633 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -121.05 -4.65 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.375 1.47 . . . . 0.0 113.777 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 21.2 tp -68.71 124.41 90.08 Favored Pre-proline 0 CA--C 1.551 1.01 0 O-C-N 121.183 -0.948 . . . . 0.0 110.974 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -80.64 159.42 21.98 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.84 2.36 . . . . 0.0 113.774 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 10.5 p90 . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 127.72 2.408 . . . . 0.0 109.607 173.797 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -70.87 -17.64 62.72 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -168.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -64.6 -32.09 73.59 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.159 0.89 . . . . 0.0 111.81 170.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 55.6 m -99.1 -3.64 34.15 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.393 1.877 . . . . 0.0 113.3 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.66 8.74 76.31 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.431 1.491 . . . . 0.0 115.801 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -106.94 -157.97 21.2 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 126.404 1.954 . . . . 0.0 113.606 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -140.49 150.99 44.45 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.051 2.14 . . . . 0.0 111.601 174.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 88.2 -152.18 23.37 Favored Glycine 0 CA--C 1.54 1.636 0 N-CA-C 116.271 1.268 . . . . 0.0 116.271 176.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.305 0.6 OUTLIER 47.52 -161.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 128.952 2.901 . . . . 0.0 115.661 -170.014 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -67.07 36.89 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.729 2.012 . . . . 0.0 113.736 171.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.17 -30.04 16.6 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 126.53 2.014 . . . . 0.0 113.877 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.1 -38.62 65.55 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.518 1.927 . . . . 0.0 114.189 172.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -97.68 -34.16 11.03 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.798 1.639 . . . . 0.0 111.798 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.3 t . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.486 1.514 . . . . 0.0 113.839 -177.385 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 119.348 -0.358 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 57.32 28.51 15.36 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.751 1.621 . . . . 0.0 115.145 168.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -83.83 111.7 19.44 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.073 -1.017 . . . . 0.0 113.072 -171.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.68 -51.14 22.3 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 124.259 1.024 . . . . 0.0 113.289 165.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.44 -38.25 0.78 Allowed 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 122.616 2.211 . . . . 0.0 114.267 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.403 0.0 OUTLIER 49.73 -42.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 130.843 3.657 . . . . 0.0 118.537 -169.526 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.7 t -159.66 160.57 34.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.685 1.994 . . . . 0.0 111.693 174.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -71.01 -29.25 65.14 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 173.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -161.64 -35.67 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.9 m -76.19 -21.19 56.78 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.8 m 58.49 11.87 1.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 119.012 2.967 . . . . 0.0 119.012 171.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -133.08 -3.25 3.15 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 -175.082 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -126.14 160.39 30.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.383 1.473 . . . . 0.0 111.857 -172.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.01 -19.23 69.7 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.03 92.57 3.18 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -57.38 179.21 0.06 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.891 2.077 . . . . 0.0 114.049 170.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -63.8 0.53 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.489 1.916 . . . . 0.0 114.475 -170.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -79.22 -11.46 59.96 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.57 1.548 . . . . 0.0 114.887 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -81.04 -37.82 28.45 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.175 0.99 . . . . 0.0 111.475 176.301 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.2 t -58.34 -37.4 54.5 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -69.49 -17.2 38.93 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.777 2.318 . . . . 0.0 114.754 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -96.15 150.31 20.66 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.485 1.514 . . . . 0.0 111.561 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm -86.19 59.35 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 123.099 1.428 . . . . 0.0 110.403 -177.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.3 mm -87.88 133.87 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 127.442 2.297 . . . . 0.0 108.546 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 m -61.81 142.41 57.33 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.989 -0.444 . . . . 0.0 110.812 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 73.5 m -51.1 -30.35 15.92 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 -159.477 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -142.26 11.79 1.95 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 174.657 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 44.3 m -64.59 -48.52 74.67 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.58 -1.325 . . . . 0.0 113.03 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . 0.452 ' HA2' ' H ' ' A' ' 43' ' ' ILE . . . -165.79 178.45 40.54 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -153.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.63 138.8 47.69 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.36 1.464 . . . . 0.0 109.915 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 t -56.37 -19.24 13.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.959 1.704 . . . . 0.0 114.361 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -65.65 -19.26 65.84 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 172.445 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -139.23 -34.87 0.57 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.376 1.47 . . . . 0.0 114.485 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -66.51 123.97 21.5 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.144 1.778 . . . . 0.0 112.053 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -155.22 169.37 24.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.42 1.488 . . . . 0.0 110.673 -174.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -63.12 -13.15 33.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.003 1.721 . . . . 0.0 115.509 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -109.35 2.55 20.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.295 1.838 . . . . 0.0 113.652 170.355 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -136.55 0.71 2.52 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -172.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.3 t -37.29 -51.88 2.37 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.194 2.198 . . . . 0.0 114.93 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.87 -8.45 19.06 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.436 2.758 . . . . 0.0 116.066 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -102.1 5.99 40.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.362 1.865 . . . . 0.0 113.653 -173.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -86.81 -152.64 0.19 Allowed 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.122 1.369 . . . . 0.0 113.355 -173.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . 0.452 ' H ' ' HA2' ' A' ' 29' ' ' GLY . 95.3 mt -55.43 -40.37 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.621 1.569 . . . . 0.0 113.48 -169.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -118.74 154.33 32.96 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 24.6 p -83.29 -34.29 25.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.855 1.262 . . . . 0.0 114.031 -175.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.0 t -159.37 -155.77 0.48 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.097 1.359 . . . . 0.0 111.322 -170.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -62.79 -24.99 68.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 127.013 2.125 . . . . 0.0 112.692 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 24.4 p -89.82 155.08 19.41 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.045 1.338 . . . . 0.0 112.467 172.373 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -72.3 134.17 45.39 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -166.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 60.26 148.48 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 128.827 2.851 . . . . 0.0 117.006 176.331 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.6 m -71.8 -15.66 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 119.783 -1.823 . . . . 0.0 110.714 161.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.91 18.87 1.32 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 128.025 2.726 . . . . 0.0 116.457 -170.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.0 155.31 44.64 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.809 1.304 . . . . 0.0 112.171 174.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.9 t80 59.9 137.64 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 128.069 2.547 . . . . 0.0 115.722 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.99 148.58 20.98 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.483 1.113 . . . . 0.0 112.486 -175.251 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 m 57.32 32.68 22.15 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -168.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 54.96 45.88 25.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.625 1.97 . . . . 0.0 113.495 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.7 t 49.8 75.93 0.6 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 126.881 2.072 . . . . 0.0 113.585 -175.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -70.94 162.35 42.98 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.531 2.82 . . . . 0.0 112.664 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -66.81 139.89 57.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.385 0.674 . . . . 0.0 111.928 173.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -98.81 104.21 16.23 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.864 1.266 . . . . 0.0 111.539 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -69.95 161.84 29.22 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.867 0.867 . . . . 0.0 111.695 168.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -77.16 9.27 3.18 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt 61.94 170.1 0.12 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 127.831 2.453 . . . . 0.0 114.573 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.5 t -85.91 147.72 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.495 1.518 . . . . 0.0 110.985 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -69.98 -35.84 74.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.489 0.716 . . . . 0.0 112.019 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 22.2 m -76.55 156.74 32.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 123.688 1.709 . . . . 0.0 112.168 166.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 36.9 p -113.31 -15.26 12.71 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.673 2.389 . . . . 0.0 111.702 -161.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.19 -21.46 21.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.078 1.751 . . . . 0.0 111.861 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 76.0 m -99.5 -22.35 15.53 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.715 1.206 . . . . 0.0 114.222 -164.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.62 -55.48 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 129.617 3.167 . . . . 0.0 118.91 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 58.2 m -112.76 122.37 47.47 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -162.104 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt 56.54 -51.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.746 3.619 . . . . 0.0 119.24 168.18 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -80.33 151.03 29.69 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -160.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 54.84 177.68 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 119.241 3.052 . . . . 0.0 119.241 159.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 68.4 m -139.63 170.61 15.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 127.492 2.317 . . . . 0.0 111.39 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -56.87 -31.76 65.15 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -176.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -73.83 -19.31 60.78 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -102.01 -17.36 16.12 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.227 1.811 . . . . 0.0 112.97 174.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 43.8 t -114.75 88.96 17.47 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 125.851 1.66 . . . . 0.0 112.471 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -59.58 -18.64 48.43 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.299 3.333 . . . . 0.0 115.606 172.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.1 m -72.22 35.38 0.06 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 127.659 2.384 . . . . 0.0 115.916 -173.253 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.4 tt -137.73 136.96 45.64 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 126.843 2.057 . . . . 0.0 109.327 174.632 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -70.13 -7.06 38.53 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 -167.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 86.1 mtt85 -81.18 -16.04 54.02 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.007 1.323 . . . . 0.0 113.733 170.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -82.98 157.9 22.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.656 1.182 . . . . 0.0 112.53 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -76.55 146.21 38.52 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.797 0.839 . . . . 0.0 112.625 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -91.01 155.54 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.77 1.228 . . . . 0.0 112.338 176.419 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -95.75 27.16 3.62 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.376 1.47 . . . . 0.0 112.64 -177.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.9 m -137.53 159.12 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 126.311 1.844 . . . . 0.0 111.758 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.1 t70 57.16 23.6 8.79 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 126.151 1.781 . . . . 0.0 115.573 177.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -75.57 153.89 37.09 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.377 1.471 . . . . 0.0 112.432 171.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -68.09 134.13 50.09 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -172.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -150.68 161.75 42.0 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.776 1.63 . . . . 0.0 111.073 -175.372 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -59.51 156.47 13.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.006 1.322 . . . . 0.0 113.442 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -141.22 175.36 9.71 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 112.433 -176.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? 43.89 59.49 12.45 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 127.497 2.319 . . . . 0.0 115.835 174.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -76.8 70.8 6.37 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.272 3.314 . . . . 0.0 112.62 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -137.16 161.19 36.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.302 2.641 . . . . 0.0 111.104 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 26.9 m -65.1 148.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.141 0.976 . . . . 0.0 112.487 176.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.8 mt -84.92 156.6 60.81 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.281 1.032 . . . . 0.0 112.652 -177.597 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.25 159.6 30.17 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.798 2.999 . . . . 0.0 114.444 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -79.43 153.79 29.41 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.324 1.05 . . . . 0.0 112.931 176.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -86.32 152.89 22.37 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.431 1.092 . . . . 0.0 112.483 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 11.9 t -87.07 136.95 32.74 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 178.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.6 tt -146.5 13.22 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 124.655 1.182 . . . . 0.0 113.398 -169.211 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -94.31 50.82 1.4 Allowed 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 -153.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.6 p 41.72 31.73 0.22 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 129.751 3.22 . . . . 0.0 119.397 166.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.3 t80 60.94 6.46 1.22 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.619 2.367 . . . . 0.0 114.847 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -106.96 -25.02 11.81 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.716 1.607 . . . . 0.0 112.168 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.2 p -145.38 18.43 1.53 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.77 1.628 . . . . 0.0 113.963 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 162.62 -133.94 3.27 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.016 1.293 . . . . 0.0 113.292 175.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.31 -159.64 1.07 Allowed Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.908 1.718 . . . . 0.0 113.014 171.034 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -109.65 150.71 27.86 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.46 1.63 . . . . 0.0 112.941 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 154.57 -103.46 0.24 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 115.265 0.866 . . . . 0.0 115.265 -177.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -70.67 151.31 45.07 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 -153.218 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 45.89 28.14 0.56 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.409 2.283 . . . . 0.0 116.835 164.039 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.21 -16.47 34.29 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.725 1.155 . . . . 0.0 115.669 -170.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.43 -33.64 76.0 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.754 1.621 . . . . 0.0 113.958 173.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -138.6 -21.14 1.02 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.951 1.301 . . . . 0.0 114.367 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.6 t -79.54 55.91 2.07 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 125.524 1.53 . . . . 0.0 111.135 172.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -149.64 146.29 27.2 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 128.356 2.662 . . . . 0.0 110.518 -171.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -123.13 -39.56 2.47 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 176.366 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? . . . . . 0 C--O 1.252 1.209 0 C-N-CA 126.096 1.758 . . . . 0.0 112.785 -171.818 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 119.559 -0.258 . . . . 0.0 111.693 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -88.71 150.82 22.79 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.858 0.863 . . . . 0.0 112.147 175.373 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.92 61.54 6.01 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.38 1.072 . . . . 0.0 113.36 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.05 61.08 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 123.993 0.917 . . . . 0.0 112.061 164.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.42 -46.02 0.23 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.551 2.167 . . . . 0.0 113.196 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.252 1.8 pttm 41.98 -165.72 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.324 1.45 . . . . 0.0 112.45 -149.154 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 m -56.2 155.38 6.75 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.077 -1.64 . . . . 0.0 114.442 178.614 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -61.18 -44.33 97.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.439 1.496 . . . . 0.0 114.636 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -157.57 -34.61 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.335 2.654 . . . . 0.0 109.974 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.9 t -55.61 168.48 0.41 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.486 1.514 . . . . 0.0 111.309 153.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.2 m -134.54 76.51 1.64 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -175.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -132.92 161.01 35.38 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.268 1.427 . . . . 0.0 110.586 162.534 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -78.15 -32.82 50.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.933 1.293 . . . . 0.0 112.822 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -73.76 -177.64 35.85 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 124.666 1.127 . . . . 0.0 112.81 169.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.331 0.6 OUTLIER 21.62 64.92 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 128.006 2.523 . . . . 0.0 114.85 -176.181 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.47 -178.28 0.18 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.438 1.895 . . . . 0.0 114.103 -174.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -22.72 -69.98 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 127.782 2.433 . . . . 0.0 115.068 -174.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -77.06 -14.29 59.84 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.059 1.744 . . . . 0.0 115.645 -178.043 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.33 -26.34 16.61 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.567 1.947 . . . . 0.0 113.219 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -56.94 -46.7 99.84 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.057 1.343 . . . . 0.0 114.437 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -93.34 -4.74 3.01 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.892 2.395 . . . . 0.0 113.822 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -83.02 158.29 22.56 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.015 1.116 . . . . 0.0 114.015 -162.726 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.5 mt -122.46 133.5 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.908 1.683 . . . . 0.0 109.972 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.0 mt -118.98 58.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.426 1.49 . . . . 0.0 109.585 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.5 m 49.3 50.92 17.26 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.702 1.601 . . . . 0.0 113.541 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.1 m 56.51 46.52 20.44 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.709 1.204 . . . . 0.0 113.667 -173.509 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 12.1 t80 56.64 56.01 5.91 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.574 1.95 . . . . 0.0 113.558 -177.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 p -72.04 -30.09 64.83 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.052 -1.03 . . . . 0.0 112.48 173.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -177.69 -159.44 22.62 Favored Glycine 0 CA--C 1.53 0.986 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 -169.005 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.16 174.22 10.36 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.364 1.066 . . . . 0.0 111.613 173.009 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.2 t -110.12 -18.87 13.23 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -177.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -97.04 -39.2 9.45 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.862 -1.149 . . . . 0.0 113.829 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -85.86 11.73 10.66 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.766 1.227 . . . . 0.0 112.433 169.38 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -70.99 126.44 29.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.668 1.987 . . . . 0.0 112.681 -174.059 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -152.0 150.59 30.15 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.66 1.184 . . . . 0.0 111.031 171.786 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.1 m -61.35 -27.43 68.5 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.593 1.557 . . . . 0.0 114.616 -171.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -75.67 -29.96 59.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.797 1.239 . . . . 0.0 113.149 174.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.2 m170 -101.47 -28.39 12.59 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -170.281 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.3 m -5.03 -75.22 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 129.833 3.253 . . . . 0.0 117.7 -174.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -76.87 -12.76 17.87 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.12 2.546 . . . . 0.0 115.574 -172.705 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -92.52 33.03 1.14 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.478 1.911 . . . . 0.0 113.02 -172.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -110.51 -38.16 5.28 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -163.873 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 58.6 mt -128.19 126.73 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.87 0.868 . . . . 0.0 111.681 -167.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.89 158.09 43.95 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 127.135 2.174 . . . . 0.0 110.113 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.1 t -75.96 143.64 41.45 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.453 0.701 . . . . 0.0 110.96 173.311 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.1 p -61.13 -37.4 82.69 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.929 1.292 . . . . 0.0 114.034 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -122.14 -7.7 8.81 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.742 1.617 . . . . 0.0 114.619 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 39.7 m -117.03 8.04 13.27 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 61.65 0.6 0.5 Allowed 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 119.119 3.007 . . . . 0.0 119.119 166.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -141.64 148.5 39.26 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 120.78 1.627 . . . . 0.0 112.73 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.292 11.2 m 53.55 -9.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 1 N-CA-C 121.847 4.017 . . . . 0.0 121.847 164.229 . . . . . . . . 3 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 117.02 -177.22 16.59 Favored Glycine 0 N--CA 1.48 1.567 0 CA-C-N 121.136 1.789 . . . . 0.0 114.308 171.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -117.98 0.04 11.78 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 115.779 1.77 . . . . 0.0 115.779 -170.292 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -83.44 153.32 24.54 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.581 -1.324 . . . . 0.0 111.908 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -60.65 -24.85 65.89 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -167.531 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -80.48 -12.4 59.55 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -132.79 -19.02 2.35 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -172.832 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 13.4 t -69.6 137.26 88.22 Favored Pre-proline 0 CA--C 1.548 0.88 0 CA-C-N 119.992 1.269 . . . . 0.0 112.021 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -57.58 136.93 78.81 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.037 2.491 . . . . 0.0 113.229 177.18 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -95.19 147.13 23.79 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.982 1.313 . . . . 0.0 111.545 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.6 -2.95 9.86 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 116.207 1.928 . . . . 0.0 116.207 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.5 t90 -101.89 154.13 19.22 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.27 1.028 . . . . 0.0 111.317 174.212 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -98.75 -3.91 34.65 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 -158.238 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -119.06 153.05 35.37 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.709 1.604 . . . . 0.0 112.165 172.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -124.98 29.98 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 125.142 1.377 . . . . 0.0 113.582 -168.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 61.92 6.62 1.74 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 126.865 2.066 . . . . 0.0 115.753 177.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 71.0 m -88.37 0.8 55.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.594 1.158 . . . . 0.0 113.702 173.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.281 6.3 t 57.29 -42.94 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 129.452 3.101 . . . . 0.0 117.768 -169.073 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -101.35 7.9 42.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 178.224 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 71.9 m -112.26 147.4 36.34 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.186 0.994 . . . . 0.0 112.229 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -106.92 178.9 4.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.913 1.685 . . . . 0.0 110.371 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.1 p -66.29 -29.48 69.7 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -80.79 160.03 24.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.273 1.429 . . . . 0.0 112.77 171.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . 0.265 22.5 pttp 49.52 30.29 3.39 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.962 2.505 . . . . 0.0 116.202 174.173 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -109.16 120.17 41.74 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.076 0.95 . . . . 0.0 112.529 -174.248 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.3 m -144.05 139.85 29.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.229 1.412 . . . . 0.0 111.78 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.64 -38.93 89.5 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.121 0.968 . . . . 0.0 112.871 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -80.98 -10.03 59.77 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.365 1.066 . . . . 0.0 113.775 179.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -108.49 -24.58 11.34 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.429 1.491 . . . . 0.0 113.716 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.9 t -48.76 -48.99 69.0 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.139 1.376 . . . . 0.0 114.383 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -76.73 -29.02 5.93 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 121.999 1.799 . . . . 0.0 113.354 174.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.3 m -88.83 5.67 42.6 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.856 1.662 . . . . 0.0 114.966 -172.267 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.0 tt -71.6 -20.17 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 125.012 1.325 . . . . 0.0 114.086 -170.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -113.53 154.18 27.52 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.808 1.243 . . . . 0.0 113.465 -170.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -111.63 -10.22 14.11 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.804 1.641 . . . . 0.0 114.462 -167.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -108.29 161.99 14.49 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -174.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -146.42 159.19 43.71 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.828 2.051 . . . . 0.0 110.198 172.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 21.2 tt -129.47 136.9 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.913 1.285 . . . . 0.0 111.97 -175.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.54 160.6 14.31 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.311 1.444 . . . . 0.0 111.172 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -124.53 139.01 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.251 1.42 . . . . 0.0 111.214 176.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -149.81 128.56 12.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.243 1.417 . . . . 0.0 111.048 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -81.71 -12.97 58.41 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.232 1.013 . . . . 0.0 112.917 173.234 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.41 14.54 4.83 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 129.039 2.936 . . . . 0.0 115.494 176.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -137.61 152.42 49.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.096 1.758 . . . . 0.0 111.726 176.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -134.88 4.13 3.26 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.583 1.553 . . . . 0.0 114.75 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.21 154.44 23.37 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.028 1.331 . . . . 0.0 112.411 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -79.25 161.65 66.99 Favored Pre-proline 0 N--CA 1.476 0.836 0 C-N-CA 124.604 1.162 . . . . 0.0 112.665 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.46 162.98 19.0 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.312 2.675 . . . . 0.0 114.173 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -118.3 155.18 31.07 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.164 1.786 . . . . 0.0 111.172 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.2 t -128.17 138.03 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 125.145 1.378 . . . . 0.0 110.743 -176.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.509 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 60.5 tp -126.33 -49.26 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.743 1.617 . . . . 0.0 113.686 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.509 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 90.7 Cg_endo -73.15 162.36 40.89 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.064 1.842 . . . . 0.0 112.629 176.758 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -143.13 150.48 39.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.206 1.402 . . . . 0.0 111.721 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -136.55 12.26 3.21 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -172.74 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.2 m 54.06 58.31 5.15 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 125.468 1.507 . . . . 0.0 113.303 172.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.3 tt -136.35 137.28 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.088 1.355 . . . . 0.0 111.888 -176.393 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 35.6 p90 -156.01 160.52 40.1 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 127.029 2.132 . . . . 0.0 110.477 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 40.4 t -89.13 139.83 30.07 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.646 0.779 . . . . 0.0 110.526 170.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -69.85 -37.34 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -169.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -100.02 -33.77 10.36 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 68.4 m -95.05 -11.71 27.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -161.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 75.65 -20.64 2.19 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.056 1.312 . . . . 0.0 114.367 -169.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -76.15 177.56 50.37 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.2 1.381 . . . . 0.0 113.95 170.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -141.93 147.7 37.48 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.585 1.554 . . . . 0.0 111.609 -172.487 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.29 9.83 55.55 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 162.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.464 ' C ' ' H ' ' A' ' 118' ' ' GLY . 3.0 p80 -83.05 -154.35 0.14 Allowed 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.489 1.644 . . . . 0.0 112.103 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -65.05 25.96 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 126.572 1.949 . . . . 0.0 114.556 167.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . 0.464 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -43.13 -29.43 0.94 Allowed Glycine 0 CA--C 1.538 1.482 0 C-N-CA 129.083 3.23 . . . . 0.0 115.044 168.792 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.83 -38.06 84.18 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.745 1.618 . . . . 0.0 114.08 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -102.85 -21.47 14.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.49 1.516 . . . . 0.0 112.36 176.449 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 24.9 t -76.88 51.53 0.79 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 126.721 2.008 . . . . 0.0 111.097 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -104.36 -30.85 9.84 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.479 1.912 . . . . 0.0 114.592 -159.547 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -136.59 157.65 46.28 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.607 1.163 . . . . 0.0 112.918 -170.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.4 tttm . . . . . 0 C--O 1.251 1.167 0 C-N-CA 126.077 1.751 . . . . 0.0 112.012 177.384 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 111.351 0.13 . . . . 0.0 111.351 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -123.67 151.39 43.15 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.775 1.63 . . . . 0.0 111.28 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.59 112.9 20.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -166.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -80.95 -54.35 0.74 Allowed Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 123.824 0.849 . . . . 0.0 112.076 155.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -76.7 -48.32 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.382 2.055 . . . . 0.0 114.313 -177.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.262 7.0 pttm 42.17 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.571 1.549 . . . . 0.0 112.587 -148.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.8 m -54.13 148.74 10.56 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 119.848 -1.782 . . . . 0.0 113.8 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.0 t30 -60.33 -39.69 87.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.558 0.743 . . . . 0.0 112.0 174.333 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -136.81 -48.31 0.62 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -169.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.5 p -97.95 16.78 19.92 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -167.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.0 m 52.23 59.1 4.76 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 118.054 2.612 . . . . 0.0 118.054 164.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -129.67 164.76 23.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.897 1.279 . . . . 0.0 111.899 165.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -94.31 155.59 16.93 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.256 1.822 . . . . 0.0 111.828 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.77 -19.37 29.62 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 125.087 1.327 . . . . 0.0 115.958 170.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.279 11.8 p-80 -126.73 55.95 1.51 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 123.756 1.741 . . . . 0.0 109.925 170.61 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -179.4 0.18 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.528 2.331 . . . . 0.0 114.808 -173.878 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -14.81 -71.52 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 128.788 2.835 . . . . 0.0 115.74 -177.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -77.01 -20.56 55.87 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -94.34 -2.97 51.26 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.217 2.207 . . . . 0.0 113.243 175.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.9 t -61.76 -41.12 75.69 Favored Pre-proline 0 CA--C 1.557 1.223 0 C-N-CA 126.491 1.917 . . . . 0.0 114.329 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.61 163.41 39.03 Favored 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 122.542 2.161 . . . . 0.0 112.926 171.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -71.22 137.04 48.34 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.41 7.01 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 -170.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.4 pt -60.42 147.23 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 119.947 1.249 . . . . 0.0 112.876 177.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.0 m -73.08 -65.09 0.85 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 m -149.2 -61.54 0.22 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.274 1.03 . . . . 0.0 112.215 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -146.55 59.16 1.21 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.72 1.608 . . . . 0.0 110.267 -178.079 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.4 p -151.99 168.18 26.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.976 1.711 . . . . 0.0 111.112 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 52.09 -152.93 6.16 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.792 1.663 . . . . 0.0 113.454 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.89 146.41 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.202 1.401 . . . . 0.0 108.946 164.449 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.1 t -60.41 -23.77 64.63 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -92.85 -11.32 33.88 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.537 1.535 . . . . 0.0 113.991 175.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -156.26 100.03 1.97 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.268 1.427 . . . . 0.0 111.622 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -150.26 143.54 25.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.008 0.923 . . . . 0.0 112.857 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -165.57 170.9 13.77 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 128.668 2.787 . . . . 0.0 108.472 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.8 m -57.36 -32.41 66.73 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.343 -1.473 . . . . 0.0 114.545 177.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -96.5 3.83 52.47 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.86 1.264 . . . . 0.0 114.288 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -116.92 0.55 12.48 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.348 1.459 . . . . 0.0 113.354 173.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -37.28 -50.64 2.41 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.253 1.421 . . . . 0.0 112.445 155.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -82.1 23.57 0.77 Allowed 'Trans proline' 0 CA--C 1.552 1.376 0 C-N-CA 124.639 3.559 . . . . 0.0 116.437 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -75.19 -84.73 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.196 -1.565 . . . . 0.0 112.643 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.22 -12.22 30.75 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -167.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.0 mt -141.46 112.9 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.756 1.622 . . . . 0.0 107.09 -169.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.271 3.8 pm0 47.48 174.1 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.891 1.676 . . . . 0.0 115.072 -159.219 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 59.3 m -140.48 151.63 44.98 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 127.112 2.165 . . . . 0.0 109.483 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 p -71.76 -32.11 67.34 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.258 1.423 . . . . 0.0 113.192 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -99.81 -34.14 10.28 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.052 1.741 . . . . 0.0 113.004 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 3.1 m -103.67 -1.43 28.12 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.4 t0 58.45 -155.96 0.34 Allowed 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.402 1.481 . . . . 0.0 113.19 -171.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -42.51 8.27 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 C-N-CA 134.139 4.976 . . . . 0.0 121.123 -169.709 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -101.75 -36.01 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.527 1.531 . . . . 0.0 114.498 -161.064 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.44 164.83 6.45 Favored Glycine 0 CA--C 1.541 1.672 0 C-N-CA 124.351 0.977 . . . . 0.0 114.462 -174.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -87.12 28.61 0.91 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.899 1.28 . . . . 0.0 114.078 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -65.68 154.04 40.0 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.122 -0.986 . . . . 0.0 112.126 171.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -23.68 44.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.612 1.965 . . . . 0.0 114.946 -172.159 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.7 m -104.37 4.18 33.17 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -119.47 -37.92 3.09 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.992 1.717 . . . . 0.0 111.847 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 91.0 m -129.65 159.38 69.9 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 126.582 1.953 . . . . 0.0 110.97 169.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -60.51 143.92 99.48 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.064 2.509 . . . . 0.0 113.009 174.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.0 p80 -85.03 -36.79 21.03 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -143.58 158.54 43.58 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 127.179 2.192 . . . . 0.0 110.705 175.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.2 m-90 -123.83 3.21 8.81 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 -172.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -144.21 141.18 29.74 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.855 1.662 . . . . 0.0 111.244 -173.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -76.17 -39.75 54.13 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.537 1.135 . . . . 0.0 113.231 -178.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.8 p -146.05 133.08 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 126.952 2.101 . . . . 0.0 108.197 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -66.19 -30.58 71.07 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.729 0.412 . . . . 0.0 111.807 -175.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.3 m -74.32 170.24 16.01 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.764 1.745 . . . . 0.0 113.109 175.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.2 p -135.16 -23.29 1.51 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 127.796 2.438 . . . . 0.0 111.209 -162.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mp -78.39 -23.78 46.64 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.373 1.869 . . . . 0.0 111.441 165.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.2 m -104.28 155.51 18.69 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.708 1.203 . . . . 0.0 113.568 -163.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -81.86 164.77 21.37 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.736 1.215 . . . . 0.0 109.904 164.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 p -73.25 41.29 0.11 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.604 2.762 . . . . 0.0 114.501 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -98.08 163.13 12.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.424 2.29 . . . . 0.0 110.983 177.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -55.31 146.35 19.54 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.081 1.352 . . . . 0.0 112.643 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -133.77 160.73 36.72 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.079 1.752 . . . . 0.0 111.167 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.7 t -100.68 146.04 27.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.055 0.942 . . . . 0.0 112.565 164.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -62.2 -40.55 96.43 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.128 1.371 . . . . 0.0 113.499 -177.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.83 -19.81 19.31 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.985 1.105 . . . . 0.0 113.985 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -124.89 -2.34 7.77 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -167.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . 0.417 21.7 t 49.02 -99.26 0.0 OUTLIER Pre-proline 0 CA--C 1.556 1.208 0 CA-C-O 115.165 -2.35 . . . . 0.0 114.745 175.782 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -63.01 -31.48 76.61 Favored 'Trans proline' 0 C--N 1.36 1.153 0 CA-C-N 124.693 2.712 . . . . 0.0 114.218 176.618 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.3 m -87.46 151.72 22.82 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.604 1.162 . . . . 0.0 112.576 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.8 tt -149.8 157.22 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 124.859 1.263 . . . . 0.0 111.043 -171.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 29.2 t-105 -68.42 132.62 47.34 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.244 0.618 . . . . 0.0 112.281 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -137.36 3.66 2.6 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.742 1.617 . . . . 0.0 113.797 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.75 154.07 20.21 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -168.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -150.44 159.26 44.6 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.152 1.781 . . . . 0.0 111.302 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.19 149.63 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.791 1.636 . . . . 0.0 112.726 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.9 tp -74.92 -28.22 60.52 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -172.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.305 9.8 p 46.91 37.74 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.59 1.956 . . . . 0.0 114.715 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 55.08 22.22 4.37 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.746 2.019 . . . . 0.0 115.338 -177.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -84.9 155.73 21.56 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.307 1.443 . . . . 0.0 113.663 -176.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -131.82 132.78 44.02 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.07 1.748 . . . . 0.0 110.954 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -78.56 -30.32 46.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.998 1.319 . . . . 0.0 113.465 -178.055 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -108.87 157.38 18.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.409 1.483 . . . . 0.0 114.098 -171.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.28 160.61 41.78 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.952 1.701 . . . . 0.0 111.472 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -70.81 134.17 86.05 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 124.112 0.965 . . . . 0.0 111.171 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -66.76 -28.46 43.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.853 2.369 . . . . 0.0 114.748 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -150.27 161.94 41.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.449 1.9 . . . . 0.0 112.126 -173.291 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.2 m -89.03 -5.97 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.481 1.112 . . . . 0.0 113.588 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.07 149.07 40.88 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.451 1.101 . . . . 0.0 111.8 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -63.42 175.29 2.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.937 3.091 . . . . 0.0 114.616 172.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -108.66 -11.13 15.13 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.382 1.473 . . . . 0.0 113.935 173.499 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -92.87 17.47 10.51 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.406 1.482 . . . . 0.0 113.403 -176.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 p -70.23 -13.82 62.34 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.687 1.995 . . . . 0.0 115.272 -167.466 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 40.1 pt -106.51 6.56 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.306 1.443 . . . . 0.0 113.615 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -119.51 154.82 33.23 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.335 1.454 . . . . 0.0 113.492 -174.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t -82.38 157.81 23.58 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.835 2.454 . . . . 0.0 111.563 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -141.0 -23.27 0.77 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.932 1.693 . . . . 0.0 114.471 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -114.36 172.94 6.71 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.899 2.08 . . . . 0.0 111.827 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.326 14.5 p 51.65 12.36 0.17 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 128.809 2.844 . . . . 0.0 118.6 170.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 163.6 -165.79 36.99 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.45 1.5 . . . . 0.0 112.942 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -72.86 149.58 43.22 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 123.938 0.78 . . . . 0.0 112.823 172.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -62.43 -15.49 49.73 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -170.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -78.9 -22.0 67.1 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 118.563 -1.132 . . . . 0.0 115.83 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -79.67 134.74 36.43 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.13 1.965 . . . . 0.0 114.761 -162.127 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 31.62 36.25 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 130.378 3.471 . . . . 0.0 117.388 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.76 -17.67 43.13 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.859 1.219 . . . . 0.0 115.153 -170.403 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -63.39 -35.24 79.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.247 1.819 . . . . 0.0 113.799 172.701 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -131.51 -12.38 3.47 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.822 1.649 . . . . 0.0 113.816 -170.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 26.8 t -60.32 132.78 54.98 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.474 1.11 . . . . 0.0 111.454 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -88.44 3.78 48.82 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -159.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -68.38 157.79 34.98 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 177.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.008 1.323 . . . . 0.0 114.483 -175.202 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 120.286 0.089 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -92.23 -16.58 25.98 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -177.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.18 141.96 23.7 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.057 1.343 . . . . 0.0 111.882 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.52 28.6 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 0.0 113.229 164.334 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.78 -39.34 0.99 Allowed 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 122.707 2.271 . . . . 0.0 114.988 -175.826 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? 58.37 -57.77 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 128.441 2.696 . . . . 0.0 116.283 -170.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -155.22 159.47 40.11 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.257 2.223 . . . . 0.0 111.525 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -72.99 -30.16 63.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -161.23 -42.2 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.208 1.403 . . . . 0.0 112.74 -172.206 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.4 -12.75 60.6 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -168.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m 54.31 26.34 6.78 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.956 1.836 . . . . 0.0 115.956 -173.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -98.12 161.32 13.77 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.041 1.336 . . . . 0.0 112.717 175.077 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -72.28 161.33 30.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.63 1.572 . . . . 0.0 113.882 -175.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.05 -71.4 2.62 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.177 1.37 . . . . 0.0 114.174 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.278 0.6 OUTLIER -83.51 77.46 9.82 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 123.15 1.452 . . . . 0.0 112.9 -172.371 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -60.6 -179.4 0.12 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.261 2.225 . . . . 0.0 113.498 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.7 -62.84 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 126.164 1.786 . . . . 0.0 114.062 -171.393 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -80.41 -2.75 46.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.62 1.968 . . . . 0.0 115.419 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.31 -17.9 13.89 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.746 1.618 . . . . 0.0 113.664 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.6 t -48.91 -48.66 71.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -172.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -83.64 -2.08 10.3 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 122.461 2.108 . . . . 0.0 114.545 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -94.47 155.5 16.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.361 1.464 . . . . 0.0 113.207 -174.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.7 pp -119.05 9.9 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.552 1.541 . . . . 0.0 114.26 -174.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.4 pt -81.56 152.03 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.556 1.143 . . . . 0.0 112.109 173.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.6 p -134.79 152.85 52.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.484 1.514 . . . . 0.0 111.109 174.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.71 20.82 1.2 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.584 1.554 . . . . 0.0 115.028 176.504 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.2 t80 47.87 34.31 3.89 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.863 2.065 . . . . 0.0 114.45 -169.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 p -93.56 2.38 56.41 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 115.143 1.535 . . . . 0.0 115.143 -172.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -157.63 167.31 34.09 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 123.833 0.73 . . . . 0.0 114.639 -177.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.09 135.15 34.52 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.807 0.843 . . . . 0.0 110.736 172.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -64.6 -14.63 58.71 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -85.76 -18.11 33.93 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.931 1.292 . . . . 0.0 114.275 176.46 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -140.76 -5.29 1.18 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 116.477 2.029 . . . . 0.0 116.477 -174.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -63.48 142.29 58.45 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.419 1.087 . . . . 0.0 112.288 174.706 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -136.08 111.77 9.38 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.289 1.435 . . . . 0.0 109.189 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 61.9 p -64.27 -20.59 66.16 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -168.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -69.14 -24.83 64.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.388 1.475 . . . . 0.0 112.973 173.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -132.83 -34.02 1.16 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 -167.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 m 60.78 166.51 0.09 OUTLIER Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 126.89 2.076 . . . . 0.0 114.059 -166.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -119.6 -170.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 122.495 2.13 . . . . 0.0 114.365 -155.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.96 66.64 0.91 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.817 2.047 . . . . 0.0 109.48 167.101 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.05 -36.64 2.33 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -163.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.3 mt -126.93 35.04 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 126.832 2.053 . . . . 0.0 108.453 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -145.57 154.76 42.52 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.287 3.035 . . . . 0.0 107.817 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 31.3 p -70.46 170.32 12.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 122.027 0.918 . . . . 0.0 112.237 167.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -70.21 134.65 48.28 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.724 -0.61 . . . . 0.0 111.04 165.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.318 19.4 ptpt 53.65 136.94 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 129.62 3.168 . . . . 0.0 115.463 -165.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . 0.298 0.5 OUTLIER 55.55 179.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 126.355 1.862 . . . . 0.0 114.874 -160.498 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -120.06 32.27 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.301 1.841 . . . . 0.0 114.854 -158.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -133.24 162.19 32.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.379 1.472 . . . . 0.0 112.136 -176.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.7 t -69.06 129.88 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.353 1.461 . . . . 0.0 112.42 -174.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.98 -169.13 7.61 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 124.703 1.144 . . . . 0.0 115.046 174.471 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.79 2.36 4.43 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 168.959 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -71.0 158.74 35.99 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.699 0.8 . . . . 0.0 111.802 173.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -64.26 149.96 46.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.664 0.786 . . . . 0.0 110.607 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 m 63.96 -18.61 0.07 Allowed 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 116.645 2.091 . . . . 0.0 116.645 -170.254 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -86.64 -47.13 9.44 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.476 1.11 . . . . 0.0 110.93 169.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 27.9 t -122.72 62.45 17.85 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 126.289 1.836 . . . . 0.0 110.86 176.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.94 -12.76 35.22 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 124.208 3.272 . . . . 0.0 115.063 -170.449 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -71.94 149.5 45.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.848 1.259 . . . . 0.0 112.722 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -124.48 -20.39 5.17 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -160.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -98.13 173.37 7.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.118 0.967 . . . . 0.0 112.9 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -64.57 158.36 24.45 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.629 1.571 . . . . 0.0 112.485 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.253 0.0 OUTLIER -85.89 30.64 0.65 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -168.487 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.4 t -65.1 114.07 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.776 0.83 . . . . 0.0 110.855 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -66.23 -25.21 66.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.491 1.117 . . . . 0.0 113.398 -169.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 60.6 m -76.49 -3.14 35.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.586 1.554 . . . . 0.0 114.906 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 10.8 t 58.64 -42.45 0.06 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.865 3.266 . . . . 0.0 118.072 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 pp -104.87 -9.41 18.02 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.994 1.717 . . . . 0.0 114.333 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.4 t -74.07 138.9 44.29 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.403 0.62 . . . . 0.0 112.468 -172.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -155.19 142.26 19.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.509 1.924 . . . . 0.0 109.356 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.3 m 58.16 34.85 24.56 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt 54.86 34.8 22.85 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.332 1.853 . . . . 0.0 114.53 174.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -69.44 152.11 45.29 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.973 0.909 . . . . 0.0 111.342 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 49.77 6.84 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.827 2.451 . . . . 0.0 117.359 -173.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.0 m -80.4 -22.4 41.29 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -155.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -57.79 117.5 4.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.86 0.864 . . . . 0.0 111.433 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 55.76 20.9 4.31 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.093 1.757 . . . . 0.0 115.138 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -115.33 -44.14 3.01 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.096 1.758 . . . . 0.0 112.541 171.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m -94.57 -16.47 0.21 Allowed Pre-proline 0 CA--C 1.553 1.093 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -176.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -53.85 -22.48 23.91 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 123.065 2.51 . . . . 0.0 116.819 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 21.9 m -62.4 -15.17 47.45 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 116.115 1.895 . . . . 0.0 116.115 -176.021 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 7.8 tp -110.51 3.02 8.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 C-N-CA 125.248 1.419 . . . . 0.0 113.21 175.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 35.8 m0 -101.15 153.27 19.73 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.246 1.418 . . . . 0.0 112.169 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -135.47 141.61 45.39 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.977 1.711 . . . . 0.0 110.983 173.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.24 -9.18 22.67 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -175.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -133.15 145.01 50.27 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.743 1.217 . . . . 0.0 113.257 -171.441 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 21.0 tt -146.39 134.26 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.554 1.542 . . . . 0.0 108.983 155.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -113.68 132.61 55.73 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.577 1.151 . . . . 0.0 110.592 -178.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.4 m -108.65 3.27 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.805 1.642 . . . . 0.0 112.83 174.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -79.75 136.8 36.84 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.92 1.288 . . . . 0.0 112.243 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -150.89 156.21 40.74 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.314 1.445 . . . . 0.0 111.846 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 61.72 164.73 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.115 2.566 . . . . 0.0 114.409 -174.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 55.0 32.18 17.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.765 2.026 . . . . 0.0 113.63 -175.323 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -111.94 -3.79 14.73 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.31 1.844 . . . . 0.0 114.816 -171.228 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.9 149.6 48.71 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -171.048 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -139.49 152.56 69.2 Favored Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 127.15 2.18 . . . . 0.0 110.668 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -68.68 -29.09 30.13 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 122.983 2.456 . . . . 0.0 113.073 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.274 60.8 pttt 52.52 174.9 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.773 3.229 . . . . 0.0 117.459 173.733 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -151.51 158.22 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 127.204 2.201 . . . . 0.0 109.556 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.38 109.19 62.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 124.734 1.214 . . . . 0.0 109.926 174.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -71.09 -12.42 30.31 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.5 2.8 . . . . 0.0 114.83 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -65.66 162.48 18.34 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.414 1.486 . . . . 0.0 113.591 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 20.7 m80 -69.13 -21.28 64.03 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.273 1.429 . . . . 0.0 114.193 -177.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 6.3 m 55.38 45.45 25.36 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 126.217 1.807 . . . . 0.0 112.845 -178.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 45.9 pt -92.64 24.11 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.97 1.708 . . . . 0.0 112.401 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -109.52 164.22 12.71 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.314 1.846 . . . . 0.0 111.062 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 13.6 t -137.45 135.09 36.54 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -76.11 145.08 40.27 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.287 171.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.3 t30 63.21 -53.32 0.19 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.863 2.465 . . . . 0.0 115.341 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 93.7 m -69.85 134.56 48.61 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.222 1.809 . . . . 0.0 112.874 -174.012 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -72.16 -14.54 76.53 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 123.849 0.738 . . . . 0.0 114.279 172.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.07 -11.69 79.12 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 125.132 1.349 . . . . 0.0 116.068 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt 43.67 -85.22 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.795 2.838 . . . . 0.0 116.166 169.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -73.57 7.03 14.28 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 126.203 1.858 . . . . 0.0 116.546 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.429 ' C ' ' H ' ' A' ' 118' ' ' GLY . 0.3 OUTLIER -75.37 -158.07 0.08 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 119.072 1.436 . . . . 0.0 112.442 175.458 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -61.42 20.48 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.824 2.049 . . . . 0.0 115.056 169.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . 0.429 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -58.14 -16.5 26.66 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 127.635 2.541 . . . . 0.0 116.378 -170.005 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.37 -35.79 71.22 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.195 1.398 . . . . 0.0 113.373 172.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -117.94 -16.97 9.84 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.936 2.094 . . . . 0.0 113.193 -167.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 21.2 p -58.91 145.41 41.44 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -169.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -76.89 156.71 31.91 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.682 1.193 . . . . 0.0 111.519 175.064 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -79.1 -9.52 59.57 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 87.1 tttt . . . . . 0 C--O 1.253 1.246 0 C-N-CA 126.228 1.811 . . . . 0.0 111.388 179.819 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.3 ttmm . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.77 -22.25 64.3 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -174.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.99 136.95 34.28 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.734 1.214 . . . . 0.0 112.202 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.66 21.31 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 123.966 0.906 . . . . 0.0 112.98 165.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -79.55 -35.23 0.84 Allowed 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 122.304 2.003 . . . . 0.0 113.942 -178.326 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt 48.04 -166.19 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.211 1.005 . . . . 0.0 111.431 -151.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.9 m -57.93 158.09 7.0 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 120.513 -1.367 . . . . 0.0 111.926 163.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.7 t30 -66.38 97.0 0.39 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.185 -0.947 . . . . 0.0 110.032 169.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 61.28 -33.86 0.09 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.529 2.732 . . . . 0.0 117.543 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.8 p -81.54 -2.6 50.5 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -172.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.4 p 49.34 0.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 120.003 3.334 . . . . 0.0 120.003 170.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -118.84 125.75 50.25 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.643 1.565 . . . . 0.0 113.695 -169.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.263 39.6 ptt180 50.22 122.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 130.983 3.713 . . . . 0.0 118.744 167.72 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 66.85 -143.82 44.16 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 124.148 0.88 . . . . 0.0 114.107 173.66 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -6.3 97.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 129.318 3.047 . . . . 0.0 117.609 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -62.33 -176.64 0.11 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.23 1.412 . . . . 0.0 114.187 170.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.3 -67.47 0.22 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.404 1.882 . . . . 0.0 114.377 -174.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -74.55 -1.13 20.08 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.807 1.643 . . . . 0.0 115.111 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -98.69 -33.21 11.03 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.665 1.586 . . . . 0.0 111.886 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.6 m -46.63 -39.98 18.03 Favored Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -73.13 -5.01 16.43 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 CA-C-N 122.372 1.883 . . . . 0.0 115.37 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -65.79 153.0 43.06 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 120.046 1.293 . . . . 0.0 112.72 173.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.0 pp -111.44 164.94 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.406 1.482 . . . . 0.0 113.018 -175.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.2 pt -83.53 122.77 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.578 1.151 . . . . 0.0 111.434 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 p -84.5 143.52 29.3 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.309 0.644 . . . . 0.0 111.054 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.7 p 44.35 23.25 0.06 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 127.306 2.242 . . . . 0.0 116.752 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 50.18 32.82 6.39 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 126.135 1.774 . . . . 0.0 114.724 -171.666 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 p -79.32 -25.9 42.28 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.425 -1.422 . . . . 0.0 113.766 -173.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.32 172.35 18.71 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.854 1.692 . . . . 0.0 111.879 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.52 148.28 29.26 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.531 0.732 . . . . 0.0 110.99 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 t -66.02 -17.8 64.92 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.006 -1.059 . . . . 0.0 113.723 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.21 -4.53 29.29 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.202 1.401 . . . . 0.0 113.882 172.135 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -153.62 89.84 1.36 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 0.0 111.291 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -155.33 126.23 7.04 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.467 1.507 . . . . 0.0 109.426 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -149.7 152.9 36.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.473 0.709 . . . . 0.0 112.818 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.6 m -63.88 -26.35 68.57 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -168.802 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -103.21 145.81 29.36 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.816 0.847 . . . . 0.0 110.507 156.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.5 m170 67.46 -12.93 0.25 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.328 2.251 . . . . 0.0 116.48 -173.456 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.313 2.8 t 21.56 -75.6 0.0 OUTLIER Pre-proline 0 CA--C 1.56 1.351 0 C-N-CA 129.841 3.256 . . . . 0.0 118.409 152.809 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 68.1 Cg_endo -79.47 -9.07 14.96 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.872 3.048 . . . . 0.0 116.555 -178.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -86.04 22.63 1.68 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.499 1.52 . . . . 0.0 114.921 -166.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.62 0.14 9.82 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 38.4 mm -101.33 39.87 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 125.009 1.324 . . . . 0.0 109.559 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -151.46 160.33 43.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.237 1.415 . . . . 0.0 112.176 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 38.6 t -102.82 166.99 10.15 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.797 1.639 . . . . 0.0 110.602 170.28 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.7 m -50.97 135.01 25.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.328 1.051 . . . . 0.0 112.413 170.282 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.302 22.2 ptmt 47.74 22.36 0.34 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.127 2.171 . . . . 0.0 116.13 -170.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 58.0 m -118.61 154.82 32.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.226 1.811 . . . . 0.0 110.54 172.577 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -102.61 -6.05 23.19 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.762 1.225 . . . . 0.0 113.774 171.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -138.58 178.83 6.85 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.346 2.258 . . . . 0.0 109.187 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.8 m -75.54 58.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 120.423 -1.423 . . . . 0.0 110.686 165.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.76 -5.9 88.98 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 118.534 2.174 . . . . 0.0 118.534 -147.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -147.67 160.48 42.64 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.851 1.825 . . . . 0.0 112.4 177.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 38.1 t80 57.02 116.37 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.658 2.383 . . . . 0.0 115.459 -176.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 48.65 22.84 0.56 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 126.632 1.973 . . . . 0.0 114.329 -175.152 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.1 m 51.6 30.28 6.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 114.962 -170.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -143.17 -17.36 0.65 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.039 1.335 . . . . 0.0 113.887 -170.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 60.7 m 58.18 -174.3 0.02 OUTLIER Pre-proline 0 CA--C 1.557 1.231 0 C-N-CA 124.43 1.092 . . . . 0.0 110.622 -161.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -66.76 17.08 0.11 Allowed 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 122.985 2.456 . . . . 0.0 116.339 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -76.2 152.01 36.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.795 1.238 . . . . 0.0 112.761 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -67.57 169.39 9.37 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.814 2.046 . . . . 0.0 113.81 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -121.0 167.78 12.22 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.174 1.79 . . . . 0.0 112.77 -175.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -86.81 162.57 17.72 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.423 1.489 . . . . 0.0 114.012 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -149.45 153.84 37.92 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.701 2.4 . . . . 0.0 109.779 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.304 7.5 p 56.7 154.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 129.382 3.073 . . . . 0.0 116.189 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -69.66 -4.51 19.78 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.485 -1.384 . . . . 0.0 114.728 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.1 m -146.72 131.52 18.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.728 1.611 . . . . 0.0 111.974 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.6 t -52.22 -34.53 46.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.996 0.918 . . . . 0.0 112.924 163.325 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.91 -18.41 65.37 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.275 1.43 . . . . 0.0 114.66 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 55.8 m -88.48 6.73 36.32 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -50.97 109.28 0.31 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.902 1.281 . . . . 0.0 110.284 163.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.6 m 55.44 21.96 4.68 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -152.28 142.99 22.87 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.137 1.775 . . . . 0.0 110.667 -178.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.1 ttmm -128.01 134.88 49.28 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.585 1.154 . . . . 0.0 112.138 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -138.12 15.18 2.83 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.683 1.593 . . . . 0.0 113.548 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.9 m -66.75 -32.78 74.3 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -151.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -65.14 -23.68 67.19 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.152 0.981 . . . . 0.0 113.339 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -100.06 -17.53 17.43 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.044 1.338 . . . . 0.0 113.964 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -133.87 -36.28 0.94 Allowed 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -167.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m -85.65 137.15 36.32 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 119.716 1.143 . . . . 0.0 112.342 -169.406 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -62.24 -31.65 82.31 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 122.919 2.412 . . . . 0.0 114.331 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 38.8 m -113.41 131.29 56.06 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.271 1.428 . . . . 0.0 111.191 173.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 8.1 tp -79.3 165.05 3.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 125.261 1.424 . . . . 0.0 112.59 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 39.9 t-105 -69.12 166.08 18.98 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -175.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -77.94 -11.21 59.88 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.893 2.077 . . . . 0.0 115.462 -168.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -131.12 152.79 50.05 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -168.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -146.31 161.23 40.77 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.634 2.374 . . . . 0.0 111.213 -176.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 12.2 tt -121.0 -1.39 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -68.72 138.93 55.3 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.809 -1.182 . . . . 0.0 111.7 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.93 8.53 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 124.952 1.301 . . . . 0.0 113.586 -171.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -81.51 42.64 0.69 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.244 1.418 . . . . 0.0 113.667 -174.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -79.53 144.87 33.54 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.586 1.554 . . . . 0.0 112.444 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -116.83 7.69 13.41 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.885 1.274 . . . . 0.0 114.317 -171.39 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -136.21 148.26 48.02 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.101 1.36 . . . . 0.0 111.524 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -135.67 143.99 45.76 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.742 2.017 . . . . 0.0 112.224 -172.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -92.47 161.01 14.8 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.511 1.124 . . . . 0.0 111.71 169.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -132.96 59.27 41.53 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 125.009 1.324 . . . . 0.0 112.905 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -71.31 144.82 46.89 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.09 2.527 . . . . 0.0 112.483 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -153.06 150.12 28.82 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.214 1.806 . . . . 0.0 111.163 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 44.4 t -131.86 136.35 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.472 1.509 . . . . 0.0 110.374 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.5 mt -132.81 94.64 20.9 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 125.994 1.717 . . . . 0.0 109.855 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -65.62 140.38 62.18 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 123.476 2.784 . . . . 0.0 114.563 -174.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -155.51 160.69 40.75 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.826 1.65 . . . . 0.0 111.436 174.174 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 35.0 p80 -149.69 171.25 16.99 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.423 1.089 . . . . 0.0 113.687 -172.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.4 m 59.91 61.67 1.84 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 126.22 1.808 . . . . 0.0 113.035 177.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 pp -122.84 16.23 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 125.16 1.384 . . . . 0.0 114.593 -173.353 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -143.37 156.83 44.78 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 174.164 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 34.7 t -158.72 156.64 30.24 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.827 2.051 . . . . 0.0 109.612 172.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -154.85 -16.96 0.12 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.6 m-20 -67.69 -18.4 64.91 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -172.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 19.1 p -134.12 32.32 3.46 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.843 1.257 . . . . 0.0 114.383 -173.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 81.55 16.06 74.39 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.699 1.44 . . . . 0.0 116.699 164.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -154.87 151.31 22.96 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.96 1.267 . . . . 0.0 112.026 176.44 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.18 -35.61 5.84 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 -168.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.58 11.96 50.48 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -171.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.267 1.2 p80 -99.89 -137.05 0.31 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.911 1.356 . . . . 0.0 114.078 -168.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -74.34 35.7 0.1 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 127.669 2.388 . . . . 0.0 113.139 -169.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.0 -18.35 8.79 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 128.05 2.738 . . . . 0.0 115.79 -172.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.21 -40.51 94.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.529 1.532 . . . . 0.0 113.304 170.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -130.51 -22.73 2.69 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -165.711 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 16.2 p -78.14 19.33 0.44 Allowed 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -165.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -71.77 153.96 41.62 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.841 1.656 . . . . 0.0 112.455 -175.484 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.39 0.98 57.05 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -178.023 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.932 1.693 . . . . 0.0 111.326 171.988 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 pttm . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 121.48 0.657 . . . . 0.0 111.346 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -152.89 155.35 36.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.05 1.34 . . . . 0.0 111.6 -177.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.62 54.16 11.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.521 2.328 . . . . 0.0 114.805 171.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.64 -46.54 60.79 Favored Pre-proline 0 CA--C 1.554 1.117 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 168.099 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -79.25 -42.37 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.931 0 C-N-CA 122.262 1.975 . . . . 0.0 114.093 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? 57.69 -56.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.923 2.889 . . . . 0.0 116.285 -171.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.8 t -156.96 160.02 38.65 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.58 2.352 . . . . 0.0 110.925 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -72.64 -24.57 61.07 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.026 -1.047 . . . . 0.0 113.703 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -159.28 -37.65 0.06 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.256 1.423 . . . . 0.0 112.978 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.9 m -77.3 -163.88 0.42 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.59 1.156 . . . . 0.0 111.489 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 78.2 p -136.73 19.31 3.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -115.56 143.57 45.13 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.318 1.047 . . . . 0.0 112.47 172.016 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ptt85 -78.69 -3.18 42.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.43 -20.82 71.98 Favored Glycine 0 CA--C 1.537 1.463 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -176.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.43 89.72 1.52 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.846 1.258 . . . . 0.0 112.14 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -60.96 -179.55 0.14 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.884 1.674 . . . . 0.0 113.445 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.31 -65.08 0.37 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 126.354 1.862 . . . . 0.0 114.675 -171.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ptmm? -76.21 -9.7 58.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 126.329 1.852 . . . . 0.0 115.303 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.17 -20.48 17.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.263 1.425 . . . . 0.0 112.723 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -66.0 -51.06 49.01 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 124.644 1.178 . . . . 0.0 113.835 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -78.21 158.85 30.01 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.282 1.988 . . . . 0.0 112.481 174.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -75.42 126.11 30.35 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.782 0.801 . . . . 0.0 109.93 164.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.9 tp -74.45 150.2 7.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 125.855 1.662 . . . . 0.0 114.788 -163.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.5 pt -73.14 161.66 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 126.631 1.972 . . . . 0.0 112.908 172.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 59.5 m -77.77 7.05 6.3 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m 64.24 130.64 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.453 2.301 . . . . 0.0 114.57 -164.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 52.18 25.76 3.5 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.707 1.603 . . . . 0.0 114.261 -172.288 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.2 t -153.93 113.01 3.71 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.444 1.897 . . . . 0.0 108.6 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.55 174.19 45.89 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.917 1.246 . . . . 0.0 115.441 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.67 139.11 47.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.342 1.457 . . . . 0.0 109.55 166.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.5 t -64.01 -22.93 67.14 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -89.07 -14.19 36.93 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -151.01 95.07 2.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.386 1.475 . . . . 0.0 111.707 -172.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -155.47 134.67 12.28 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.261 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -158.12 160.96 37.87 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.342 1.457 . . . . 0.0 110.6 172.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -58.47 -28.63 65.52 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.063 1.745 . . . . 0.0 115.055 -175.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -72.6 -24.89 61.15 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.794 1.238 . . . . 0.0 113.367 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -122.05 -0.58 9.45 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.524 1.529 . . . . 0.0 114.414 -171.653 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -25.03 -60.06 0.14 Allowed Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 129.034 2.934 . . . . 0.0 117.665 -177.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -80.49 54.51 5.26 Favored 'Trans proline' 0 CA--C 1.55 1.291 0 C-N-CA 123.571 2.847 . . . . 0.0 114.298 -168.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.41 171.53 8.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.608 1.963 . . . . 0.0 113.533 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.67 -60.89 0.17 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 128.565 2.746 . . . . 0.0 116.622 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.2 mt -106.93 49.2 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 123.245 1.498 . . . . 0.0 110.261 -164.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.0 mm-40 -148.19 165.15 31.77 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.939 2.496 . . . . 0.0 109.725 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 10.6 p -126.0 124.38 40.58 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.529 1.132 . . . . 0.0 111.405 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.4 p -71.32 -16.12 62.43 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -165.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -93.05 -13.02 29.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.578 1.151 . . . . 0.0 113.269 176.663 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.3 t -143.3 -20.79 0.62 Allowed 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -157.365 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 60.58 141.5 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 128.114 2.566 . . . . 0.0 114.666 -162.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.284 10.5 pt-20 46.54 126.23 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 131.298 3.839 . . . . 0.0 119.225 -175.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.47 -12.15 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 119.08 -2.262 . . . . 0.0 112.04 163.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.43 4.94 3.37 Favored Glycine 0 CA--C 1.541 1.715 0 C-N-CA 126.43 1.967 . . . . 0.0 116.986 -177.23 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.26 169.87 14.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.732 1.613 . . . . 0.0 112.075 173.176 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 53.42 88.21 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.055 1.742 . . . . 0.0 112.926 -172.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 53.64 26.05 5.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 126.349 1.86 . . . . 0.0 114.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.6 m 55.12 23.04 4.96 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.645 1.578 . . . . 0.0 114.733 -172.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -141.35 -17.05 0.81 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.288 1.435 . . . . 0.0 114.022 -169.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 35.4 m 57.41 168.11 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 125.827 1.651 . . . . 0.0 114.09 -154.789 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -65.44 -177.27 0.64 Allowed 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.623 2.882 . . . . 0.0 115.116 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 58.0 t60 -58.89 164.08 3.08 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.112 1.365 . . . . 0.0 113.725 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -53.52 144.63 16.71 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.434 1.894 . . . . 0.0 114.428 -166.743 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.6 m-90 -72.88 168.93 17.9 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.908 1.683 . . . . 0.0 114.117 -177.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -113.33 159.79 19.03 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 126.247 1.819 . . . . 0.0 112.8 179.267 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -77.79 168.25 20.23 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.142 1.777 . . . . 0.0 115.169 -171.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.4 m -69.45 148.36 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.803 1.641 . . . . 0.0 112.495 171.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 pp0? -68.17 -19.65 64.81 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -168.097 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.8 m -76.13 -20.23 57.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 172.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 61.47 -28.47 0.06 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.105 2.162 . . . . 0.0 115.155 -156.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 44.7 mt -89.72 -15.82 31.69 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.397 1.879 . . . . 0.0 114.533 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -176.25 2.47 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -174.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.7 tptt 66.7 -24.59 0.11 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 128.217 2.607 . . . . 0.0 115.177 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.8 t -73.59 150.9 41.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.815 1.246 . . . . 0.0 113.312 168.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -70.23 -22.44 62.9 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.612 1.965 . . . . 0.0 114.178 177.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -75.95 -44.1 41.62 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.345 1.058 . . . . 0.0 113.136 -175.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -77.05 -42.95 36.32 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -165.531 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.1 m -76.42 -11.59 59.91 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.184 1.92 . . . . 0.0 116.184 -158.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -51.52 124.7 12.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.292 1.437 . . . . 0.0 112.029 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . 0.285 10.0 pt-20 49.97 4.6 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 128.909 2.884 . . . . 0.0 118.486 -178.065 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -124.58 -24.23 4.24 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.198 1.399 . . . . 0.0 114.605 -177.005 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 86.5 m -128.81 68.77 79.57 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.921 1.288 . . . . 0.0 112.007 168.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -64.09 170.34 9.21 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.076 2.518 . . . . 0.0 113.967 172.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.0 m -95.17 2.03 54.91 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.8 pt -75.46 155.43 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 122.443 1.116 . . . . 0.0 112.861 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 4.1 m-90 -72.69 -11.36 60.6 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -157.791 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 36.5 ttt-85 -129.92 16.84 5.71 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.472 1.509 . . . . 0.0 113.891 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -74.12 -33.7 63.66 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.625 -0.672 . . . . 0.0 112.772 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -96.82 160.72 14.21 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 111.322 168.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 46.4 pt -65.63 147.79 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 123.672 0.789 . . . . 0.0 113.128 -177.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 pp -99.84 16.43 23.77 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.928 1.691 . . . . 0.0 113.424 175.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.253 33.2 m 47.53 30.28 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 127.425 2.29 . . . . 0.0 114.83 176.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . 0.307 3.9 p30 48.14 24.38 0.65 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.353 2.261 . . . . 0.0 116.283 -173.289 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -142.61 -29.22 0.57 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.045 1.338 . . . . 0.0 114.33 -175.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -79.98 151.36 30.07 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.553 1.141 . . . . 0.0 112.251 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -138.5 139.82 38.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.409 1.484 . . . . 0.0 111.716 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -108.58 150.12 27.94 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.817 1.647 . . . . 0.0 110.85 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -101.5 -16.18 16.89 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -82.34 137.64 45.38 Favored Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 124.023 0.929 . . . . 0.0 111.204 176.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.32 160.35 50.19 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.871 2.381 . . . . 0.0 113.081 173.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -85.02 -26.53 27.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.179 1.791 . . . . 0.0 112.949 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.7 t -124.46 145.53 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.997 1.719 . . . . 0.0 110.543 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -120.05 164.76 20.58 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 126.053 1.741 . . . . 0.0 111.739 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -58.28 156.48 30.12 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.821 3.014 . . . . 0.0 115.787 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -101.08 165.29 11.38 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.768 1.627 . . . . 0.0 112.799 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 19.6 m80 60.36 22.86 12.37 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.552 1.941 . . . . 0.0 116.143 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 32.4 p -85.65 -12.23 51.86 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.887 1.675 . . . . 0.0 113.631 176.625 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 96.1 mt -91.8 142.73 12.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.891 1.676 . . . . 0.0 110.295 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 37.9 p90 -142.41 157.5 44.71 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.715 1.206 . . . . 0.0 113.448 -174.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 4.5 t -145.3 39.81 1.2 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.921 1.288 . . . . 0.0 112.511 173.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -61.49 -9.3 5.45 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -176.206 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -64.96 -22.06 66.94 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.398 1.079 . . . . 0.0 113.119 170.196 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 95.6 m -105.95 176.03 5.3 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.972 2.109 . . . . 0.0 112.354 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.05 -7.76 38.98 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 124.937 1.256 . . . . 0.0 115.712 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -159.54 154.13 25.18 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.427 1.489 . . . . 0.0 112.47 172.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -86.16 -22.08 27.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -77.99 33.16 1.71 Allowed Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.825 1.679 . . . . 0.0 117.149 -163.722 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.99 151.17 31.7 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.827 1.314 . . . . 0.0 113.108 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 44.39 28.74 0.32 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.359 2.264 . . . . 0.0 116.905 154.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.93 -18.45 59.88 Favored Glycine 0 CA--C 1.536 1.348 0 O-C-N 121.017 -1.052 . . . . 0.0 114.898 -167.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.32 -46.42 41.09 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.37 1.468 . . . . 0.0 113.483 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -111.44 -20.85 12.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.764 1.626 . . . . 0.0 114.463 -162.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 5.1 t -77.85 -5.61 51.48 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -170.721 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -81.77 45.09 0.87 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.648 1.979 . . . . 0.0 111.757 171.14 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -77.84 -13.39 59.9 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -164.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.6 tptp . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.791 1.637 . . . . 0.0 111.91 -179.325 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 120.603 0.239 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -65.67 145.93 55.43 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.174 0.99 . . . . 0.0 112.097 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.6 82.43 6.89 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.382 1.473 . . . . 0.0 112.221 -171.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.97 -51.64 79.17 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 171.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.75 -35.44 0.53 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.482 2.122 . . . . 0.0 113.993 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.401 0.0 OUTLIER 51.87 -53.64 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 130.138 3.375 . . . . 0.0 117.482 -168.608 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 4.5 m -163.56 165.82 23.17 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 131.564 3.946 . . . . 0.0 109.623 179.363 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -72.84 -94.8 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.901 -1.125 . . . . 0.0 112.502 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -90.22 -22.3 21.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.527 1.131 . . . . 0.0 111.476 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -67.17 166.77 13.39 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.713 1.605 . . . . 0.0 110.792 165.032 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.5 p -134.52 15.56 3.71 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -165.194 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -84.14 164.28 19.27 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.693 0.797 . . . . 0.0 112.312 174.336 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.6 mtt-85 -91.67 111.82 23.49 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 170.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.25 152.33 16.34 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.522 1.534 . . . . 0.0 112.586 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.363 13.3 p-80 51.53 62.87 2.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-O 123.438 1.589 . . . . 0.0 111.644 -161.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -64.13 -170.42 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.387 1.875 . . . . 0.0 114.391 -175.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -34.94 -64.75 0.25 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.504 1.922 . . . . 0.0 114.522 -169.689 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -74.68 -11.17 60.11 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.151 1.78 . . . . 0.0 115.437 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -99.98 -13.63 19.01 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.376 1.87 . . . . 0.0 113.635 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.9 m -65.1 167.32 10.05 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.74 1.216 . . . . 0.0 112.274 159.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.82 162.71 12.58 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 124.147 3.231 . . . . 0.0 114.759 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -65.84 149.74 49.7 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.342 1.057 . . . . 0.0 113.404 -178.29 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.8 pp -89.86 171.81 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.251 1.42 . . . . 0.0 113.76 -175.662 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.1 mt -68.76 127.23 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.121 1.369 . . . . 0.0 110.331 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.0 p -62.43 128.37 35.7 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 121.897 0.856 . . . . 0.0 112.204 -175.119 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.9 m 51.32 14.56 0.24 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.3 t80 45.65 35.89 2.37 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.777 1.631 . . . . 0.0 113.359 -166.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 p -86.5 -14.44 43.07 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.96 -173.0 18.55 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 114.977 0.751 . . . . 0.0 114.977 -174.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.0 -176.89 1.2 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.956 0.902 . . . . 0.0 111.731 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -119.69 -40.86 2.72 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 173.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -79.61 -24.84 41.69 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.3 p30 -133.39 32.96 3.6 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.304 1.842 . . . . 0.0 112.652 174.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 23.1 t-160 -46.42 -55.14 7.84 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.48 2.712 . . . . 0.0 115.427 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.23 -43.58 56.5 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 m -70.12 -16.71 63.15 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -167.136 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -77.72 22.78 0.25 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.682 1.593 . . . . 0.0 113.289 172.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.8 m80 50.99 58.2 5.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.83 1.252 . . . . 0.0 111.258 -163.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.348 32.2 t 34.38 -90.75 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 129.379 3.072 . . . . 0.0 115.93 176.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -73.13 -5.72 17.67 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 123.327 2.685 . . . . 0.0 115.768 -175.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -90.5 36.05 0.88 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.471 1.508 . . . . 0.0 113.536 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -131.14 -13.71 3.49 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 117.188 2.292 . . . . 0.0 117.188 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.1 mm -120.18 45.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-N 120.49 1.496 . . . . 0.0 110.473 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.76 158.29 43.96 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 120.65 -1.281 . . . . 0.0 112.888 166.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 43.4 t -55.02 155.77 4.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.143 2.177 . . . . 0.0 112.064 169.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -62.22 -28.47 69.71 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.621 -1.3 . . . . 0.0 114.423 -174.633 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -131.74 4.11 4.19 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.74 1.616 . . . . 0.0 113.987 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 m -135.3 158.82 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.094 1.358 . . . . 0.0 111.333 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -88.56 0.19 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -160.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -122.49 153.08 39.63 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.954 -1.091 . . . . 0.0 113.375 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.6 t -6.32 -60.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.241 1 C-N-CA 132.581 4.352 . . . . 0.0 119.021 -167.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.03 165.26 32.61 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 124.872 1.225 . . . . 0.0 112.238 -169.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -79.62 9.48 4.96 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 116.717 2.118 . . . . 0.0 116.717 -159.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -61.27 151.34 32.08 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.503 -1.373 . . . . 0.0 112.301 174.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -0.02 1.48 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -175.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.8 p -127.47 3.63 6.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.368 1.867 . . . . 0.0 113.289 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -119.4 -27.23 5.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.266 1.826 . . . . 0.0 112.733 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 19.8 t -139.98 58.21 10.75 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.932 1.693 . . . . 0.0 111.569 169.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.33 156.99 54.25 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.024 2.483 . . . . 0.0 112.149 175.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -90.28 -8.78 50.07 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -111.96 137.48 49.91 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.439 1.896 . . . . 0.0 109.414 165.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -92.2 -53.46 4.23 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -164.264 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt 48.87 32.22 3.62 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.947 1.699 . . . . 0.0 113.955 -174.825 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -106.83 123.12 47.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.593 1.557 . . . . 0.0 111.289 -172.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.293 2.2 p 48.48 18.03 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 127.946 2.499 . . . . 0.0 115.359 -179.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 54.36 0.85 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.54 2.336 . . . . 0.0 116.264 -170.543 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.3 m -145.02 144.8 31.2 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.61 1.096 . . . . 0.0 112.662 -169.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.0 t -77.65 -24.62 49.38 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.674 0.79 . . . . 0.0 113.124 161.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.9 mt -74.55 -15.74 60.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.906 1.283 . . . . 0.0 113.966 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 87.4 m -112.51 159.39 18.83 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.671 1.189 . . . . 0.0 112.866 -169.171 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -126.27 154.09 43.87 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.086 1.754 . . . . 0.0 110.368 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 p -51.93 137.01 27.58 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.379 1.071 . . . . 0.0 112.483 176.584 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.304 8.8 ptpp? 48.23 20.23 0.26 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 127.978 2.511 . . . . 0.0 116.775 -171.717 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -133.59 30.95 3.75 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.894 2.078 . . . . 0.0 112.698 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -73.22 171.94 12.05 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.876 0.87 . . . . 0.0 112.809 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.2 m 66.59 -7.04 0.46 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 127.989 2.516 . . . . 0.0 117.532 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -53.66 151.21 6.29 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.587 1.555 . . . . 0.0 112.25 171.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 51.85 37.83 21.73 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.301 1.44 . . . . 0.0 113.135 -174.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? 53.44 62.59 2.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.761 2.025 . . . . 0.0 112.256 -177.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t -116.72 39.23 0.26 Allowed Pre-proline 0 CA--C 1.561 1.377 0 C-N-CA 125.762 1.625 . . . . 0.0 114.322 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -74.92 -25.15 12.31 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 122.03 1.82 . . . . 0.0 113.574 -177.562 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.5 m -67.26 154.9 40.19 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.268 1.827 . . . . 0.0 114.683 -172.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 2.0 pp -87.85 170.01 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.077 1.351 . . . . 0.0 114.524 -174.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -62.88 -25.83 68.49 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 127.211 2.204 . . . . 0.0 114.68 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 62.82 -179.55 0.14 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.205 2.202 . . . . 0.0 113.738 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . 63.77 -5.89 0.26 Allowed 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 118.461 2.763 . . . . 0.0 118.461 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -84.76 150.61 24.96 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.995 1.27 . . . . 0.0 112.0 169.648 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 47.7 pt -68.76 142.78 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.475 0.71 . . . . 0.0 112.413 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.0 tp -138.54 -10.12 1.41 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.57 1.148 . . . . 0.0 113.979 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.04 -17.27 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.491 1.116 . . . . 0.0 113.748 -177.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -82.11 -9.22 59.6 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.74 1.216 . . . . 0.0 114.155 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -120.48 127.9 52.65 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.555 1.542 . . . . 0.0 112.417 -176.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 51.9 30.41 7.14 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.372 1.869 . . . . 0.0 114.726 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -144.27 152.11 40.34 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.068 1.747 . . . . 0.0 111.146 -175.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -143.68 153.5 42.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.439 1.896 . . . . 0.0 112.915 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.38 -15.04 56.46 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.88 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -106.92 126.58 29.88 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 124.924 1.289 . . . . 0.0 112.215 -174.634 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -80.41 166.71 19.91 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.646 2.897 . . . . 0.0 112.583 173.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -138.69 125.23 20.64 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.653 1.581 . . . . 0.0 109.863 167.411 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.0 t -104.01 -35.74 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -162.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.1 tp -143.68 127.57 9.21 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.782 1.233 . . . . 0.0 110.757 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -91.2 -13.92 1.87 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.118 2.546 . . . . 0.0 114.415 -177.362 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -115.76 151.36 35.3 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.028 1.331 . . . . 0.0 112.855 -171.741 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -76.38 146.01 39.02 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.785 0.834 . . . . 0.0 113.152 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.2 t -154.16 159.81 41.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.154 1.382 . . . . 0.0 111.987 177.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.8 mm 52.93 54.83 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 126.769 2.028 . . . . 0.0 111.002 -176.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -121.79 157.21 31.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.131 1.773 . . . . 0.0 112.738 -171.251 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.9 m -81.08 155.72 26.16 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 152.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -77.35 -10.21 59.31 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 120.847 -1.158 . . . . 0.0 113.803 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -110.32 -20.63 12.56 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.0 p -154.79 164.89 38.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.239 1.016 . . . . 0.0 113.087 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -67.92 123.3 18.22 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.013 0.815 . . . . 0.0 113.994 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.78 142.26 1.08 Allowed Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.746 1.641 . . . . 0.0 114.514 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -80.28 56.38 2.47 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.935 1.694 . . . . 0.0 112.614 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -76.11 -12.38 84.13 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.177 1.37 . . . . 0.0 116.434 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -144.6 -161.29 1.26 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.028 1.414 . . . . 0.0 112.452 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -70.24 44.37 0.07 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.427 2.291 . . . . 0.0 113.023 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -43.84 -19.67 0.12 Allowed Glycine 0 CA--C 1.532 1.094 1 C-N-CA 131.359 4.314 . . . . 0.0 118.452 -170.161 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.78 -38.81 89.45 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.401 1.601 . . . . 0.0 112.352 169.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -112.44 -14.14 13.29 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.648 1.979 . . . . 0.0 113.007 171.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 62.57 48.23 4.54 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.357 2.263 . . . . 0.0 114.78 166.145 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -126.9 168.09 14.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.211 1.805 . . . . 0.0 111.342 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -87.92 -14.67 38.68 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -174.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 C--O 1.252 1.228 0 C-N-CA 126.426 1.89 . . . . 0.0 111.496 -175.598 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 62.2 pttt . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 111.455 0.168 . . . . 0.0 111.455 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -79.02 -33.14 45.12 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.879 0.872 . . . . 0.0 112.585 -178.057 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.96 140.55 22.53 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.161 1.384 . . . . 0.0 111.731 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.96 -52.18 1.61 Allowed Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.328 1.051 . . . . 0.0 112.947 165.202 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.14 -36.49 1.88 Allowed 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.763 2.308 . . . . 0.0 114.556 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 60.92 -64.84 0.06 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 127.91 2.484 . . . . 0.0 114.368 -169.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.5 t -159.55 161.29 35.21 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 128.416 2.686 . . . . 0.0 110.368 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -68.26 -35.45 77.91 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.063 -1.023 . . . . 0.0 112.933 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -145.4 -62.83 0.34 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 p -87.76 95.94 10.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.601 1.161 . . . . 0.0 111.934 -176.351 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.0 p -71.66 63.53 0.43 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 128.373 2.669 . . . . 0.0 115.887 -168.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 pp0? -121.09 148.16 44.55 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 127.376 2.27 . . . . 0.0 110.545 165.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.8 mtm180 -73.07 136.26 44.94 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.639 0.776 . . . . 0.0 111.727 -172.786 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 147.07 -37.67 1.15 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.798 1.19 . . . . 0.0 113.79 176.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -139.72 101.06 4.11 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.179 0.991 . . . . 0.0 112.992 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.86 -178.69 0.33 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.557 1.143 . . . . 0.0 112.938 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.83 -66.21 0.35 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.945 1.698 . . . . 0.0 113.802 -171.706 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -74.34 -11.1 60.16 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.865 1.431 . . . . 0.0 114.865 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -85.64 -26.76 25.83 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.347 1.059 . . . . 0.0 112.263 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.2 t -59.1 -42.34 93.06 Favored Pre-proline 0 CA--C 1.557 1.235 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -77.03 162.7 31.65 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.442 2.095 . . . . 0.0 114.389 -173.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -87.2 6.16 34.45 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.015 1.726 . . . . 0.0 115.629 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.4 pp -83.48 28.46 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 -165.02 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 mt -113.86 145.36 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.163 1.385 . . . . 0.0 111.595 -170.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.7 t -43.22 117.47 1.11 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.853 2.061 . . . . 0.0 114.136 -174.22 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.7 m 51.58 20.34 1.04 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.661 1.984 . . . . 0.0 116.245 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.9 t80 52.15 26.38 3.85 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 125.298 1.439 . . . . 0.0 113.789 -167.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.4 p -115.48 -25.86 7.76 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.945 1.698 . . . . 0.0 113.627 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -96.99 155.5 20.74 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.688 1.613 . . . . 0.0 113.779 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -109.92 142.54 41.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.437 1.095 . . . . 0.0 110.849 166.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -59.62 -26.18 65.26 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.413 1.485 . . . . 0.0 114.875 -168.587 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.16 1.27 28.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -140.91 -13.59 0.94 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 115.931 1.826 . . . . 0.0 115.931 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -64.24 138.57 58.5 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.868 -1.145 . . . . 0.0 113.409 -176.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.46 133.75 46.56 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.799 1.639 . . . . 0.0 110.227 171.375 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.9 t -58.67 -29.68 66.77 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 171.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -62.93 -25.19 68.22 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.627 1.571 . . . . 0.0 114.087 174.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -131.64 -16.29 3.01 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -165.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.46 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.346 2.1 m 41.22 -98.18 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 128.057 2.543 . . . . 0.0 115.927 178.59 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.46 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 19.9 Cg_exo -77.33 -3.38 13.61 Favored 'Trans proline' 0 C--N 1.36 1.146 0 CA-C-N 123.544 2.301 . . . . 0.0 117.626 -155.768 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.75 -3.96 2.75 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -171.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.3 -23.38 17.23 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.031 1.332 . . . . 0.0 114.148 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.5 mt -128.51 -15.75 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.266 1.427 . . . . 0.0 112.623 -176.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -128.81 173.28 10.5 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.725 -1.234 . . . . 0.0 111.625 155.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 28.0 p -117.3 -176.67 3.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.51 1.524 . . . . 0.0 110.392 167.439 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.1 p -75.99 -17.93 59.5 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -176.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -96.1 -31.81 12.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.571 1.148 . . . . 0.0 113.768 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -156.09 167.56 30.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.795 1.238 . . . . 0.0 112.263 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.96 18.38 0.18 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.378 1.871 . . . . 0.0 114.853 -169.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -132.09 158.12 42.42 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.86 1.664 . . . . 0.0 112.359 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.99 121.75 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 125.032 1.333 . . . . 0.0 113.465 -165.972 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 54.44 -150.77 15.58 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 124.786 1.184 . . . . 0.0 115.776 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.3 m80 -139.46 10.37 2.5 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.096 1.358 . . . . 0.0 113.705 170.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -72.09 148.98 45.22 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.129 -0.982 . . . . 0.0 112.146 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.0 tpt85 -60.68 -23.21 64.65 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.715 1.606 . . . . 0.0 114.266 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -90.92 -8.09 50.32 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.287 1.835 . . . . 0.0 114.45 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -119.61 -42.14 2.65 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.966 1.306 . . . . 0.0 113.944 -171.716 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.3 t -109.7 112.69 58.32 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 123.891 0.876 . . . . 0.0 112.211 -171.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -69.0 164.48 33.61 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.076 2.518 . . . . 0.0 113.973 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -128.06 144.6 51.12 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.204 1.402 . . . . 0.0 110.617 167.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -78.3 -18.41 55.28 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.6 1.16 . . . . 0.0 113.75 -176.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -67.27 122.46 17.92 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.137 0.575 . . . . 0.0 112.454 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -141.42 148.97 40.42 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 127.722 2.409 . . . . 0.0 109.048 169.795 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -125.32 145.69 49.91 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.028 1.331 . . . . 0.0 111.988 -177.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.6 m -113.48 152.03 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 125.614 1.565 . . . . 0.0 111.943 -177.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -12.27 33.5 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.4 m -87.15 99.91 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.428 0.691 . . . . 0.0 112.451 -172.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.4 p 33.23 -79.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 117.483 2.401 . . . . 0.0 117.483 136.151 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 pp -109.65 -10.03 14.84 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.63 2.772 . . . . 0.0 114.729 -170.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.26 161.39 26.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.423 1.089 . . . . 0.0 113.1 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -125.73 148.31 49.1 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.157 1.783 . . . . 0.0 109.662 171.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.8 p -58.33 137.22 57.35 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.476 1.511 . . . . 0.0 112.197 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.4 tttt 53.45 23.55 3.47 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.294 1.837 . . . . 0.0 114.798 -174.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -132.14 12.07 4.65 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.19 1.396 . . . . 0.0 114.386 -175.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -147.83 171.1 16.25 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.904 0.882 . . . . 0.0 111.966 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.9 t -129.26 153.6 47.63 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . 0.446 ' C ' ' H ' ' A' ' 79' ' ' ARG . 56.7 mtmt -66.33 -4.23 7.56 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.851 2.06 . . . . 0.0 114.046 165.237 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -66.99 43.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 126.54 1.936 . . . . 0.0 111.676 155.552 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . 0.446 ' H ' ' C ' ' A' ' 77' ' ' LYS . 62.9 mmt-85 48.94 50.4 17.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 129.829 3.252 . . . . 0.0 115.423 175.575 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m 64.61 174.67 0.06 OUTLIER Pre-proline 0 CA--C 1.556 1.193 0 C-N-CA 126.118 1.767 . . . . 0.0 115.602 166.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -62.59 -18.26 62.73 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 123.475 2.783 . . . . 0.0 116.35 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.2 p -72.31 -0.78 13.16 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 -171.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 7.6 tp -86.54 119.62 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.703 1.138 . . . . 0.0 110.768 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -140.64 -20.61 0.82 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.531 1.308 . . . . 0.0 114.531 -176.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.44 -22.55 63.65 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -171.233 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -148.04 155.96 42.08 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.368 1.067 . . . . 0.0 112.949 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -103.73 154.3 19.71 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.518 1.527 . . . . 0.0 111.825 171.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.5 mp -95.9 84.66 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 163.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.3 tp -99.77 1.88 43.61 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.062 1.345 . . . . 0.0 113.877 -162.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.9 m -62.31 146.98 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.322 1.049 . . . . 0.0 113.236 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -121.43 151.18 40.5 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.987 1.715 . . . . 0.0 113.613 -171.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -79.81 160.08 26.27 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.633 1.573 . . . . 0.0 113.795 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -123.04 157.43 32.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.142 1.377 . . . . 0.0 112.944 -173.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 60.96 161.47 0.06 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.776 2.431 . . . . 0.0 116.305 -177.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -129.19 161.3 30.45 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.597 2.359 . . . . 0.0 110.574 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -136.01 152.91 51.41 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.316 1.046 . . . . 0.0 113.182 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.49 158.6 60.12 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.594 2.358 . . . . 0.0 110.435 170.247 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.45 154.58 58.11 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.129 2.553 . . . . 0.0 114.103 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -87.44 22.49 2.16 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.804 1.642 . . . . 0.0 113.105 174.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -149.85 150.61 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 127.218 2.207 . . . . 0.0 110.008 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -130.16 146.31 61.0 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.252 1.421 . . . . 0.0 111.214 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.03 -13.72 19.24 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.81 3.007 . . . . 0.0 114.127 -176.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -69.32 -12.19 61.45 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -172.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 12.2 t-160 -85.54 3.87 38.56 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.032 1.333 . . . . 0.0 114.568 -173.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 96.9 m -105.85 141.56 37.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 125.151 1.38 . . . . 0.0 111.986 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.1 pt -114.6 158.65 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.797 1.639 . . . . 0.0 111.926 173.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.02 160.17 39.18 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.02 1.328 . . . . 0.0 112.239 -172.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 8.6 t -83.2 142.72 30.96 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.225 1.01 . . . . 0.0 111.972 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -137.46 11.54 2.98 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.898 1.279 . . . . 0.0 112.925 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -142.88 158.18 43.87 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.415 1.886 . . . . 0.0 110.157 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 p 52.64 -5.4 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 119.684 3.216 . . . . 0.0 119.684 173.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.68 -167.94 39.66 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.29 1.424 . . . . 0.0 114.002 -178.001 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.77 161.78 48.79 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.648 1.118 . . . . 0.0 113.954 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -65.28 -19.0 65.76 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -166.409 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.27 -37.22 15.45 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 116.293 1.277 . . . . 0.0 116.293 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.28 141.77 30.71 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.382 1.591 . . . . 0.0 115.016 -164.747 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 37.71 31.78 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 129.486 3.114 . . . . 0.0 117.17 164.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.54 -11.41 41.51 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.302 1.43 . . . . 0.0 115.441 -165.132 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.16 -35.27 73.88 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.671 1.588 . . . . 0.0 113.747 173.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -143.99 -27.54 0.53 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -159.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.0 p -70.27 -11.43 60.9 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -175.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -80.07 51.88 1.44 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.462 1.905 . . . . 0.0 112.653 -176.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -76.2 -7.67 55.36 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.254 1.422 . . . . 0.0 114.8 -176.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm . . . . . 0 C--O 1.252 1.19 0 C-N-CA 126.965 2.106 . . . . 0.0 111.16 178.619 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -158.13 174.26 15.47 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.452 1.501 . . . . 0.0 112.423 -168.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 53.61 56.23 7.53 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.288 1.835 . . . . 0.0 114.659 177.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -45.64 -47.44 38.15 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 173.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 -40.36 0.33 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 122.056 1.838 . . . . 0.0 114.067 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm 40.63 -158.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.693 1.197 . . . . 0.0 111.773 -146.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.1 t -59.77 157.7 11.69 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.408 -1.433 . . . . 0.0 112.834 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -63.58 -35.8 81.68 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.272 -0.892 . . . . 0.0 111.763 168.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -150.15 -48.08 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -166.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 55.6 m -70.25 -40.24 74.52 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.743 1.156 . . . . 0.0 113.924 -170.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.8 m 56.8 21.71 6.28 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 117.446 2.387 . . . . 0.0 117.446 176.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -129.26 8.55 5.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.313 1.445 . . . . 0.0 112.9 175.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -143.49 150.68 39.32 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.629 1.572 . . . . 0.0 111.707 -172.114 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -68.31 -10.83 60.65 Favored Glycine 0 CA--C 1.533 1.215 0 N-CA-C 116.19 1.236 . . . . 0.0 116.19 -170.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.58 92.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.124 1.462 . . . . 0.0 112.432 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -59.02 175.57 0.27 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.089 1.356 . . . . 0.0 113.169 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -32.79 -68.98 0.09 Allowed 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 126.751 2.02 . . . . 0.0 114.45 -173.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -78.49 -8.03 58.1 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -27.32 26.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.046 1.339 . . . . 0.0 111.821 171.658 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.09 139.49 95.99 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.257 1.423 . . . . 0.0 112.013 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.94 -19.45 46.12 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.574 2.849 . . . . 0.0 114.995 178.107 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 23.8 t-160 -117.76 108.27 15.18 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.556 1.142 . . . . 0.0 110.94 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.0 pt -140.56 165.46 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 125.878 1.671 . . . . 0.0 112.062 -178.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.9 mt 54.69 22.97 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 126.678 1.991 . . . . 0.0 113.585 175.554 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.1 m 46.82 27.58 0.71 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.136 1.774 . . . . 0.0 114.616 -174.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . 0.299 5.7 p 42.07 79.58 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.588 1.955 . . . . 0.0 113.315 -162.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 68.54 17.09 9.08 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.454 2.702 . . . . 0.0 116.984 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -109.09 66.1 0.63 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 108.434 164.492 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 164.29 -162.6 35.45 Favored Glycine 0 CA--C 1.524 0.631 0 O-C-N 121.195 -0.94 . . . . 0.0 114.0 173.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -136.41 158.03 45.39 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.617 1.567 . . . . 0.0 108.597 163.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.5 t -67.41 -24.76 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -175.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -119.63 -39.09 2.9 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -107.82 61.95 0.61 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.153 0.981 . . . . 0.0 112.959 -171.305 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -153.76 134.95 14.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.241 1.416 . . . . 0.0 111.031 -176.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -156.12 171.22 20.53 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.227 1.011 . . . . 0.0 112.648 -172.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -53.69 -32.08 50.38 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.083 1.753 . . . . 0.0 114.564 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -84.9 -8.96 58.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.015 1.726 . . . . 0.0 113.649 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -131.78 -0.55 3.85 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.839 1.656 . . . . 0.0 114.699 -170.42 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 t -27.96 -52.84 0.24 Allowed Pre-proline 0 CA--C 1.557 1.222 0 C-N-CA 127.969 2.508 . . . . 0.0 117.25 -175.355 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -65.41 -18.49 60.17 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 122.701 2.267 . . . . 0.0 116.167 -178.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -73.16 128.08 34.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.782 1.233 . . . . 0.0 110.692 174.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.73 138.96 21.3 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -172.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 35.9 mm 58.38 139.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 130.51 3.524 . . . . 0.0 116.709 165.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -162.24 158.94 25.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.345 1.858 . . . . 0.0 112.858 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.6 t -99.49 162.34 13.09 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.079 1.352 . . . . 0.0 110.14 159.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.5 p -56.2 140.46 44.39 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 120.938 -1.101 . . . . 0.0 111.692 177.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt 56.94 6.71 0.34 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.639 1.976 . . . . 0.0 115.687 -174.307 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.5 m -93.85 -36.44 12.24 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.225 1.01 . . . . 0.0 112.523 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 60.01 -20.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 128.087 2.555 . . . . 0.0 116.769 -176.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -136.58 127.58 27.72 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.959 2.103 . . . . 0.0 110.021 162.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.274 13.5 m 40.78 -62.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.026 1 C-N-CA 132.575 4.35 . . . . 0.0 118.949 178.943 . . . . . . . . 3 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 166.26 155.37 8.8 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.981 1.276 . . . . 0.0 114.051 -172.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -77.26 113.64 15.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.287 1.435 . . . . 0.0 112.602 175.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.6 t80 66.02 154.53 0.08 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.794 2.038 . . . . 0.0 115.662 -173.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 48.84 16.49 0.12 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 128.383 2.673 . . . . 0.0 114.982 -167.339 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.0 m 50.13 28.23 2.94 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.119 1.768 . . . . 0.0 114.515 -170.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -157.94 -14.79 0.08 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 115.861 1.8 . . . . 0.0 115.861 -174.621 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 31.5 p 36.63 89.1 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.192 0 C-N-CA 127.793 2.437 . . . . 0.0 115.998 -172.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -63.98 10.69 0.11 Allowed 'Trans proline' 0 CA--C 1.551 1.349 0 C-N-CA 124.683 3.588 . . . . 0.0 117.728 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 64.22 -28.83 0.1 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 129.366 3.066 . . . . 0.0 117.986 173.715 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -71.37 -3.51 21.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.746 1.619 . . . . 0.0 114.407 174.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -68.08 -20.93 64.99 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.66 1.584 . . . . 0.0 114.178 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.0 tttp -71.55 123.32 22.19 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.856 1.262 . . . . 0.0 112.92 -175.189 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt 57.07 -33.72 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 130.519 3.528 . . . . 0.0 119.505 173.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -67.65 145.01 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-N 120.264 1.393 . . . . 0.0 113.225 -171.708 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -81.02 -19.07 44.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.481 1.112 . . . . 0.0 113.076 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.0 m -97.89 148.35 23.52 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.042 0.937 . . . . 0.0 111.943 178.498 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.2 t -74.72 -35.21 62.67 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -95.23 -25.2 16.46 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -171.504 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.72 147.06 39.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.92 0.888 . . . . 0.0 112.853 -169.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -103.85 -31.4 9.8 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.608 1.163 . . . . 0.0 112.676 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.4 m -79.57 160.67 26.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.291 1.036 . . . . 0.0 113.542 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.49 163.7 22.1 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.857 1.663 . . . . 0.0 112.712 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.4 tppt? 56.53 31.25 18.67 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.467 1.907 . . . . 0.0 113.385 -173.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -89.72 158.84 17.37 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.724 1.609 . . . . 0.0 113.265 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.4 p -162.37 -65.27 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 176.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -56.04 147.64 19.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.7 2.0 . . . . 0.0 113.718 -161.49 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 55.93 27.31 10.92 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.851 1.66 . . . . 0.0 113.72 -171.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.5 mmt85 50.38 50.65 18.33 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 126.526 1.93 . . . . 0.0 111.917 -169.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m 61.23 130.59 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 129.096 2.958 . . . . 0.0 113.681 -162.075 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.47 157.32 61.38 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.83 2.353 . . . . 0.0 112.951 -173.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.3 m 58.98 13.01 2.61 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.81 1.781 . . . . 0.0 115.81 174.326 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.6 mt 48.58 31.84 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 125.681 1.592 . . . . 0.0 112.463 -170.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 56.74 17.58 3.25 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 126.66 1.984 . . . . 0.0 115.355 -174.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -66.33 -15.05 62.94 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.288 1.835 . . . . 0.0 114.44 -176.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.55 -16.57 61.26 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 174.302 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -95.18 166.52 11.87 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.607 1.563 . . . . 0.0 112.179 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.6 tp -139.9 150.19 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.092 1.357 . . . . 0.0 112.226 -176.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.4 tp -133.82 144.49 49.01 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.109 1.763 . . . . 0.0 110.699 178.319 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.8 t -74.74 -45.64 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.844 0.858 . . . . 0.0 111.805 -177.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.6 t70 53.27 30.19 9.68 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.215 1.806 . . . . 0.0 115.387 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -109.03 2.19 21.07 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.035 1.334 . . . . 0.0 113.811 -173.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.85 107.3 13.54 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.26 -0.9 . . . . 0.0 110.988 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.71 -11.54 59.61 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -173.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -121.27 119.44 32.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.435 1.494 . . . . 0.0 111.343 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -138.81 19.87 2.67 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.838 1.655 . . . . 0.0 112.136 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -91.77 153.33 43.74 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 126.203 1.801 . . . . 0.0 113.172 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.94 164.61 35.1 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.26 2.64 . . . . 0.0 112.943 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -123.76 168.31 12.88 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.604 1.962 . . . . 0.0 111.373 174.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.31 -2.3 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -168.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -104.16 144.82 29.47 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.882 1.273 . . . . 0.0 113.738 -176.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -82.59 169.42 13.72 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.093 3.196 . . . . 0.0 113.94 -176.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -90.73 152.34 20.85 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.902 1.681 . . . . 0.0 112.385 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 26.0 m170 47.32 62.7 2.29 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.929 1.692 . . . . 0.0 114.947 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.8 p -79.28 49.79 1.01 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 127.765 2.426 . . . . 0.0 112.577 174.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.7 pt -82.77 159.91 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 C-N-CA 125.372 1.469 . . . . 0.0 113.831 -171.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -136.24 170.49 15.94 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.286 2.235 . . . . 0.0 110.553 178.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 66.5 m -64.24 155.67 31.21 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.62 -0.675 . . . . 0.0 110.503 158.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -72.18 172.7 9.72 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.873 -0.517 . . . . 0.0 111.068 159.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 56.0 t30 65.52 -61.71 0.24 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.555 2.342 . . . . 0.0 115.991 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.94 -21.79 26.04 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -170.171 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.51 -5.59 28.39 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 124.758 1.17 . . . . 0.0 115.457 -173.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -78.8 -171.81 40.56 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.866 1.222 . . . . 0.0 112.789 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -144.34 146.08 32.35 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.881 1.672 . . . . 0.0 110.697 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.47 17.71 48.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 162.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -140.01 132.64 28.83 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.547 1.673 . . . . 0.0 113.23 168.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 40.16 30.55 0.07 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 128.225 2.61 . . . . 0.0 117.141 168.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.7 -31.38 37.67 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.794 1.188 . . . . 0.0 115.514 -164.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.13 -38.34 86.01 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.022 1.729 . . . . 0.0 114.284 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -106.74 -19.98 13.49 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.728 2.011 . . . . 0.0 112.894 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 48.2 t -72.63 -22.67 60.91 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.684 1.994 . . . . 0.0 112.425 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -58.82 149.69 25.95 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.476 1.51 . . . . 0.0 111.493 168.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -70.48 -21.65 62.75 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -169.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 65.2 mttp . . . . . 0 C--O 1.252 1.191 0 C-N-CA 126.282 1.833 . . . . 0.0 111.806 179.274 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.9 tptt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 110.297 -0.261 . . . . 0.0 110.297 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 53.26 38.96 28.96 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.688 1.595 . . . . 0.0 114.457 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -126.0 134.51 51.44 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.664 1.186 . . . . 0.0 112.689 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.05 -51.91 25.5 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.371 1.068 . . . . 0.0 113.223 167.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.86 -39.73 1.68 Allowed 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.447 2.098 . . . . 0.0 113.763 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER 61.1 -55.05 0.1 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 128.251 2.62 . . . . 0.0 115.956 -176.377 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -158.92 158.72 33.89 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.3 2.24 . . . . 0.0 110.809 174.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -67.79 -39.06 84.06 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 112.923 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -160.03 -34.71 0.06 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.934 1.694 . . . . 0.0 113.391 -177.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.5 m -68.44 -30.17 68.98 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -171.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 m 53.2 22.63 2.72 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 170.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -134.82 6.06 3.4 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.298 1.039 . . . . 0.0 113.45 177.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 -141.02 154.93 46.23 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.971 1.708 . . . . 0.0 112.091 -164.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -72.07 -18.01 77.56 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 116.374 1.31 . . . . 0.0 116.374 -169.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.22 95.82 0.79 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 118.448 1.124 . . . . 0.0 111.921 172.073 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.32 178.15 0.57 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.138 1.375 . . . . 0.0 112.688 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.83 -64.56 0.48 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.149 1.779 . . . . 0.0 114.323 -170.784 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -74.67 -15.46 60.8 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.897 1.679 . . . . 0.0 115.075 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.26 -20.02 30.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.704 1.202 . . . . 0.0 111.773 178.367 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.98 154.09 90.86 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 124.18 0.992 . . . . 0.0 112.243 157.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -75.47 142.99 27.1 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.317 2.678 . . . . 0.0 111.585 177.188 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.9 t60 -153.58 167.84 28.19 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.07 1.348 . . . . 0.0 111.124 176.817 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.8 mt 55.42 52.06 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.048 1.739 . . . . 0.0 111.407 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.0 mt -101.1 120.03 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.72 1.608 . . . . 0.0 108.728 -174.078 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 p -62.66 126.82 28.64 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.449 1.022 . . . . 0.0 110.298 -176.784 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.0 m 46.87 29.02 0.93 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -175.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 t80 55.03 30.89 15.04 Favored 'General case' 0 CA--C 1.552 1.058 0 C-N-CA 126.704 2.002 . . . . 0.0 115.195 -172.882 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 91.4 m -73.87 106.63 5.68 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.545 1.538 . . . . 0.0 112.783 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.44 -151.28 50.55 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.538 -0.726 . . . . 0.0 113.951 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -105.12 139.62 39.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.669 1.188 . . . . 0.0 110.202 170.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.3 t -55.17 -27.34 45.03 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -172.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.89 -35.3 22.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -99.53 -13.02 19.64 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -63.9 130.27 43.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.849 1.66 . . . . 0.0 111.745 174.64 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -147.24 149.42 32.86 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.841 1.256 . . . . 0.0 109.804 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.4 p -64.97 -21.11 66.79 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -163.504 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.9 ptt180 -73.78 -19.41 60.78 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -108.5 -35.66 6.42 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.921 1.688 . . . . 0.0 112.323 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.413 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.449 1.6 t 47.72 -114.45 0.0 OUTLIER Pre-proline 0 CA--C 1.563 1.454 0 C-N-CA 128.063 2.545 . . . . 0.0 113.973 174.898 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.413 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 56.0 Cg_endo -79.99 -11.52 13.64 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 CA-C-N 124.491 2.64 . . . . 0.0 116.276 -167.177 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -83.48 54.87 2.98 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.212 1.405 . . . . 0.0 114.321 -165.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.07 -11.46 0.75 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 177.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 mm -119.12 11.55 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 125.565 1.546 . . . . 0.0 112.56 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 pt20 -133.06 160.06 38.27 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -173.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -65.57 165.34 12.46 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.638 1.175 . . . . 0.0 111.61 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 m -71.48 -31.29 66.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -134.61 19.74 3.59 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.06 1.744 . . . . 0.0 113.012 -176.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.0 t -153.13 169.13 23.73 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 126.632 1.973 . . . . 0.0 109.881 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -70.04 -174.43 0.78 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 125.335 1.454 . . . . 0.0 113.822 178.018 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -40.59 128.29 2.49 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.406 2.282 . . . . 0.0 114.967 -172.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m -66.85 -7.88 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 O-C-N 120.953 -1.092 . . . . 0.0 112.374 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 -15.51 31.18 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.928 1.251 . . . . 0.0 114.848 167.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.91 -178.12 6.5 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.289 1.544 . . . . 0.0 114.333 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.6 173.31 2.82 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 118.237 2.68 . . . . 0.0 118.237 -158.296 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 44.19 95.74 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.834 3.254 . . . . 0.0 115.114 161.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.5 m 61.46 22.06 12.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 52.72 72.52 0.41 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.916 1.286 . . . . 0.0 111.024 -167.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.0 t 74.18 133.89 0.04 OUTLIER Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 128.186 2.594 . . . . 0.0 112.237 -162.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -55.63 144.03 76.77 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 123.166 2.577 . . . . 0.0 115.923 -167.926 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -69.62 129.93 41.0 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.816 1.247 . . . . 0.0 112.951 -178.588 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -101.68 30.56 4.26 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.166 1.786 . . . . 0.0 113.642 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 25.7 t-105 -101.29 11.65 38.91 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.047 1.739 . . . . 0.0 113.984 -167.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 93.7 mttt 54.65 32.93 18.21 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.843 1.657 . . . . 0.0 113.108 -174.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tptp -71.93 156.7 38.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 126.232 1.813 . . . . 0.0 111.742 -177.163 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p -58.55 128.95 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.236 0.614 . . . . 0.0 111.593 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -87.1 -12.03 48.34 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 46.2 m -84.18 150.62 25.37 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.29 1.036 . . . . 0.0 112.169 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.5 t -78.97 -36.04 42.06 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.828 1.251 . . . . 0.0 113.601 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -93.9 -9.36 37.45 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -172.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 72.2 m -89.28 148.93 23.3 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.022 0.929 . . . . 0.0 112.325 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -79.48 169.35 18.18 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.542 1.137 . . . . 0.0 111.081 166.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.0 m -82.48 26.92 0.53 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.369 1.068 . . . . 0.0 113.528 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.8 tppt? -150.1 162.06 41.15 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.119 2.168 . . . . 0.0 109.805 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 55.84 39.22 30.69 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.471 1.509 . . . . 0.0 113.113 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -119.6 160.49 22.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.646 1.578 . . . . 0.0 111.924 -174.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 p -152.5 158.86 43.16 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.403 1.081 . . . . 0.0 113.067 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -69.28 171.03 9.13 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.968 1.307 . . . . 0.0 112.912 -176.612 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 57.87 37.65 26.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.993 1.317 . . . . 0.0 112.826 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? 59.18 60.39 2.4 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.134 2.174 . . . . 0.0 112.851 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.6 p 40.8 56.11 7.91 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 127.768 2.427 . . . . 0.0 116.895 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -81.13 -26.01 3.69 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.789 2.993 . . . . 0.0 113.71 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.8 t -138.43 154.89 48.88 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.073 1.349 . . . . 0.0 113.282 -167.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 16.2 tt -74.73 -20.8 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 125.928 1.691 . . . . 0.0 113.43 175.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -61.42 148.29 42.19 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.465 1.106 . . . . 0.0 113.291 -175.483 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -98.98 -0.33 42.34 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.474 1.51 . . . . 0.0 113.492 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.38 9.92 38.18 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.433 1.493 . . . . 0.0 114.986 -167.709 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -61.02 150.83 32.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.097 0.959 . . . . 0.0 113.075 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.8 pt -69.19 148.47 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.945 0.898 . . . . 0.0 113.342 -171.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.3 mt -104.78 12.95 32.11 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.455 1.502 . . . . 0.0 113.413 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.4 m -104.55 158.21 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 125.739 1.616 . . . . 0.0 111.441 175.112 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -79.37 146.14 33.02 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.885 0.874 . . . . 0.0 113.157 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -111.93 13.18 20.83 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.378 1.871 . . . . 0.0 113.647 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.311 0.5 OUTLIER 55.83 19.31 3.42 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 170.781 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -89.84 147.65 23.66 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.216 0.916 . . . . 0.0 111.595 166.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -135.95 -178.87 5.33 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.78 1.632 . . . . 0.0 113.233 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 68.67 134.43 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 129.004 2.922 . . . . 0.0 115.131 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -147.38 97.68 4.04 Favored Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 127.415 2.286 . . . . 0.0 108.941 -178.647 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.63 -14.86 7.62 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.951 2.434 . . . . 0.0 113.952 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -76.72 152.14 35.81 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.529 1.132 . . . . 0.0 113.419 -175.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -139.01 160.82 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.691 1.597 . . . . 0.0 111.415 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.2 mt -111.39 86.24 6.43 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 125.921 1.689 . . . . 0.0 109.097 173.629 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -83.57 170.07 11.84 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.613 2.875 . . . . 0.0 113.905 -167.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 59.17 33.85 22.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.021 1.728 . . . . 0.0 115.254 170.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -126.61 150.55 48.83 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.462 1.505 . . . . 0.0 111.54 177.691 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 54.3 m -128.71 -49.09 1.25 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -174.036 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.3 pp -137.42 154.5 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.511 1.124 . . . . 0.0 113.27 -173.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -142.25 97.98 3.23 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.297 1.439 . . . . 0.0 110.41 -178.253 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 12.7 t -152.77 154.29 34.89 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.957 0.903 . . . . 0.0 111.59 173.851 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -144.2 -43.17 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -80.1 -30.9 39.25 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -164.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 24.2 p -149.6 139.71 22.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.886 1.274 . . . . 0.0 110.782 -176.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 67.14 20.83 71.42 Favored Glycine 0 CA--C 1.541 1.665 0 O-C-N 121.415 -0.803 . . . . 0.0 114.459 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 61.07 -134.08 48.98 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-N 118.088 0.944 . . . . 0.0 112.168 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -92.26 -1.41 57.12 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.866 1.266 . . . . 0.0 114.084 169.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.25 -156.35 27.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.626 1.584 . . . . 0.0 115.355 -173.452 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.7 p80 45.53 -157.14 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.593 2.757 . . . . 0.0 115.516 -178.039 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -71.61 28.76 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.951 1.701 . . . . 0.0 113.097 168.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . 0.414 ' HA2' ' SG ' ' A' ' 121' ' ' CYS . . . -52.36 -24.52 16.82 Favored Glycine 0 CA--C 1.541 1.69 0 C-N-CA 127.962 2.696 . . . . 0.0 115.58 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -67.04 -40.25 87.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.267 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -98.09 -17.57 19.02 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.318 1.847 . . . . 0.0 113.176 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . 0.414 ' SG ' ' HA2' ' A' ' 118' ' ' GLY . 1.8 p -71.8 6.5 1.97 Allowed 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 115.033 1.494 . . . . 0.0 115.033 -174.831 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.3 mttm -74.94 158.59 33.05 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.79 1.636 . . . . 0.0 112.99 -170.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -136.89 147.0 46.19 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.113 1.365 . . . . 0.0 111.759 -172.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.838 1.655 . . . . 0.0 112.174 -179.583 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -156.14 165.56 36.05 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.085 1.754 . . . . 0.0 111.607 -172.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.34 132.88 34.23 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.145 0.978 . . . . 0.0 113.082 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.72 37.86 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.747 1.219 . . . . 0.0 113.58 165.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -46.16 0.36 Allowed 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.044 1.829 . . . . 0.0 114.029 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt 41.71 -163.31 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.95 1.3 . . . . 0.0 112.816 -149.183 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 m -58.52 150.13 23.58 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.08 -1.637 . . . . 0.0 113.129 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 38.4 t30 -64.43 -44.95 89.6 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.691 0.797 . . . . 0.0 112.277 -179.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -121.72 -58.25 1.76 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.63 1.172 . . . . 0.0 112.249 -167.234 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.5 p -79.48 -166.37 0.95 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.684 0.793 . . . . 0.0 110.931 167.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 62.3 p -134.61 23.47 3.68 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -69.19 171.66 8.06 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.774 -0.579 . . . . 0.0 111.631 168.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.58 149.32 39.85 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.787 1.235 . . . . 0.0 111.964 168.238 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 122.03 -93.28 0.5 Allowed Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.093 1.33 . . . . 0.0 110.716 -169.087 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.08 74.8 2.95 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 121.956 0.884 . . . . 0.0 113.047 176.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -62.03 173.86 1.0 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.865 1.266 . . . . 0.0 113.008 173.583 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -16.03 -73.63 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.776 2.83 . . . . 0.0 115.44 -171.589 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -67.46 -26.26 66.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.309 1.843 . . . . 0.0 115.65 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.94 -20.52 24.39 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.201 1.8 . . . . 0.0 112.828 176.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -56.92 -40.93 88.64 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.243 1.817 . . . . 0.0 114.56 -173.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -65.1 131.55 29.01 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.865 2.377 . . . . 0.0 112.474 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -74.77 139.87 43.64 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.5 mt -127.32 90.6 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.808 1.643 . . . . 0.0 108.919 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.16 155.65 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 126.8 2.04 . . . . 0.0 110.553 -176.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 73.9 m -87.05 1.05 54.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.093 1.357 . . . . 0.0 113.853 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.437 ' C ' ' H ' ' A' ' 28' ' ' CYS . 51.0 m 63.66 126.13 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.343 2.257 . . . . 0.0 114.065 -163.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 40.2 t80 57.83 -21.09 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 127.412 2.285 . . . . 0.0 116.012 -164.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.437 ' H ' ' C ' ' A' ' 26' ' ' SER . 4.0 t -110.82 138.15 47.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.378 2.271 . . . . 0.0 111.036 178.396 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.55 -178.14 51.47 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.047 1.308 . . . . 0.0 114.864 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -140.03 144.66 37.01 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.51 1.524 . . . . 0.0 110.229 171.877 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.0 t -69.98 -16.04 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -172.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.2 -21.69 15.42 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.663 1.585 . . . . 0.0 114.006 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.83 108.61 4.03 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.533 1.133 . . . . 0.0 111.841 -175.687 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -148.4 143.19 26.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.871 1.269 . . . . 0.0 110.799 -178.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -135.99 105.47 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 -167.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.2 m 54.76 -160.01 0.17 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.533 1.533 . . . . 0.0 114.527 167.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.6 2.07 23.75 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 166.093 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -80.13 -40.54 27.23 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.71 1.204 . . . . 0.0 111.733 177.576 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.9 m 63.85 166.04 0.11 Allowed Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 128.121 2.568 . . . . 0.0 114.83 -178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -118.42 -153.78 0.0 OUTLIER 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.481 2.788 . . . . 0.0 112.814 -160.512 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -66.95 -15.58 63.79 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.064 1.746 . . . . 0.0 115.446 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 58.35 -166.39 0.16 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.008 1.723 . . . . 0.0 115.148 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.3 mt -83.43 52.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.123 1.769 . . . . 0.0 112.095 -163.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -150.32 148.83 29.31 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.579 1.552 . . . . 0.0 113.661 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.3 t -81.13 133.22 35.43 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.88 2.072 . . . . 0.0 109.503 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.7 p -67.16 -21.6 65.8 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -77.09 -26.22 53.14 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.917 1.287 . . . . 0.0 113.059 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.7 p -153.56 -92.91 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -136.67 -164.55 1.59 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.52 1.928 . . . . 0.0 111.772 -166.118 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -45.71 139.47 4.01 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.702 1.601 . . . . 0.0 113.946 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.0 m -64.83 -8.61 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 121.176 -0.952 . . . . 0.0 112.585 173.05 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.88 -8.14 2.02 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 127.159 2.314 . . . . 0.0 115.754 171.392 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -147.41 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.921 1.688 . . . . 0.0 112.445 163.818 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -52.64 126.16 18.87 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.814 -1.179 . . . . 0.0 112.732 176.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.4 mmt-85 -66.41 160.24 25.25 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.897 2.079 . . . . 0.0 112.852 -171.343 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m 55.71 36.66 27.67 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.441 1.096 . . . . 0.0 113.076 -166.501 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.271 10.6 pt20 42.12 90.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.941 2.896 . . . . 0.0 115.843 -178.04 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.7 t 61.85 55.05 2.76 Favored Pre-proline 0 CA--C 1.556 1.201 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 164.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -68.49 179.02 3.28 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.761 2.974 . . . . 0.0 112.723 170.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -56.68 -16.76 6.9 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.213 1.805 . . . . 0.0 115.527 -174.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -69.16 -16.55 63.66 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.655 1.182 . . . . 0.0 114.133 172.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -66.05 131.92 47.33 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.929 0.891 . . . . 0.0 111.152 167.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 33.0 mmmt -139.21 160.09 40.63 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.935 1.694 . . . . 0.0 111.873 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -140.84 166.09 25.74 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.864 2.066 . . . . 0.0 111.199 173.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.438 HG13 ' H ' ' A' ' 67' ' ' CYS . 21.6 t -67.73 131.12 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 164.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -77.81 -0.39 26.99 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . 0.438 ' H ' HG13 ' A' ' 65' ' ' VAL . 80.8 m -124.63 165.58 17.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.965 1.706 . . . . 0.0 111.443 170.432 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.2 p -127.73 -28.48 2.71 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.061 2.144 . . . . 0.0 110.852 -159.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.4 -37.79 87.16 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.114 1.766 . . . . 0.0 110.501 161.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.9 m -82.79 129.55 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.01 1.324 . . . . 0.0 111.677 -173.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -114.59 14.57 17.69 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.488 1.515 . . . . 0.0 113.49 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.3 t -140.95 161.79 37.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.421 1.888 . . . . 0.0 112.401 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.6 -18.66 59.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.0 1.32 . . . . 0.0 114.262 173.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -79.18 147.05 32.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.085 0.954 . . . . 0.0 111.074 168.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -142.65 146.3 34.33 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.506 1.122 . . . . 0.0 111.878 -175.268 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.8 m -133.85 105.25 6.67 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -168.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -66.03 -17.35 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.144 1.377 . . . . 0.0 114.242 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -85.74 -9.77 56.61 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.077 0.951 . . . . 0.0 113.389 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -119.81 -43.6 2.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.533 1.533 . . . . 0.0 113.792 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 t -80.44 -57.58 0.62 Allowed Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -171.038 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -76.07 154.89 37.9 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.255 1.97 . . . . 0.0 113.067 -176.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 26.0 m 58.91 -172.17 0.11 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 116.224 1.935 . . . . 0.0 116.224 167.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 9.5 tp -139.74 138.37 38.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 125.527 1.531 . . . . 0.0 110.462 174.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -92.92 116.71 29.29 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.664 0.786 . . . . 0.0 111.231 177.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -134.94 13.35 3.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.685 1.594 . . . . 0.0 113.46 178.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -110.27 169.1 8.96 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.077 1.351 . . . . 0.0 113.326 -172.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -142.47 153.81 43.99 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.996 1.319 . . . . 0.0 111.408 172.094 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 78.9 mt -78.56 131.95 33.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.239 1.016 . . . . 0.0 111.213 -173.763 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -129.58 150.9 50.71 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.377 1.871 . . . . 0.0 109.801 169.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 49.3 t -130.66 138.67 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.968 1.307 . . . . 0.0 110.434 -174.191 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -135.34 160.93 36.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.128 1.771 . . . . 0.0 111.456 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -124.65 150.77 45.7 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.513 1.525 . . . . 0.0 111.928 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -110.97 144.2 40.44 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.574 1.549 . . . . 0.0 112.461 -175.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -134.45 138.94 45.16 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.241 1.416 . . . . 0.0 111.481 176.186 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -154.07 159.65 41.63 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.1 1.76 . . . . 0.0 112.416 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -114.14 167.11 10.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.628 1.571 . . . . 0.0 112.758 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -132.6 134.9 25.29 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.785 1.634 . . . . 0.0 112.089 -176.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -80.85 -177.54 3.81 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.371 3.381 . . . . 0.0 113.124 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -64.55 160.86 18.6 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 113.304 175.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.07 143.15 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 126.42 1.888 . . . . 0.0 108.778 166.379 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 146.34 99.02 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -173.453 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.41 140.65 9.7 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.336 2.69 . . . . 0.0 112.788 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -141.93 -6.73 0.97 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 172.244 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -110.6 8.68 22.9 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -164.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 34.3 p -93.13 7.95 42.12 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.736 2.015 . . . . 0.0 114.031 -175.787 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.1 tt -44.47 -38.63 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 127.25 2.22 . . . . 0.0 116.06 -164.664 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -75.39 -11.7 60.1 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.9 t -156.81 46.38 0.42 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.265 1.026 . . . . 0.0 112.011 168.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -58.93 -18.21 31.53 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -168.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -62.63 -29.63 70.77 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.492 1.517 . . . . 0.0 114.802 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 22.8 p -150.68 -2.07 0.37 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.63 -169.09 46.59 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.809 1.195 . . . . 0.0 113.279 -171.641 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.58 0.64 87.81 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.289 0.947 . . . . 0.0 115.088 -174.307 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt 28.87 99.06 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 129.849 3.26 . . . . 0.0 116.256 170.337 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 98.06 3.9 57.79 Favored Glycine 0 CA--C 1.534 1.255 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 167.656 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -91.51 121.4 33.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.991 . . . . 0.0 112.008 169.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 38.73 35.63 0.12 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.656 2.382 . . . . 0.0 115.274 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.32 -33.17 52.46 Favored Glycine 0 N--CA 1.476 1.307 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 -150.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.35 -48.64 49.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.242 1.417 . . . . 0.0 113.282 177.182 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -77.28 -26.82 52.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.142 1.377 . . . . 0.0 112.269 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 8.1 t -74.29 -2.99 27.47 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.271 1.828 . . . . 0.0 113.382 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.37 -22.84 65.55 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.603 1.561 . . . . 0.0 113.752 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -124.72 158.57 32.91 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.958 1.303 . . . . 0.0 112.794 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--O 1.252 1.226 0 C-N-CA 126.619 1.968 . . . . 0.0 111.671 179.1 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 47.6 tttp . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.499 0.19 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -74.09 -19.77 60.48 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -172.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.22 124.94 33.17 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -167.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -86.66 -51.03 0.46 Allowed Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.344 1.457 . . . . 0.0 113.404 158.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.15 -31.52 7.67 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 123.032 2.488 . . . . 0.0 115.314 -173.212 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . 0.469 ' HD3' ' H ' ' A' ' 12' ' ' GLN 0.264 1.4 tmmt? 62.25 -60.93 0.12 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 128.115 2.566 . . . . 0.0 117.011 176.783 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -164.54 152.58 12.23 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.738 2.815 . . . . 0.0 109.54 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -68.53 -34.39 75.78 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -144.92 -39.98 0.25 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.254 1.421 . . . . 0.0 113.223 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.6 p -88.0 -156.4 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.731 1.612 . . . . 0.0 111.364 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -146.25 143.78 29.42 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -172.967 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.469 ' H ' ' HD3' ' A' ' 6' ' ' LYS . 41.2 mt-30 58.71 46.21 14.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.752 2.021 . . . . 0.0 115.004 160.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -126.54 14.25 7.6 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.979 1.711 . . . . 0.0 113.858 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.62 -41.73 1.92 Allowed Glycine 0 N--CA 1.477 1.39 0 C-N-CA 125.543 1.544 . . . . 0.0 115.704 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.54 84.4 0.43 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.265 1.426 . . . . 0.0 111.935 172.112 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -63.44 -179.66 0.36 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.678 1.591 . . . . 0.0 113.529 176.518 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.03 -68.08 0.06 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 127.171 2.189 . . . . 0.0 114.97 -171.182 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -73.96 -22.57 59.59 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.339 1.856 . . . . 0.0 115.386 -179.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.15 -26.92 26.53 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.58 1.552 . . . . 0.0 112.339 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.44 -50.85 83.81 Favored Pre-proline 0 CA--C 1.546 0.798 0 C-N-CA 125.789 1.636 . . . . 0.0 114.86 -173.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.36 119.09 5.62 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 121.86 1.706 . . . . 0.0 112.014 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -89.49 167.7 12.78 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.989 0.915 . . . . 0.0 111.241 167.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.1 mt -80.05 71.57 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.759 1.224 . . . . 0.0 110.787 -176.691 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.2 mt -135.25 146.4 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.22 2.208 . . . . 0.0 109.285 172.696 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.1 t -71.16 125.55 27.23 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.344 0.658 . . . . 0.0 111.091 173.769 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 10.0 t -65.63 127.25 31.14 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -164.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 50.51 31.74 5.9 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.146 1.778 . . . . 0.0 114.329 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.8 t -135.39 -21.48 1.56 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.625 1.17 . . . . 0.0 113.868 -167.475 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.96 170.7 37.7 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.593 1.092 . . . . 0.0 113.13 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -100.96 158.6 15.87 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.557 1.543 . . . . 0.0 110.763 170.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.8 t -59.95 -31.28 69.72 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -100.13 -7.69 24.55 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.901 1.28 . . . . 0.0 113.705 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -149.21 87.57 1.54 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.496 1.119 . . . . 0.0 112.27 -173.307 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . 0.453 ' CG ' ' H ' ' A' ' 35' ' ' TYR . 46.9 t-80 -153.34 174.6 14.12 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.03 2.132 . . . . 0.0 110.009 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.453 ' H ' ' CG ' ' A' ' 34' ' ' HIS 0.297 1.7 p90 59.06 -30.24 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 131.157 3.783 . . . . 0.0 117.994 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 86.6 p -60.83 163.56 5.59 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.487 1.039 . . . . 0.0 111.423 162.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.9 ttt-85 54.98 24.72 6.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.587 1.155 . . . . 0.0 112.508 -164.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 46.24 96.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.043 2.537 . . . . 0.0 114.263 -167.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.431 6.4 t 73.18 -105.02 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.236 0 C-N-CA 127.984 2.514 . . . . 0.0 115.602 177.636 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -66.75 138.96 50.79 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.695 2.264 . . . . 0.0 113.773 -166.26 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -143.62 -29.19 0.52 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -171.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.46 174.67 13.6 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -173.167 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.276 2.7 mt 64.15 63.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 127.48 2.312 . . . . 0.0 114.174 169.269 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -128.83 168.74 15.47 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.478 1.511 . . . . 0.0 113.095 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 83.9 m -70.91 163.48 27.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.792 0.806 . . . . 0.0 112.237 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m -74.32 -24.02 59.14 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -120.64 -5.65 9.72 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.528 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.6 p -148.53 158.72 44.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.579 1.151 . . . . 0.0 111.995 178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -74.37 137.92 43.08 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.562 1.145 . . . . 0.0 113.202 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.05 155.41 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 128.538 2.735 . . . . 0.0 115.203 -172.343 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m -88.4 -10.52 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 O-C-N 120.571 -1.33 . . . . 0.0 111.164 157.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.06 40.26 0.7 Allowed Glycine 0 CA--C 1.537 1.449 0 C-N-CA 128.593 2.996 . . . . 0.0 117.174 -164.278 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.06 -138.03 0.22 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.533 2.333 . . . . 0.0 111.33 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -51.92 121.91 7.46 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 124.957 1.303 . . . . 0.0 113.194 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 47.75 23.28 0.42 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.062 2.545 . . . . 0.0 114.562 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.28 77.3 p 44.63 27.99 0.29 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.807 2.443 . . . . 0.0 114.906 -166.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -145.67 -13.33 0.5 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -171.27 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.315 1.7 t 97.29 -64.45 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.222 0 N-CA-C 118.987 2.958 . . . . 0.0 118.987 173.237 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.95 159.63 37.71 Favored 'Trans proline' 0 C--N 1.353 0.786 0 CA-C-N 122.983 2.101 . . . . 0.0 114.532 -162.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -61.66 144.9 53.8 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.369 1.468 . . . . 0.0 113.588 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -140.5 151.67 44.99 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 126.69 1.996 . . . . 0.0 110.602 169.342 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 28.7 p90 -64.7 151.8 44.08 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -124.66 23.85 7.94 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.163 1.785 . . . . 0.0 113.164 -174.803 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -71.8 -19.11 62.04 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.376 1.47 . . . . 0.0 114.873 -171.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.9 p -144.23 133.72 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 126.277 1.831 . . . . 0.0 109.674 177.767 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -94.77 -4.29 47.56 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.986 0.915 . . . . 0.0 113.36 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 78.0 m -112.58 1.15 15.69 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.663 1.585 . . . . 0.0 114.879 -166.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.263 11.0 t 55.7 -46.72 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 129.292 3.037 . . . . 0.0 118.266 -171.462 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 pp -90.92 -18.04 25.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.958 1.703 . . . . 0.0 114.23 -176.124 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.05 166.63 23.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.153 0.981 . . . . 0.0 112.265 177.423 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.18 150.34 43.85 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.487 -0.758 . . . . 0.0 111.921 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.2 p -74.92 28.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 128.461 2.705 . . . . 0.0 116.064 -176.784 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -122.09 156.35 33.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.508 1.923 . . . . 0.0 110.48 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -65.26 116.42 6.58 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.728 0.811 . . . . 0.0 110.87 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 49.6 p-80 -137.71 2.82 2.45 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.131 1.772 . . . . 0.0 112.861 -174.472 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.7 m -81.28 34.61 0.37 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.029 1.731 . . . . 0.0 115.568 -156.719 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -54.15 139.16 36.31 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.274 1.43 . . . . 0.0 112.224 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 45.92 45.98 12.09 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.905 1.282 . . . . 0.0 113.522 -170.119 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.7 mtm180 58.26 38.75 26.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.374 1.87 . . . . 0.0 113.45 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.7 t 60.57 123.11 0.02 OUTLIER Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 129.085 2.954 . . . . 0.0 113.394 -165.176 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -76.34 -25.01 10.26 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.222 1.948 . . . . 0.0 113.249 -176.249 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.3 m -85.28 -5.58 59.31 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.362 1.616 . . . . 0.0 115.362 -167.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.2 tt -71.59 149.38 9.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 123.658 0.783 . . . . 0.0 112.35 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 42.8 p90 -78.86 169.53 18.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.431 1.493 . . . . 0.0 114.568 -173.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 32.3 ttm-85 -58.61 145.36 39.89 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.911 2.085 . . . . 0.0 113.063 -175.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.31 169.97 8.43 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.351 1.461 . . . . 0.0 113.193 -178.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -61.38 -26.93 68.16 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -174.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . 0.45 ' H ' HD11 ' A' ' 88' ' ' ILE . 0.1 OUTLIER -72.22 -7.38 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 173.959 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 97.0 mt -123.43 5.13 9.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.548 1.939 . . . . 0.0 113.579 -178.3 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.8 p -73.99 -29.21 25.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 119.476 1.035 . . . . 0.0 113.777 -172.398 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 25.9 t0 49.07 55.16 9.73 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 126.203 1.801 . . . . 0.0 114.676 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -133.0 144.12 49.89 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.01 1.324 . . . . 0.0 112.247 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -78.65 136.19 37.4 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.519 1.128 . . . . 0.0 111.88 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -103.42 157.72 16.84 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.634 1.173 . . . . 0.0 113.229 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -78.3 128.56 33.88 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.27 1.028 . . . . 0.0 111.024 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -133.82 -0.93 3.09 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -176.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -88.07 147.91 41.78 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.522 1.129 . . . . 0.0 112.15 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.88 155.03 51.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.399 2.733 . . . . 0.0 114.204 175.545 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . 0.416 ' HG3' ' H ' ' A' ' 100' ' ' VAL . 27.2 tptt -149.65 -172.8 4.24 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.251 1.82 . . . . 0.0 111.07 177.364 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . 0.416 ' H ' ' HG3' ' A' ' 99' ' ' LYS . 10.5 p -53.05 144.32 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.068 1.347 . . . . 0.0 112.886 177.939 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.63 159.73 82.56 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.352 1.061 . . . . 0.0 112.51 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -59.42 -23.01 68.6 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.575 2.85 . . . . 0.0 115.064 177.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -123.53 126.74 47.24 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.531 1.532 . . . . 0.0 110.244 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 34.4 p80 -148.2 27.89 0.93 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.53 1.132 . . . . 0.0 113.268 -174.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.6 t -122.48 170.32 10.1 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.704 1.201 . . . . 0.0 113.752 -173.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 81.3 mt -125.34 136.46 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 127.556 2.343 . . . . 0.0 110.161 -171.85 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -96.44 -48.39 5.59 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.219 1.008 . . . . 0.0 112.844 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 43.5 t -89.02 109.9 20.68 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.967 0.907 . . . . 0.0 111.174 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -70.63 -22.69 62.5 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.103 0.961 . . . . 0.0 113.538 -178.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -83.0 -19.62 36.65 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -171.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 31.5 p -150.08 10.12 0.69 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.07 3.71 85.21 Favored Glycine 0 CA--C 1.537 1.443 0 O-C-N 121.033 -1.042 . . . . 0.0 115.199 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -81.4 -159.76 23.95 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.758 1.171 . . . . 0.0 113.874 176.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.36 169.07 25.56 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 112.272 176.259 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 70.31 22.3 77.53 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 117.055 1.582 . . . . 0.0 117.055 158.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . 0.454 ' C ' ' H ' ' A' ' 118' ' ' GLY . 1.7 p80 -138.81 -165.45 1.83 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.845 1.323 . . . . 0.0 112.145 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -66.04 30.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.259 1.823 . . . . 0.0 113.998 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . 0.454 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -53.42 -25.75 28.04 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 128.232 2.825 . . . . 0.0 114.869 -178.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.9 -40.24 94.75 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.298 1.839 . . . . 0.0 113.533 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -111.61 -15.35 13.49 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.056 1.742 . . . . 0.0 113.027 -172.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 1.6 p -62.7 155.36 26.64 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.809 0.814 . . . . 0.0 112.698 178.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -70.26 155.41 40.7 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.01 0.924 . . . . 0.0 112.894 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -74.93 129.09 37.05 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 122.126 -0.359 . . . . 0.0 110.452 168.602 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 49.4 tttp . . . . . 0 C--O 1.253 1.237 0 C-N-CA 126.883 2.073 . . . . 0.0 113.296 -178.654 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.2 mtmt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 110.737 -0.097 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -89.24 156.8 18.53 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.201 1.0 . . . . 0.0 113.531 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.57 136.36 36.06 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.628 1.171 . . . . 0.0 110.982 172.033 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.73 -48.31 93.82 Favored Pre-proline 0 CA--C 1.551 1.017 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 170.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -41.47 0.54 Allowed 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.63 2.22 . . . . 0.0 113.988 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? 59.01 -54.03 0.05 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 128.778 2.831 . . . . 0.0 116.122 -171.115 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 167.95 28.94 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.828 2.451 . . . . 0.0 111.703 175.375 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -74.48 -34.03 63.0 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -153.89 -47.32 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.966 1.306 . . . . 0.0 112.879 -175.508 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.9 p -79.06 -164.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.284 1.034 . . . . 0.0 111.96 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 t -139.15 29.26 2.25 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -162.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -94.83 156.33 16.41 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.966 1.306 . . . . 0.0 111.512 175.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -76.29 161.25 28.9 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.17 1.788 . . . . 0.0 112.49 178.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.22 -11.73 41.96 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.652 1.821 . . . . 0.0 117.652 162.156 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.253 0.6 OUTLIER -134.82 72.6 1.46 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.591 1.696 . . . . 0.0 111.744 173.95 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.75 177.9 0.1 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.129 2.172 . . . . 0.0 113.858 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.24 -68.84 0.06 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 127.184 2.194 . . . . 0.0 115.271 -173.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -75.5 -18.54 59.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -92.09 -21.97 20.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.837 1.655 . . . . 0.0 113.114 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.1 t -56.97 -43.66 99.49 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.58 1.552 . . . . 0.0 114.934 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -66.83 -11.29 31.48 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 122.519 2.146 . . . . 0.0 117.044 -168.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -60.86 -19.16 59.55 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -176.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.6 tt -70.0 -19.37 22.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 126.223 1.809 . . . . 0.0 113.829 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mt -104.85 129.62 57.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.421 1.888 . . . . 0.0 109.414 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 p -75.95 133.44 40.47 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.416 -0.803 . . . . 0.0 110.375 168.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 p -57.71 120.61 8.67 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.658 1.583 . . . . 0.0 113.774 -164.798 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 55.3 -13.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.358 2.663 . . . . 0.0 116.984 -171.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -87.63 46.34 1.37 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 110.941 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.23 159.73 10.24 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 120.594 -1.316 . . . . 0.0 114.864 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.58 134.14 53.05 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.034 1.333 . . . . 0.0 109.524 163.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.7 t -66.77 -9.54 37.94 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -162.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -104.08 -10.27 18.14 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.278 1.431 . . . . 0.0 114.519 172.602 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.94 -17.91 8.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.043 1.737 . . . . 0.0 113.682 -174.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -87.47 145.07 26.42 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.833 1.653 . . . . 0.0 112.922 -173.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -150.66 155.43 39.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.504 1.522 . . . . 0.0 109.855 174.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.1 p -61.43 -30.26 70.46 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -173.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.6 mtp-105 -82.79 -28.65 30.15 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.145 1.378 . . . . 0.0 112.915 171.49 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -85.94 -9.35 57.03 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.314 1.446 . . . . 0.0 113.448 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.5 t -17.51 -61.87 0.04 OUTLIER Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 130.558 3.543 . . . . 0.0 117.3 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -63.57 -21.76 70.54 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.757 2.305 . . . . 0.0 115.982 -174.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -83.93 112.1 19.85 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.803 1.183 . . . . 0.0 110.165 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.77 -155.8 0.66 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.838 1.255 . . . . 0.0 112.331 -159.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.5 87.29 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 124.709 1.204 . . . . 0.0 109.511 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -128.38 160.37 32.45 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.181 1.792 . . . . 0.0 113.154 -171.66 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.62 -4.11 35.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.379 2.271 . . . . 0.0 113.63 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 48.2 m 64.66 -28.75 0.1 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 128.102 2.561 . . . . 0.0 117.471 -171.782 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -124.45 3.84 8.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.155 1.782 . . . . 0.0 113.71 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.3 t -154.44 47.3 0.58 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.896 1.278 . . . . 0.0 111.031 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 49.39 -159.11 0.06 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.864 1.266 . . . . 0.0 114.203 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.415 ' HG2' ' H ' ' A' ' 52' ' ' GLY . 21.0 tt0 -48.17 140.17 7.59 Favored 'General case' 0 CA--C 1.552 1.054 0 O-C-N 120.018 -1.677 . . . . 0.0 113.193 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.4 m -63.73 -23.21 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 119.742 -1.849 . . . . 0.0 111.507 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . 0.415 ' H ' ' HG2' ' A' ' 50' ' ' GLU . . . -81.13 -13.94 80.02 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.962 1.744 . . . . 0.0 116.294 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -79.86 -17.7 52.55 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.098 1.949 . . . . 0.0 115.152 -168.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -131.74 144.16 50.77 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.904 1.282 . . . . 0.0 110.922 169.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -58.84 152.8 18.43 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.392 1.477 . . . . 0.0 112.395 -173.128 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.7 m 58.91 40.81 22.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 113.175 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.275 18.7 pt20 48.14 49.16 17.82 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.809 2.044 . . . . 0.0 114.454 -175.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 73.7 m 63.18 148.75 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 128.362 2.665 . . . . 0.0 115.762 -170.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -70.66 162.42 42.58 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.376 2.717 . . . . 0.0 112.659 174.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -141.99 143.06 33.01 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.012 1.325 . . . . 0.0 111.934 176.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -147.46 142.39 26.93 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.416 1.886 . . . . 0.0 110.841 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 58.1 p-90 -134.76 -4.34 2.52 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.3 tttp -127.03 147.49 50.14 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.423 1.489 . . . . 0.0 111.939 -171.678 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -69.49 -35.55 75.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.864 1.266 . . . . 0.0 113.163 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.2 p -106.75 145.32 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.976 1.71 . . . . 0.0 110.688 174.422 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 8.5 tm0? -84.03 24.62 0.9 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.039 1.336 . . . . 0.0 113.298 -173.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.8 m -137.05 154.36 50.38 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.783 1.633 . . . . 0.0 110.701 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -70.5 -177.37 1.47 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 122.098 -0.376 . . . . 0.0 110.588 149.643 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.305 2.9 pp 55.25 9.92 0.39 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.865 2.466 . . . . 0.0 116.805 173.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 46.7 m -116.43 164.21 14.89 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.577 1.551 . . . . 0.0 114.022 -171.401 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 59.78 1.55 0.31 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.989 2.916 . . . . 0.0 118.353 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.0 p -72.67 -32.71 66.02 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.124 0.969 . . . . 0.0 112.137 156.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -139.25 -179.03 5.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.011 2.925 . . . . 0.0 110.23 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -54.97 148.44 13.51 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.424 1.49 . . . . 0.0 113.107 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -85.11 114.83 22.53 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.96 0.904 . . . . 0.0 111.882 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.9 m -77.25 78.04 3.78 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.443 1.497 . . . . 0.0 112.759 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -57.15 -28.27 62.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.336 1.455 . . . . 0.0 114.1 -174.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.06 -9.91 59.76 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -131.72 -31.28 1.56 Allowed 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -169.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 49.8 t -79.14 -46.17 1.69 Allowed Pre-proline 0 CA--C 1.55 0.952 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -65.46 -34.01 44.72 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 122.287 1.991 . . . . 0.0 114.649 -175.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.1 p -148.78 138.83 22.24 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.002 1.321 . . . . 0.0 111.024 -176.707 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.2 tt -140.5 131.28 29.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.622 1.569 . . . . 0.0 111.141 -176.588 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 17.9 m0 49.78 31.46 4.5 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.661 1.984 . . . . 0.0 115.148 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -82.99 125.69 31.7 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.784 1.634 . . . . 0.0 110.495 177.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.96 146.95 24.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.665 0.786 . . . . 0.0 112.884 -177.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -119.33 32.99 5.82 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.974 1.71 . . . . 0.0 111.814 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 pp -69.56 162.13 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.884 1.274 . . . . 0.0 113.434 -176.095 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.6 mt -108.29 151.66 25.67 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.279 1.432 . . . . 0.0 111.738 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.6 p -137.97 39.4 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 127.423 2.289 . . . . 0.0 109.231 171.129 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -121.66 103.47 8.92 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.797 1.639 . . . . 0.0 109.722 -162.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -132.15 163.79 27.74 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.427 1.491 . . . . 0.0 113.603 -164.603 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -102.23 14.23 32.53 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -170.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -67.53 122.41 17.94 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.421 -1.424 . . . . 0.0 111.243 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -83.02 -26.92 30.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 57.64 -19.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 128.68 2.792 . . . . 0.0 118.295 -179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 46.4 71.69 1.49 Allowed Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 128.256 2.623 . . . . 0.0 113.587 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -63.6 150.4 88.58 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.284 1.99 . . . . 0.0 110.929 168.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -131.16 154.29 48.51 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.38 1.472 . . . . 0.0 111.735 -176.08 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.5 m -110.86 13.35 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.889 1.676 . . . . 0.0 112.906 176.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.5 tp -66.96 -30.95 3.5 Favored Pre-proline 0 CA--C 1.553 1.058 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 172.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -58.94 162.1 14.15 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 122.862 2.375 . . . . 0.0 113.779 171.268 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -63.54 153.55 35.33 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 27.4 m80 -75.46 1.19 14.69 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 116.435 2.013 . . . . 0.0 116.435 -158.486 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.5 p -98.92 -7.36 27.23 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.755 1.622 . . . . 0.0 114.776 -173.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 36.1 pt -110.99 137.94 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 124.952 1.301 . . . . 0.0 112.206 178.36 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -159.12 129.65 5.91 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.765 1.226 . . . . 0.0 112.418 -176.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 p -92.03 159.69 15.59 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.35 1.06 . . . . 0.0 113.799 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -130.14 -41.42 1.27 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.621 1.168 . . . . 0.0 113.317 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -79.74 4.19 17.05 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.736 1.214 . . . . 0.0 113.524 175.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 36.0 t -139.01 145.54 39.79 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.091 2.157 . . . . 0.0 108.785 168.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.25 164.64 40.47 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.559 1.076 . . . . 0.0 115.191 -175.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.5 -13.29 23.09 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.35 1.452 . . . . 0.0 116.269 174.565 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . 0.278 64.4 pttt 45.92 31.41 1.08 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 127.804 2.442 . . . . 0.0 116.411 172.863 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.26 -17.07 19.02 Favored Glycine 0 CA--C 1.537 1.443 0 N-CA-C 117.095 1.598 . . . . 0.0 117.095 -168.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -151.53 156.19 40.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.211 1.505 . . . . 0.0 114.508 -166.159 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 19.3 t80 46.71 33.67 2.2 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.269 2.227 . . . . 0.0 115.33 166.803 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.74 -14.54 30.03 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.653 1.597 . . . . 0.0 116.73 -166.7 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.95 -34.49 78.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.575 1.15 . . . . 0.0 113.523 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -141.79 -11.21 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -172.208 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 46.5 t -61.98 116.57 5.01 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.017 -1.052 . . . . 0.0 113.374 -174.445 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -147.51 144.82 28.83 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 128.637 2.775 . . . . 0.0 109.352 178.823 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -102.14 142.6 33.14 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.62 0.768 . . . . 0.0 111.455 166.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 89.1 mttt . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.245 1.818 . . . . 0.0 112.858 179.427 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -85.29 50.09 1.88 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.401 1.48 . . . . 0.0 113.791 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.28 116.24 7.11 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.113 0.965 . . . . 0.0 112.597 -175.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -72.92 -54.63 4.48 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.134 0.974 . . . . 0.0 112.798 172.088 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -80.42 -27.71 3.3 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.0 2.466 . . . . 0.0 114.132 178.119 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 tptt 57.61 -67.92 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.31 2.644 . . . . 0.0 115.524 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 36.0 t -166.17 154.88 11.08 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 129.145 2.978 . . . . 0.0 108.675 177.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -67.32 -55.28 14.51 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.85 -1.156 . . . . 0.0 112.747 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -121.13 -58.59 1.79 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.835 0.854 . . . . 0.0 113.056 -168.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.5 p -86.81 -159.05 0.47 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.896 1.279 . . . . 0.0 111.194 172.502 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 61.4 m -149.9 169.37 21.29 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.606 1.162 . . . . 0.0 113.646 -174.952 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 61.55 27.11 16.68 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.184 1.793 . . . . 0.0 115.418 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.8 mtp85 -120.3 6.02 10.7 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.343 1.457 . . . . 0.0 114.837 -177.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.51 -33.69 0.98 Allowed Glycine 0 CA--C 1.536 1.377 0 C-N-CA 125.44 1.495 . . . . 0.0 115.71 175.227 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -71.13 96.29 1.34 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.387 1.094 . . . . 0.0 112.263 175.063 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.03 179.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 127.186 2.195 . . . . 0.0 113.404 169.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.2 -64.37 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.506 1.522 . . . . 0.0 114.077 -169.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.95 -1.8 41.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.81 1.644 . . . . 0.0 115.29 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -94.53 -26.89 16.23 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.101 1.361 . . . . 0.0 111.166 172.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.5 t -62.81 149.73 88.95 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 125.555 1.542 . . . . 0.0 110.958 173.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -68.21 149.23 75.97 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.748 2.299 . . . . 0.0 115.888 -161.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -111.91 0.36 16.08 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.439 1.496 . . . . 0.0 114.457 -178.196 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm -82.76 -6.97 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 124.637 1.175 . . . . 0.0 112.135 -175.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.5 mm -62.53 136.14 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 125.776 1.631 . . . . 0.0 110.334 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.4 p -69.06 -43.38 74.73 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.178 -0.951 . . . . 0.0 113.562 -173.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.7 p -159.72 171.15 20.05 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 128.808 2.843 . . . . 0.0 108.851 162.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -76.34 37.74 0.17 Allowed 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -173.586 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.5 p -99.15 -31.54 11.7 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.144 2.177 . . . . 0.0 112.706 167.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 174.41 170.84 38.09 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 115.392 0.917 . . . . 0.0 115.392 -177.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.52 106.92 3.62 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 67.3 -150.09 0.18 Allowed 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 114.577 -1.192 . . . . 0.0 113.496 135.565 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -92.57 1.49 57.23 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.419 -1.426 . . . . 0.0 113.182 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -86.64 -31.31 21.18 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -173.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.86 157.13 24.5 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.814 0.846 . . . . 0.0 112.351 171.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -115.83 179.21 4.04 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.167 1.387 . . . . 0.0 111.409 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.7 m -69.44 16.67 0.05 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.283 2.233 . . . . 0.0 116.111 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -125.75 -3.47 7.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.962 2.105 . . . . 0.0 113.156 166.713 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.01 4.7 3.81 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.491 2.316 . . . . 0.0 113.324 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.0 t -47.75 -48.32 60.51 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 125.06 1.344 . . . . 0.0 113.012 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -85.02 80.35 2.14 Favored 'Trans proline' 0 CA--C 1.55 1.317 0 C-N-CA 123.296 2.664 . . . . 0.0 112.512 167.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -151.99 153.39 33.96 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.04 1.336 . . . . 0.0 112.401 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.24 -31.64 0.1 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.159 2.584 . . . . 0.0 117.202 -175.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 16.2 mm -112.78 55.52 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 126.143 1.777 . . . . 0.0 109.527 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . 0.43 ' HA ' ' C ' ' A' ' 50' ' ' GLU . 5.5 pm0 -140.91 148.29 40.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.525 1.13 . . . . 0.0 112.246 174.143 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 29.7 p -86.98 167.39 14.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.092 0.957 . . . . 0.0 111.718 170.299 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.9 t -58.66 133.7 56.13 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt 55.47 19.15 3.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.819 2.048 . . . . 0.0 114.441 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.4 m -130.14 178.51 6.51 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.473 1.909 . . . . 0.0 112.522 -175.655 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -111.65 -15.91 13.35 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -166.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.43 ' C ' ' HA ' ' A' ' 44' ' ' GLN . 47.4 mt-10 -134.19 167.32 20.89 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.766 2.027 . . . . 0.0 108.996 173.019 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.6 -11.3 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.408 -1.432 . . . . 0.0 113.99 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.93 140.18 3.04 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 127.153 2.311 . . . . 0.0 109.936 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -125.73 -3.96 7.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.763 1.625 . . . . 0.0 112.525 -176.485 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -134.53 141.9 46.84 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 126.546 1.938 . . . . 0.0 108.884 163.9 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.68 47.52 2.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.037 1.735 . . . . 0.0 112.855 178.902 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 m 64.16 -30.52 0.11 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -139.12 -4.26 1.53 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.826 1.651 . . . . 0.0 114.071 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.292 18.1 p 36.74 49.52 1.31 Allowed Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 128.789 2.836 . . . . 0.0 116.914 -172.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -70.37 145.88 54.86 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.649 2.233 . . . . 0.0 112.192 -178.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -81.23 -13.6 58.37 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 166.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -72.82 160.73 31.7 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.504 1.122 . . . . 0.0 111.194 170.205 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 20.9 t-105 -71.77 150.62 44.23 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.334 0.587 . . . . 0.0 112.433 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -108.08 3.85 24.36 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.401 1.481 . . . . 0.0 114.235 -159.278 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -144.77 159.75 42.36 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.076 2.15 . . . . 0.0 110.095 173.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.9 p -93.84 133.11 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.938 0.895 . . . . 0.0 111.164 174.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -72.4 -17.82 61.77 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 77.0 m -87.11 -28.95 22.2 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.311 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 58.1 -36.28 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 127.482 2.313 . . . . 0.0 116.081 -151.19 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 29.3 tp -70.55 -15.68 62.8 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 129.907 3.283 . . . . 0.0 114.12 177.781 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.7 t -107.03 156.77 18.39 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.625 1.17 . . . . 0.0 112.587 -170.529 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -115.52 1.03 13.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.681 1.592 . . . . 0.0 114.418 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.7 t -87.34 147.97 25.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -111.17 2.07 17.6 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.532 2.333 . . . . 0.0 115.115 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -112.75 -8.33 13.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.543 1.937 . . . . 0.0 113.599 -172.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -78.09 165.3 24.16 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -165.284 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.3 t -69.59 145.66 52.36 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.9 -22.71 65.95 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 127.265 2.226 . . . . 0.0 114.965 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -77.25 33.76 0.16 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 125.117 1.367 . . . . 0.0 112.519 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 46.19 47.47 13.26 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.485 2.314 . . . . 0.0 112.815 -165.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 27.6 p 33.75 66.45 1.29 Allowed Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 127.707 2.403 . . . . 0.0 116.204 168.262 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -70.15 -29.21 22.34 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.82 2.346 . . . . 0.0 114.181 -172.256 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 57.8 p -113.12 -0.85 14.56 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.454 1.902 . . . . 0.0 114.714 -170.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.9 tp -61.05 -28.04 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 O-C-N 121.189 -0.944 . . . . 0.0 112.124 -177.243 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 13.3 t90 -78.1 13.96 1.3 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.439 1.496 . . . . 0.0 114.034 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 89.3 mmt-85 -125.34 1.79 7.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.852 2.061 . . . . 0.0 113.214 165.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.53 -9.26 59.27 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.1 p90 -67.73 -16.49 64.16 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 -176.029 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.8 tt -80.17 -11.52 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.865 0 C-N-CA 124.663 1.185 . . . . 0.0 114.104 -176.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -86.24 9.28 18.13 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.67 1.188 . . . . 0.0 114.096 -177.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.3 p -106.69 -8.33 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 -167.495 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -131.83 157.28 44.31 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.167 1.387 . . . . 0.0 113.771 -176.316 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -124.2 -22.88 4.65 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 -163.581 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -143.8 159.54 42.33 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.452 1.501 . . . . 0.0 112.004 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.36 -5.88 6.53 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -174.002 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -138.56 159.67 41.51 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.824 1.25 . . . . 0.0 113.591 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.75 165.08 30.72 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.946 1.699 . . . . 0.0 111.529 175.393 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.58 146.59 42.4 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.243 1.417 . . . . 0.0 112.273 172.614 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -64.5 160.59 38.85 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.262 2.642 . . . . 0.0 114.023 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -134.78 157.16 47.45 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.186 1.794 . . . . 0.0 111.477 173.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.6 m -90.28 -10.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 124.918 1.287 . . . . 0.0 114.301 -177.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.9 tp -73.33 -35.15 2.56 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -61.8 148.69 92.53 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.031 2.487 . . . . 0.0 114.578 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 24.7 p90 -82.04 -20.82 37.53 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 46.9 56.64 6.46 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.444 1.897 . . . . 0.0 115.37 164.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 13.8 t -138.97 43.63 2.06 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 123.913 1.816 . . . . 0.0 112.606 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.9 pt -100.63 -2.92 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 115.052 1.501 . . . . 0.0 115.052 -165.737 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -153.48 151.99 30.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.969 0.908 . . . . 0.0 112.969 -172.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 57.3 m -82.99 8.59 12.29 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.455 1.502 . . . . 0.0 114.822 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 63.42 -26.91 0.07 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 118.132 2.642 . . . . 0.0 118.132 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -133.16 -12.04 2.85 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -176.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 28.4 p -151.26 172.27 16.12 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.348 0.976 . . . . 0.0 112.915 -173.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -62.31 161.29 30.38 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 124.203 0.906 . . . . 0.0 113.695 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.29 172.07 39.58 Favored Glycine 0 CA--C 1.537 1.425 0 CA-C-O 121.677 0.598 . . . . 0.0 112.797 -165.085 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -125.58 -20.84 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -165.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -171.43 22.18 0.08 OUTLIER Glycine 0 CA--C 1.535 1.337 0 N-CA-C 117.538 1.775 . . . . 0.0 117.538 -175.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -66.97 -51.0 60.53 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 120.183 1.991 . . . . 0.0 112.459 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -135.29 30.52 3.25 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.395 2.278 . . . . 0.0 108.716 161.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -16.25 22.99 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 127.18 2.324 . . . . 0.0 115.258 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -63.26 -37.27 86.6 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.459 1.504 . . . . 0.0 113.542 171.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -141.97 -4.16 1.07 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -166.354 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.7 p -72.95 31.68 0.07 Allowed 'General case' 0 CA--C 1.555 1.15 0 O-C-N 120.329 -1.482 . . . . 0.0 114.922 176.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 37.8 tttm -60.65 156.3 17.0 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.313 2.645 . . . . 0.0 111.588 169.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.62 160.73 24.8 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 169.932 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.56 1.544 . . . . 0.0 114.532 -179.332 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.7 tppt? . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 119.473 -0.298 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 56.19 31.19 17.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 126.451 1.901 . . . . 0.0 115.579 172.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -81.16 100.56 9.15 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.144 -0.973 . . . . 0.0 111.525 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.66 -50.54 71.47 Favored Pre-proline 0 CA--C 1.552 1.027 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 175.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.43 -44.35 0.12 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.023 1.815 . . . . 0.0 113.773 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? 61.48 -55.09 0.11 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 128.047 2.539 . . . . 0.0 114.612 -167.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -153.8 159.83 42.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.656 2.782 . . . . 0.0 111.359 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -76.3 -53.17 8.6 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.614 -0.679 . . . . 0.0 109.945 157.682 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -134.84 161.54 34.91 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.632 1.973 . . . . 0.0 110.207 176.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . 0.318 14.6 p 47.02 -159.39 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 126.397 1.879 . . . . 0.0 112.967 -161.461 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -145.43 28.96 1.17 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -163.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -91.29 145.62 24.5 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.287 1.035 . . . . 0.0 112.357 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.19 -28.79 66.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -165.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -81.81 -13.65 79.26 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 116.169 1.227 . . . . 0.0 116.169 -164.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -142.65 81.85 1.75 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.642 1.221 . . . . 0.0 113.437 -169.771 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.12 -178.33 0.16 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.224 1.41 . . . . 0.0 113.211 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.63 -68.81 0.11 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 126.495 1.918 . . . . 0.0 114.81 -166.802 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -68.9 -20.63 64.25 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -91.7 -24.53 19.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.746 1.618 . . . . 0.0 113.103 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.7 t -57.06 -43.99 99.58 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.657 1.583 . . . . 0.0 114.83 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -92.55 -5.79 3.24 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.554 2.169 . . . . 0.0 115.454 -174.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -131.8 155.72 47.27 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.608 1.095 . . . . 0.0 113.821 -168.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.2 pp -92.04 -14.68 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.37 1.068 . . . . 0.0 113.406 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 12.4 pt -83.98 142.34 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.041 1.336 . . . . 0.0 112.774 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.37 101.99 12.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.215 1.006 . . . . 0.0 110.2 171.716 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m 44.39 49.72 8.07 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.232 1.813 . . . . 0.0 115.681 170.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.9 t80 57.85 32.72 22.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.976 1.71 . . . . 0.0 115.255 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 52.8 t -66.61 -19.73 65.84 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.191 1.396 . . . . 0.0 112.791 170.236 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -166.58 -171.09 32.3 Favored Glycine 0 CA--C 1.531 1.09 0 O-C-N 120.695 -1.253 . . . . 0.0 114.688 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -88.41 127.92 35.51 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.419 1.087 . . . . 0.0 111.98 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -58.15 -22.54 51.62 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -83.78 -11.47 57.04 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -141.18 -1.32 1.37 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -169.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -83.97 142.8 30.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.82 -1.175 . . . . 0.0 113.345 -175.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -156.45 159.48 38.7 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.074 1.349 . . . . 0.0 111.116 175.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.1 m -60.47 -29.96 69.38 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -169.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.93 4.47 34.76 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 173.2 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -108.44 -19.05 13.59 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.886 1.674 . . . . 0.0 112.941 176.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 m -14.35 -65.55 0.03 OUTLIER Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 130.198 3.399 . . . . 0.0 117.191 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -67.63 -17.44 48.05 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.927 2.418 . . . . 0.0 115.802 -171.516 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -100.53 53.43 0.87 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.468 1.507 . . . . 0.0 112.143 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -134.42 -107.67 0.23 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.954 1.302 . . . . 0.0 112.253 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.262 33.4 mt -96.54 22.5 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 125.37 1.468 . . . . 0.0 110.736 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -133.5 153.79 51.35 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.318 -1.489 . . . . 0.0 112.031 165.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 19.7 p -102.17 169.32 8.8 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 112.125 174.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.3 m -59.63 143.33 50.79 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt 58.63 11.02 1.6 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.351 1.86 . . . . 0.0 114.716 -173.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 73.0 m -138.79 174.72 10.23 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.915 1.686 . . . . 0.0 112.843 -170.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -114.5 5.04 15.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.413 1.485 . . . . 0.0 114.088 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -153.2 150.51 29.09 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.472 1.509 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.8 m -77.75 13.64 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.666 -1.271 . . . . 0.0 111.858 168.539 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.72 -136.29 0.13 Allowed Glycine 0 CA--C 1.531 1.062 0 C-N-CA 127.833 2.635 . . . . 0.0 114.359 -172.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 57.0 -147.38 0.53 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.095 0.958 . . . . 0.0 111.532 -173.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.9 p90 -93.37 176.49 6.37 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.805 1.242 . . . . 0.0 113.764 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -23.36 134.13 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 130.618 3.567 . . . . 0.0 116.133 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.1 m 55.59 47.52 20.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.657 1.583 . . . . 0.0 113.918 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.255 14.4 pt20 50.39 43.86 26.79 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.725 2.01 . . . . 0.0 114.593 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 59.32 170.19 0.07 OUTLIER Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 127.527 2.331 . . . . 0.0 115.267 -171.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -58.5 123.91 14.65 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.048 2.499 . . . . 0.0 113.865 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -101.52 24.07 10.22 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.206 1.802 . . . . 0.0 111.781 171.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.8 mtpt -136.1 160.33 38.98 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 128.117 2.567 . . . . 0.0 110.842 -176.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.5 m-90 -67.81 142.71 56.09 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.083 0.953 . . . . 0.0 112.168 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.7 tptt -83.85 131.9 34.84 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.764 0.826 . . . . 0.0 112.983 -171.631 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -123.75 142.93 50.63 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 127.142 2.177 . . . . 0.0 109.431 163.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 p -83.23 138.01 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.521 0.728 . . . . 0.0 112.67 -172.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.1 pm0 -108.83 -2.41 18.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.476 1.91 . . . . 0.0 114.372 -173.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 57.1 m -77.31 -5.17 48.51 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -163.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.284 10.9 t 59.34 -39.47 0.07 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 129.034 2.934 . . . . 0.0 118.211 -174.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -81.35 -1.96 47.39 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.575 -1.328 . . . . 0.0 113.558 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.3 m -107.84 177.84 4.7 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.719 1.608 . . . . 0.0 111.994 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.9 tptt 68.5 138.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.867 2.067 . . . . 0.0 111.32 -156.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 t 54.95 -171.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.34 -143.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 62.7 mttm 60.91 -8.94 0.07 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 129.047 2.939 . . . . 0.0 116.301 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 83.0 tttt 57.81 111.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 128.302 2.641 . . . . 0.0 112.508 -161.736 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -76.45 148.73 37.05 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.6 p -133.59 113.95 12.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.916 1.686 . . . . 0.0 110.891 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -66.9 140.05 57.76 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.116 -0.99 . . . . 0.0 111.419 -175.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 60.22 10.18 2.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 126.903 2.081 . . . . 0.0 116.115 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtm180 -130.43 -50.18 1.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.289 1.436 . . . . 0.0 113.14 -175.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 85.0 m 60.29 144.15 0.06 OUTLIER Pre-proline 0 CA--C 1.554 1.125 0 C-N-CA 128.538 2.735 . . . . 0.0 114.468 -170.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.41 -26.46 17.09 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.923 2.415 . . . . 0.0 114.055 -174.055 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.4 m -85.9 -0.5 55.56 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 115.52 1.674 . . . . 0.0 115.52 -168.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.9 pt -133.05 165.63 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 125.564 1.546 . . . . 0.0 112.005 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 9.1 m-90 -121.39 157.62 30.09 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.971 1.308 . . . . 0.0 112.933 -170.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 86.2 mtt-85 -135.6 159.02 42.92 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.473 1.909 . . . . 0.0 112.479 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . 58.47 6.03 0.52 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 118.972 2.953 . . . . 0.0 118.972 160.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 54.0 p90 -71.88 134.28 45.95 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.806 1.185 . . . . 0.0 112.429 -178.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.8 pt -132.13 -1.6 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 125.496 1.519 . . . . 0.0 113.45 177.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 tt -87.07 111.02 20.49 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.804 1.242 . . . . 0.0 108.979 176.048 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.7 m -124.31 5.91 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -170.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -70.35 -21.34 62.9 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 121.283 -0.885 . . . . 0.0 113.315 176.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -117.5 143.77 45.73 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.907 1.683 . . . . 0.0 111.038 171.023 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -142.9 154.79 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.276 1.43 . . . . 0.0 111.642 -177.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -136.92 143.69 43.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.258 1.823 . . . . 0.0 111.164 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -132.85 157.9 43.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.881 1.672 . . . . 0.0 112.327 176.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.76 -177.75 2.9 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.196 0.999 . . . . 0.0 112.145 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -57.29 150.83 40.48 Favored Pre-proline 0 N--CA 1.478 0.936 0 C-N-CA 124.011 0.924 . . . . 0.0 111.192 171.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 149.37 88.21 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.355 2.703 . . . . 0.0 113.348 -173.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -69.79 160.62 31.39 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -170.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.2 t -121.72 151.88 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.023 2.129 . . . . 0.0 108.506 169.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 99.1 mt -57.28 142.1 76.27 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 123.803 0.841 . . . . 0.0 112.607 -174.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -77.27 -15.16 16.16 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.302 2.668 . . . . 0.0 113.606 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -109.31 150.66 27.66 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.22 1.408 . . . . 0.0 112.019 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -86.53 155.65 20.4 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.219 1.008 . . . . 0.0 113.548 -173.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 97.2 m -90.88 143.61 26.55 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.813 1.245 . . . . 0.0 111.791 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 89.9 mt -76.28 137.85 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 125.203 1.401 . . . . 0.0 110.737 178.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 46.8 p90 -110.87 146.94 35.61 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.409 1.484 . . . . 0.0 112.635 -178.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.8 t -128.77 11.45 6.15 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.263 1.425 . . . . 0.0 114.056 -173.459 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -63.56 -16.11 59.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 -166.259 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -63.91 -20.12 65.62 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.181 1.392 . . . . 0.0 114.545 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.1 p -107.63 8.13 28.95 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.638 1.575 . . . . 0.0 113.819 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.51 131.83 1.94 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 126.017 1.77 . . . . 0.0 112.284 -166.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.85 112.99 0.26 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.25 1.405 . . . . 0.0 113.232 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -69.84 -9.3 54.26 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -174.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 179.96 124.08 0.87 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.801 1.191 . . . . 0.0 111.638 170.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -144.16 -46.15 0.26 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.614 0.766 . . . . 0.0 113.045 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -130.3 37.31 3.89 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.23 1.812 . . . . 0.0 109.266 165.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.44 -17.9 27.55 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 126.815 2.15 . . . . 0.0 115.077 -170.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.62 -34.56 67.38 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.497 1.519 . . . . 0.0 113.455 171.096 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -129.07 -25.26 2.78 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.722 1.609 . . . . 0.0 113.675 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 7.8 t -75.45 -11.15 59.98 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.619 1.168 . . . . 0.0 113.699 -177.404 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -65.25 148.24 52.03 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.798 1.239 . . . . 0.0 112.874 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.1 mp0 -63.75 155.48 30.06 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.914 1.286 . . . . 0.0 113.107 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 C--O 1.254 1.326 0 C-N-CA 126.05 1.74 . . . . 0.0 111.715 176.904 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 86.0 tttt . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 119.548 -0.263 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -115.3 151.12 35.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.391 1.476 . . . . 0.0 111.16 174.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.61 107.74 19.07 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -168.411 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.36 -51.5 13.13 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 123.957 0.903 . . . . 0.0 112.783 165.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.64 -29.95 2.65 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.811 2.34 . . . . 0.0 114.328 178.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 58.76 -63.78 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.438 2.695 . . . . 0.0 115.962 -175.335 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -158.11 164.34 36.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 128.07 2.548 . . . . 0.0 110.302 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -68.28 -31.42 70.86 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.997 -1.064 . . . . 0.0 113.171 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.79 -51.02 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.653 1.581 . . . . 0.0 112.466 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 p -91.11 63.07 4.99 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.64 1.576 . . . . 0.0 113.387 -172.16 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.6 m -35.92 89.46 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.665 3.586 . . . . 0.0 117.387 -172.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -137.67 143.09 41.17 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.998 2.119 . . . . 0.0 108.68 164.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -74.39 158.25 34.24 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -169.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.25 -23.54 23.87 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 125.567 1.556 . . . . 0.0 115.145 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.264 13.9 p-80 -123.9 78.16 1.6 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 123.235 1.493 . . . . 0.0 111.756 173.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.63 -179.54 0.38 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.613 1.965 . . . . 0.0 113.472 174.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.47 -66.55 0.19 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.967 2.107 . . . . 0.0 114.512 -174.073 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -74.76 -16.49 60.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -94.78 -14.14 24.97 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.374 1.47 . . . . 0.0 113.203 -177.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -64.0 143.54 98.21 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 124.409 1.084 . . . . 0.0 111.607 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -75.28 173.77 13.94 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.862 2.375 . . . . 0.0 115.591 -164.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -63.89 152.66 39.17 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.082 0.953 . . . . 0.0 113.092 175.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.7 tt -71.36 -36.98 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.025 1.33 . . . . 0.0 114.208 -174.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.6 mt 56.04 -74.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 127.642 2.377 . . . . 0.0 112.708 -172.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 38.9 t -156.03 78.71 0.97 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.28 2.632 . . . . 0.0 106.955 172.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m 49.75 51.51 16.38 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 8.8 t80 61.51 42.94 10.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.065 2.146 . . . . 0.0 113.908 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -102.54 172.63 6.75 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.122 1.369 . . . . 0.0 112.374 169.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.93 -171.64 38.33 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.829 1.491 . . . . 0.0 116.829 158.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -123.86 5.82 8.72 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.585 1.554 . . . . 0.0 112.684 174.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.303 5.0 t 53.88 154.71 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.716 2.006 . . . . 0.0 115.133 -150.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.1 t70 59.21 -52.58 0.06 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 129.984 3.314 . . . . 0.0 115.085 -168.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -94.98 67.1 3.08 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.231 2.212 . . . . 0.0 111.021 176.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -147.85 138.66 23.25 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.739 1.615 . . . . 0.0 110.646 177.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -150.75 157.42 42.92 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.928 1.291 . . . . 0.0 110.394 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 72.2 p -60.18 -22.04 62.45 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.455 1.902 . . . . 0.0 115.031 -175.403 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -72.6 -25.93 61.51 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.932 1.293 . . . . 0.0 112.724 173.299 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -112.95 -34.15 5.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.959 1.303 . . . . 0.0 114.435 -169.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.335 64.6 m 36.07 -101.69 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.163 0 C-N-CA 128.354 2.662 . . . . 0.0 116.485 172.856 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -76.48 -17.33 16.47 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.14 1.893 . . . . 0.0 115.124 -165.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.44 -1.83 14.54 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -162.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -20.81 53.55 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.421 1.488 . . . . 0.0 114.659 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.67 64.01 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.476 1.51 . . . . 0.0 109.199 -169.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -170.11 163.72 9.19 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.867 2.067 . . . . 0.0 111.041 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 81.3 m -131.5 173.41 11.13 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.644 1.577 . . . . 0.0 110.282 168.359 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -78.95 -42.52 26.66 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.009 1.724 . . . . 0.0 114.054 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.44 -27.78 22.51 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.876 1.27 . . . . 0.0 112.493 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 6.6 p -129.59 124.4 33.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.166 1.386 . . . . 0.0 110.995 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -84.39 149.69 25.84 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.226 1.41 . . . . 0.0 114.107 -168.264 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 62.32 9.8 3.5 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.4 m -134.82 137.29 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.851 1.26 . . . . 0.0 113.437 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.71 160.64 26.63 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.82 1.2 . . . . 0.0 112.474 170.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -75.08 81.05 2.25 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -174.444 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -136.31 160.3 39.14 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 127.48 2.312 . . . . 0.0 110.872 170.392 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 146.21 36.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.118 0.485 . . . . 0.0 110.256 169.129 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 21.2 m 61.67 -2.5 0.26 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -171.233 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -102.25 -53.51 2.9 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.383 1.073 . . . . 0.0 111.184 170.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.4 m -105.97 10.0 0.07 OUTLIER Pre-proline 0 CA--C 1.558 1.278 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -52.92 -22.56 18.6 Favored 'Trans proline' 0 CA--C 1.545 1.072 0 CA-C-N 124.66 2.7 . . . . 0.0 116.673 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -79.45 -3.99 49.1 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -46.73 -42.93 17.51 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 126.718 2.007 . . . . 0.0 114.448 -172.349 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -74.92 -11.43 60.12 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 116.58 2.067 . . . . 0.0 116.58 -162.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -87.53 -11.26 49.33 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 -173.451 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -110.5 112.13 23.83 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.363 1.465 . . . . 0.0 110.842 -178.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.9 t -104.41 128.48 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.501 1.52 . . . . 0.0 109.821 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -96.36 4.88 51.94 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.016 1.726 . . . . 0.0 113.13 -171.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 85.3 m -85.18 -16.21 41.1 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.256 7.1 t 56.8 -46.66 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 129.35 3.06 . . . . 0.0 117.809 -168.339 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -85.07 -22.62 28.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.455 1.502 . . . . 0.0 113.186 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 58.1 m -82.97 131.09 35.2 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.801 0.841 . . . . 0.0 110.799 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -115.19 2.01 13.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 83.8 p -78.94 169.68 17.84 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.441 1.496 . . . . 0.0 113.43 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -95.71 8.96 41.98 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.497 1.519 . . . . 0.0 114.425 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.05 -148.32 0.38 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.077 2.151 . . . . 0.0 109.783 177.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . 0.409 ' CG ' ' H ' ' A' ' 76' ' ' SER . 44.8 t60 58.01 -123.39 1.49 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.025 1.33 . . . . 0.0 113.292 172.503 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' SER . . . . . 0.409 ' H ' ' CG ' ' A' ' 75' ' ' HIS . 1.3 t 59.32 -47.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.95 2.5 . . . . 0.0 115.936 -159.745 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.4 tptp 51.65 40.33 27.05 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.978 2.511 . . . . 0.0 113.86 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 57.08 61.31 2.62 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.958 1.303 . . . . 0.0 113.222 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 61.0 56.08 2.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.192 2.197 . . . . 0.0 114.593 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t 51.9 54.65 14.56 Favored Pre-proline 0 CA--C 1.556 1.193 0 C-N-CA 126.529 1.932 . . . . 0.0 115.816 164.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -71.07 167.31 26.47 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.604 2.869 . . . . 0.0 112.377 176.681 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.7 m -84.22 119.33 24.91 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.8 0.84 . . . . 0.0 111.26 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.6 tt -141.91 139.48 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 128.091 2.556 . . . . 0.0 109.944 -6.226 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -89.92 137.54 32.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.636 0.774 . . . . 0.0 111.936 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -148.76 140.94 23.99 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.851 1.66 . . . . 0.0 111.018 178.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -135.24 158.25 44.83 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.723 1.609 . . . . 0.0 110.401 170.441 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -138.0 147.89 44.64 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.227 1.011 . . . . 0.0 112.798 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 38.3 pt -136.2 144.6 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 126.034 1.733 . . . . 0.0 111.45 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.7 tp -152.67 141.4 20.97 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.583 1.553 . . . . 0.0 110.321 176.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 26.0 t -134.43 141.65 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.362 1.465 . . . . 0.0 110.159 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -70.26 143.13 52.22 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.157 0.983 . . . . 0.0 112.761 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -75.82 -43.78 44.3 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.345 1.058 . . . . 0.0 113.819 -175.285 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.7 t30 61.09 6.66 1.32 Allowed 'General case' 0 CA--C 1.56 1.356 0 N-CA-C 118.008 2.596 . . . . 0.0 118.008 175.436 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -131.44 -23.22 2.39 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -176.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 85.7 mttt 66.12 149.53 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 130.041 3.336 . . . . 0.0 115.634 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -88.82 156.65 18.82 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.413 1.085 . . . . 0.0 113.11 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -150.98 152.67 31.98 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.487 1.915 . . . . 0.0 111.83 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.87 -15.06 12.14 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.35 2.7 . . . . 0.0 114.358 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt 60.53 -5.52 0.1 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.093 2.557 . . . . 0.0 116.688 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 20.2 m -133.72 145.63 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 127.045 2.138 . . . . 0.0 109.86 166.422 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -147.6 99.78 3.81 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 123.815 0.846 . . . . 0.0 112.233 -173.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -65.74 148.06 86.34 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.495 2.797 . . . . 0.0 112.295 167.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -136.59 -15.12 1.63 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -129.88 139.87 51.08 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.768 1.627 . . . . 0.0 109.39 168.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 p -126.33 -5.17 6.63 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.378 1.471 . . . . 0.0 114.285 -165.557 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 19.5 tt -140.14 142.79 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.648 1.579 . . . . 0.0 110.783 178.866 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -123.51 115.58 21.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.161 1.384 . . . . 0.0 110.831 -166.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 25.1 p -96.44 67.41 2.47 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -166.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -40.26 -37.16 0.61 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 127.984 2.514 . . . . 0.0 116.31 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -92.81 -12.5 31.01 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -166.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 12.1 p -131.28 179.33 6.09 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.331 1.052 . . . . 0.0 113.245 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -58.84 154.22 28.21 Favored Glycine 0 CA--C 1.538 1.523 0 C-N-CA 124.155 0.883 . . . . 0.0 114.054 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.57 -36.15 1.82 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 125.096 1.332 . . . . 0.0 114.701 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt 45.88 48.56 12.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.571 2.348 . . . . 0.0 113.69 171.396 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 174.0 17.5 0.02 OUTLIER Glycine 0 CA--C 1.536 1.385 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 -174.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -141.13 144.31 34.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.54 1.67 . . . . 0.0 113.106 -176.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 35.08 40.55 0.06 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 128.202 2.601 . . . . 0.0 116.571 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.23 -19.9 41.23 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 116.225 1.25 . . . . 0.0 116.225 -165.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -78.63 -44.18 24.5 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.097 1.359 . . . . 0.0 113.438 173.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -103.43 -20.75 13.95 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.898 1.679 . . . . 0.0 113.883 -165.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 15.9 p -74.38 -1.12 19.56 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.742 1.217 . . . . 0.0 114.243 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -68.45 155.07 40.6 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.451 1.5 . . . . 0.0 111.79 174.704 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -107.16 151.06 25.9 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.354 1.062 . . . . 0.0 112.4 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.389 1.476 . . . . 0.0 112.362 176.166 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 N--CA 1.486 1.336 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -103.04 -23.58 13.68 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.025 0.93 . . . . 0.0 113.466 -170.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.01 45.22 0.99 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.98 1.312 . . . . 0.0 112.993 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.8 -47.24 62.76 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.436 1.094 . . . . 0.0 113.553 164.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -77.88 -31.44 3.13 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.667 2.245 . . . . 0.0 114.033 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 59.83 -65.99 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 128.278 2.631 . . . . 0.0 114.488 -169.029 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -160.68 170.15 21.39 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 128.078 2.551 . . . . 0.0 110.746 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -73.82 -31.98 63.5 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.808 -1.183 . . . . 0.0 114.15 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -157.58 -58.72 0.08 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.768 1.227 . . . . 0.0 112.201 -177.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.1 p -77.3 130.7 37.53 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.468 0.707 . . . . 0.0 111.657 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.4 m -81.15 42.37 0.65 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.632 1.716 . . . . 0.0 115.632 -165.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -95.22 150.89 19.73 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.954 1.702 . . . . 0.0 111.45 176.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 ptm85 -76.01 171.56 14.24 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 113.871 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.8 -78.72 1.98 Allowed Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.839 1.209 . . . . 0.0 112.692 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -79.93 85.9 5.51 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.592 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -54.69 176.71 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.047 1.739 . . . . 0.0 113.669 168.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.58 -66.19 0.21 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.945 2.098 . . . . 0.0 114.444 -174.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -78.07 -5.46 51.56 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -89.94 -37.4 14.4 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.127 1.371 . . . . 0.0 111.939 175.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.8 t -56.13 -47.58 98.55 Favored Pre-proline 0 CA--C 1.549 0.914 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.89 5.41 3.47 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.294 1.996 . . . . 0.0 115.473 -164.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -60.41 -26.78 66.95 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.851 -1.156 . . . . 0.0 113.556 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.6 pp -115.32 13.2 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -175.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.88 148.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 125.204 1.402 . . . . 0.0 110.757 172.55 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.8 m -68.54 158.58 33.59 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.64 -0.662 . . . . 0.0 112.033 163.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -67.19 105.29 1.67 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.26 1.024 . . . . 0.0 112.492 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.5 t80 61.15 5.2 1.0 Allowed 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 117.999 2.592 . . . . 0.0 117.999 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 20.3 p -106.1 1.14 26.06 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -150.41 154.35 25.59 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.43 1.014 . . . . 0.0 114.937 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -113.44 20.44 16.07 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.887 1.675 . . . . 0.0 113.896 -174.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.277 2.8 t 60.44 -29.46 0.05 Allowed 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 129.608 3.163 . . . . 0.0 118.036 174.327 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.22 -24.81 27.69 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.506 1.522 . . . . 0.0 113.796 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -132.39 5.67 4.08 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.954 1.302 . . . . 0.0 114.049 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -89.86 148.5 23.13 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.139 -0.975 . . . . 0.0 113.383 -171.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -147.46 132.51 18.24 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.117 0.967 . . . . 0.0 111.725 170.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.9 m -58.7 -26.04 63.49 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.161 1.784 . . . . 0.0 114.677 -173.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -70.7 -21.32 62.58 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.068 1.347 . . . . 0.0 113.744 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -125.14 -19.8 5.05 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.809 1.244 . . . . 0.0 114.313 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.383 63.3 m 47.77 -106.92 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 127.822 2.449 . . . . 0.0 115.602 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -62.33 102.41 0.27 Allowed 'Trans proline' 0 C--N 1.356 0.962 0 CA-C-N 123.503 2.287 . . . . 0.0 113.771 -164.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -135.67 -15.37 1.84 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.662 1.985 . . . . 0.0 113.181 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -133.52 177.52 7.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.891 1.676 . . . . 0.0 111.409 -178.077 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 76.6 mt 65.1 -76.25 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 127.219 2.208 . . . . 0.0 111.687 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -59.54 162.82 4.63 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.643 0.777 . . . . 0.0 112.519 162.774 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 7.8 t -109.08 123.9 49.9 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.332 1.053 . . . . 0.0 109.284 163.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m 41.91 37.55 0.83 Allowed 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 165.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt 55.08 26.17 7.88 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.95 2.5 . . . . 0.0 115.221 -175.452 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.7 p -81.32 -61.73 1.86 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.154 0.888 . . . . 0.0 111.687 170.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.417 ' C ' ' H ' ' A' ' 51' ' ' VAL . 15.5 m-20 -153.68 168.79 25.08 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.301 1.84 . . . . 0.0 111.329 172.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -56.61 4.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 130.89 3.676 . . . . 0.0 117.337 -175.554 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.417 ' H ' ' C ' ' A' ' 49' ' ' ASP . 1.5 m -164.82 -30.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.859 1 C-N-CA 132.04 4.136 . . . . 0.0 108.807 179.457 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.49 -157.95 19.37 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 127.181 2.324 . . . . 0.0 113.526 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -75.44 64.24 1.56 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.781 2.033 . . . . 0.0 112.609 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.6 t80 49.15 -128.53 2.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.96 2.904 . . . . 0.0 112.851 178.944 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 52.47 43.63 30.8 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.854 1.661 . . . . 0.0 113.06 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.5 m 52.03 63.44 2.24 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.916 1.686 . . . . 0.0 113.836 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 58.5 41.38 22.7 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.796 1.639 . . . . 0.0 113.172 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 79.2 m 63.82 151.89 0.11 Allowed Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 129.202 3.001 . . . . 0.0 116.533 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -71.22 156.89 58.5 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 123.159 2.573 . . . . 0.0 112.83 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -76.01 -13.55 60.23 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -126.08 126.77 44.74 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.62 1.968 . . . . 0.0 109.146 171.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 50.2 t-105 -152.68 170.15 20.96 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -174.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.41 150.2 48.42 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.873 2.069 . . . . 0.0 112.126 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -63.81 165.9 7.95 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.652 1.581 . . . . 0.0 111.793 170.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m -55.25 157.44 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.677 -0.639 . . . . 0.0 111.539 164.405 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.98 -21.43 66.49 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 24.9 m -87.18 134.59 33.51 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.155 0.982 . . . . 0.0 111.697 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.2 t -63.31 -31.06 72.11 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.444 HD22 ' H ' ' A' ' 69' ' ' LEU . 2.6 pt? -104.55 18.78 21.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.889 1.676 . . . . 0.0 115.24 -172.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 61.9 m -127.98 158.96 36.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.132 1.373 . . . . 0.0 111.25 176.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -151.23 112.82 4.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.436 1.094 . . . . 0.0 110.899 169.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m 57.24 12.22 1.3 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 118.028 2.603 . . . . 0.0 118.028 168.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -141.89 152.59 43.72 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.496 1.918 . . . . 0.0 110.754 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -84.29 157.56 21.5 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.244 1.018 . . . . 0.0 112.2 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 33.8 p80 -135.81 178.78 6.78 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.095 2.158 . . . . 0.0 111.028 -172.177 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.2 t -114.7 166.33 11.86 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.779 1.232 . . . . 0.0 112.841 173.451 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -61.66 -17.88 57.25 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 127.732 2.413 . . . . 0.0 114.159 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -67.99 -25.77 65.58 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 169.047 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -92.72 -57.83 2.54 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.762 1.625 . . . . 0.0 110.873 172.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 24.2 p -160.41 154.41 19.48 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.986 1.315 . . . . 0.0 112.136 169.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -59.25 150.87 71.48 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.55 2.833 . . . . 0.0 116.175 -165.409 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 t -151.01 159.82 44.32 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.578 1.551 . . . . 0.0 110.788 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.9 pp -69.44 162.91 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 123.941 0.896 . . . . 0.0 113.368 -178.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 35.1 p90 -133.78 161.01 35.87 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.487 1.515 . . . . 0.0 112.623 -173.709 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 39.3 mmm-85 -132.24 9.61 4.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 126.122 1.769 . . . . 0.0 114.365 175.544 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . 58.72 14.65 3.29 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -174.666 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -86.0 14.32 6.34 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.733 1.613 . . . . 0.0 113.999 -173.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 47.6 mt 64.17 105.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 128.553 2.741 . . . . 0.0 113.353 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.79 158.0 22.98 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.861 1.264 . . . . 0.0 111.71 171.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 25.1 m -93.68 150.18 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.649 1.18 . . . . 0.0 112.558 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -119.29 -1.87 10.73 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.275 1.43 . . . . 0.0 113.188 175.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -83.35 141.9 31.44 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.554 1.142 . . . . 0.0 112.217 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -85.76 -14.97 43.61 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.45 55.53 3.22 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.046 1.338 . . . . 0.0 112.467 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -66.47 155.25 38.08 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.693 1.597 . . . . 0.0 113.441 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.05 164.27 30.49 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.634 1.574 . . . . 0.0 111.739 178.317 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -67.57 158.48 82.47 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 124.36 1.064 . . . . 0.0 112.199 178.664 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -64.77 -16.03 53.27 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.367 2.712 . . . . 0.0 116.659 -174.529 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.302 21.8 ptmt 52.72 -1.81 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 129.479 3.112 . . . . 0.0 118.679 179.533 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 70.0 t -83.32 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.979 1.312 . . . . 0.0 109.709 168.804 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . 0.45 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 3.2 tm? -124.06 -46.83 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.37 1.468 . . . . 0.0 114.364 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . 0.45 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 85.6 Cg_endo -73.45 158.77 47.58 Favored 'Trans proline' 0 C--N 1.355 0.906 0 CA-C-N 122.097 1.785 . . . . 0.0 113.347 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -130.06 163.22 27.01 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.671 1.588 . . . . 0.0 112.758 -175.422 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -125.95 21.17 7.57 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.889 1.676 . . . . 0.0 113.4 176.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 23.2 p -86.83 -5.67 59.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.408 1.883 . . . . 0.0 114.367 -171.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.0 tt -78.82 132.65 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.142 0.977 . . . . 0.0 111.152 174.277 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -141.36 169.49 17.51 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.196 1.398 . . . . 0.0 112.631 -176.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 17.6 t -71.92 158.29 36.3 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.35 1.06 . . . . 0.0 113.098 176.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -136.52 24.32 3.17 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.802 1.641 . . . . 0.0 112.488 172.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -139.3 167.61 21.69 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.22 1.808 . . . . 0.0 111.725 -171.485 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.285 18.6 p 47.25 23.65 0.35 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.999 2.52 . . . . 0.0 117.341 173.409 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.54 -31.64 2.01 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.707 1.622 . . . . 0.0 114.283 178.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 138.24 -161.33 25.61 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.977 1.275 . . . . 0.0 114.719 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -77.39 -176.74 4.32 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.222 1.809 . . . . 0.0 114.377 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.14 -53.53 4.87 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.153 1.358 . . . . 0.0 114.742 173.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -77.69 142.28 38.88 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 40.79 22.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 129.767 3.227 . . . . 0.0 117.877 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.25 -23.31 52.76 Favored Glycine 0 CA--C 1.536 1.353 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 -161.691 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -61.18 -44.6 97.05 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.054 1.342 . . . . 0.0 112.963 173.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -105.76 -30.73 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.259 1.824 . . . . 0.0 113.031 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 53.6 t -70.09 116.18 10.16 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.728 1.211 . . . . 0.0 110.445 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.39 158.88 43.75 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 127.399 2.28 . . . . 0.0 110.486 -176.187 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -76.0 130.14 37.96 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.706 0.402 . . . . 0.0 111.533 176.002 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . 0.403 ' HA ' ' HE2' ' A' ' 124' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.328 0 C-N-CA 126.259 1.823 . . . . 0.0 111.766 -177.617 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.9 pttt . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.492 0.186 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -112.78 -6.72 13.83 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -161.927 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.16 149.39 28.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.224 1.01 . . . . 0.0 113.202 -178.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.29 -55.63 0.88 Allowed Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.304 1.041 . . . . 0.0 112.421 162.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.16 -37.03 3.68 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.949 2.432 . . . . 0.0 113.927 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.336 0.0 OUTLIER 53.12 -31.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 131.51 3.924 . . . . 0.0 118.271 -171.235 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.58 -179.79 8.53 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.488 1.915 . . . . 0.0 111.522 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -101.47 146.41 27.67 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.692 -0.63 . . . . 0.0 109.33 144.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.4 t30 59.45 -69.88 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 165.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.1 p -86.13 -15.35 41.38 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.611 1.565 . . . . 0.0 115.167 -170.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 m 55.92 30.73 16.53 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 160.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -142.62 19.79 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 175.312 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -144.59 143.08 30.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.166 1.386 . . . . 0.0 111.202 -177.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.98 -12.98 61.02 Favored Glycine 0 N--CA 1.475 1.244 0 N-CA-C 116.826 1.49 . . . . 0.0 116.826 -162.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -68.97 93.38 0.56 Allowed 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.576 1.188 . . . . 0.0 112.37 171.163 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -53.49 175.62 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.987 1.715 . . . . 0.0 113.595 172.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -62.01 0.94 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.943 1.297 . . . . 0.0 114.061 -165.463 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.48 -9.18 59.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -84.56 -31.55 24.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.075 1.35 . . . . 0.0 111.974 173.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.4 t -64.64 136.81 96.92 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.843 1.657 . . . . 0.0 111.073 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.69 158.46 57.11 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.797 2.998 . . . . 0.0 114.713 -170.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -132.58 170.27 15.43 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.754 2.021 . . . . 0.0 109.703 169.38 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.9 pp -62.13 150.56 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.0 mt -125.14 137.15 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 111.027 -167.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 32.8 t -61.35 109.37 1.13 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.17 1.388 . . . . 0.0 111.708 170.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.6 m 47.38 16.97 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 127.722 2.409 . . . . 0.0 116.724 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 48.45 34.18 4.58 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.98 1.312 . . . . 0.0 113.347 -168.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.7 p -96.93 -22.77 16.67 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -164.61 157.69 30.16 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.851 1.215 . . . . 0.0 112.151 177.553 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.56 121.89 14.97 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.318 1.059 . . . . 0.0 112.631 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.5 t -59.13 -26.89 65.11 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -75.27 -22.16 57.99 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -141.41 -18.25 0.79 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 -168.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 149.92 45.74 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.077 1.308 . . . . 0.0 112.85 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -147.08 167.74 23.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.589 1.556 . . . . 0.0 110.029 176.148 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.7 t -38.81 -45.64 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.986 2.115 . . . . 0.0 115.899 -172.62 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -73.59 -15.89 61.26 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -127.38 0.55 6.32 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.104 1.762 . . . . 0.0 113.539 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.8 t -40.3 -50.99 6.41 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 128.005 2.522 . . . . 0.0 115.81 -172.572 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -79.33 -2.83 12.61 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 123.192 2.595 . . . . 0.0 116.483 -176.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -128.83 11.29 6.1 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -162.008 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.27 24.14 4.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.2 mt -128.77 62.96 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 126.578 1.951 . . . . 0.0 108.742 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -145.4 150.26 36.22 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.265 -1.522 . . . . 0.0 113.99 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -76.25 168.0 20.84 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.258 1.023 . . . . 0.0 112.042 174.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 21.2 m -85.1 -18.95 32.69 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.2 tppt? -127.95 -9.01 5.46 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.043 1.337 . . . . 0.0 114.37 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 p -145.55 167.33 23.28 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.033 1.333 . . . . 0.0 111.776 174.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -76.89 132.19 38.98 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.43 -0.794 . . . . 0.0 112.566 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.63 141.85 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.836 2.454 . . . . 0.0 116.186 179.481 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.2 m -80.33 -21.41 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 O-C-N 120.451 -1.405 . . . . 0.0 110.797 157.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.92 -6.48 24.85 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.949 1.738 . . . . 0.0 116.399 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . 0.263 0.7 OUTLIER -87.64 -132.49 0.07 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.746 1.273 . . . . 0.0 113.122 172.453 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -61.6 126.42 27.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -157.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 45.85 30.84 0.93 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.647 2.379 . . . . 0.0 113.761 -175.086 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.1 p 49.8 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.805 3.642 . . . . 0.0 119.061 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -147.34 8.55 0.92 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.696 1.998 . . . . 0.0 112.982 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.8 m 58.92 27.74 0.05 OUTLIER Pre-proline 0 CA--C 1.563 1.48 0 N-CA-C 117.306 2.335 . . . . 0.0 117.306 -170.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -68.1 121.48 8.49 Favored 'Trans proline' 0 C--N 1.358 1.056 0 CA-C-N 122.922 2.079 . . . . 0.0 112.706 -178.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.0 m80 58.71 167.4 0.05 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.929 2.092 . . . . 0.0 115.122 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -71.55 -43.14 66.91 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.925 -1.109 . . . . 0.0 111.837 174.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -155.53 135.86 13.15 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.17 1.788 . . . . 0.0 110.024 175.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -152.39 41.59 0.63 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.426 1.091 . . . . 0.0 112.864 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -89.19 173.13 8.59 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.03 1.332 . . . . 0.0 112.641 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.5 p -114.27 150.78 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 126.64 1.976 . . . . 0.0 109.357 165.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 -70.26 -12.66 61.74 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.412 1.485 . . . . 0.0 113.238 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.3 m -111.8 166.83 10.85 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.22 1.408 . . . . 0.0 112.131 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 57.1 p -116.09 -3.43 12.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.894 1.677 . . . . 0.0 112.882 -158.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 pp -132.15 -3.42 3.52 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.063 2.145 . . . . 0.0 113.252 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 67.3 m -86.7 157.15 19.71 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.575 1.15 . . . . 0.0 112.191 -177.321 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptt -133.99 7.23 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.7 t -149.27 154.4 38.98 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.676 1.19 . . . . 0.0 112.138 175.675 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -83.3 -28.05 29.37 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.283 1.433 . . . . 0.0 114.454 -174.113 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -88.82 70.22 8.67 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.517 1.127 . . . . 0.0 111.942 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.9 p-80 -139.55 175.56 9.46 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.083 1.353 . . . . 0.0 112.322 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -133.49 165.34 25.1 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.691 1.597 . . . . 0.0 111.336 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -58.56 -32.61 69.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.204 1.402 . . . . 0.0 112.981 175.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -74.47 -23.06 58.83 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.646 1.178 . . . . 0.0 112.985 173.015 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -103.85 -12.24 17.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.388 1.875 . . . . 0.0 114.059 -173.798 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 46.3 m -46.77 131.66 8.5 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.346 1.458 . . . . 0.0 111.55 176.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -58.93 -29.78 91.38 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 122.713 2.275 . . . . 0.0 117.433 -163.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 64.5 m -114.7 19.28 16.11 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 125.071 1.348 . . . . 0.0 114.295 -177.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.8 tp -65.61 142.42 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 120.718 -1.239 . . . . 0.0 112.229 -177.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.6 t-105 -71.26 139.78 50.13 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.58 0.752 . . . . 0.0 112.813 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -151.57 145.89 25.45 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.432 1.893 . . . . 0.0 111.305 166.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.94 157.48 21.9 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -137.91 149.14 45.96 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.073 1.749 . . . . 0.0 111.927 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 20.7 tt -78.97 -38.36 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.509 0.724 . . . . 0.0 111.621 165.033 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 11.0 tp 52.41 27.59 5.06 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.21 2.204 . . . . 0.0 115.238 175.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 90.3 t -135.4 139.44 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 126.476 1.911 . . . . 0.0 108.751 175.251 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -143.45 165.05 28.61 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.744 1.218 . . . . 0.0 113.605 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -106.21 13.07 29.37 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.06 2.144 . . . . 0.0 114.418 -175.712 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -75.93 172.8 12.1 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.314 1.046 . . . . 0.0 111.844 176.531 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -61.84 122.74 16.17 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.349 -0.845 . . . . 0.0 111.286 176.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -146.33 147.77 31.69 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.19 1.796 . . . . 0.0 111.567 -173.708 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 53.98 -176.66 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.397 1.479 . . . . 0.0 113.773 -165.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.15 161.8 33.04 Favored Pre-proline 0 N--CA 1.476 0.838 0 C-N-CA 125.354 1.461 . . . . 0.0 112.436 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.37 -172.66 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 124.296 3.331 . . . . 0.0 113.819 168.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -66.8 9.73 0.17 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 126.84 2.056 . . . . 0.0 115.278 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t 65.12 121.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 128.891 2.877 . . . . 0.0 113.489 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -72.05 151.75 92.71 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.003 0.921 . . . . 0.0 112.623 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -64.9 128.42 20.77 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.401 2.068 . . . . 0.0 113.025 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -86.85 -29.74 21.98 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.071 0.948 . . . . 0.0 112.26 169.696 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -140.15 161.42 37.68 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.458 1.903 . . . . 0.0 110.211 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.7 p -126.12 144.25 50.81 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.19 1.396 . . . . 0.0 111.349 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.3 pp -87.6 159.18 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 123.905 0.882 . . . . 0.0 112.532 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -77.97 158.94 29.1 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.557 1.143 . . . . 0.0 113.015 -174.027 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 31.9 t -145.22 140.48 27.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.794 0.838 . . . . 0.0 112.058 171.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -138.54 -10.11 1.41 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -176.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -90.11 -44.82 9.54 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -161.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.8 p -119.06 5.11 11.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.266 1.826 . . . . 0.0 113.558 177.44 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 170.8 -172.28 44.18 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.428 1.966 . . . . 0.0 111.44 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -75.92 177.3 50.24 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 123.545 0.593 . . . . 0.0 113.341 170.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -54.27 140.19 33.81 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.378 1.471 . . . . 0.0 111.908 173.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 156.83 -9.34 0.25 Allowed Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.776 1.87 . . . . 0.0 117.776 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -137.49 -167.26 2.09 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.955 1.877 . . . . 0.0 112.942 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -69.42 45.39 0.06 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.313 1.845 . . . . 0.0 113.236 173.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -53.46 -21.14 12.64 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 128.188 2.804 . . . . 0.0 115.573 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -75.57 -44.56 42.6 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.304 1.052 . . . . 0.0 112.825 171.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -88.3 -11.42 46.5 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.511 1.524 . . . . 0.0 113.167 -177.431 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 2.1 p -69.18 1.07 3.97 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -176.308 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -54.13 140.04 33.4 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.225 1.41 . . . . 0.0 111.952 175.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -91.75 164.45 13.7 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.28 1.032 . . . . 0.0 113.382 -175.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.626 1.971 . . . . 0.0 111.215 175.969 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.583 0.23 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.8 -2.38 16.19 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.849 2.06 . . . . 0.0 113.891 174.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.52 126.53 16.36 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.263 1.025 . . . . 0.0 113.123 178.459 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -84.16 -49.18 0.66 Allowed Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 125.092 1.357 . . . . 0.0 113.19 159.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.2 -29.83 6.06 Favored 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.796 2.331 . . . . 0.0 114.857 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? 62.33 -63.45 0.1 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.968 2.507 . . . . 0.0 114.647 -172.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.4 t -156.82 172.3 18.88 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.758 2.423 . . . . 0.0 111.245 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -73.51 -39.62 64.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.13 -0.981 . . . . 0.0 113.417 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -155.97 -58.34 0.1 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.9 1.28 . . . . 0.0 113.105 -171.571 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.9 p -79.01 -9.74 59.62 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 46.62 51.76 11.77 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 159.829 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -143.84 6.12 1.38 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -175.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -150.41 157.52 43.13 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.295 1.838 . . . . 0.0 110.273 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.14 -9.52 42.1 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.267 1.267 . . . . 0.0 116.267 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -72.97 94.49 1.87 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.962 1.381 . . . . 0.0 113.098 175.514 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -54.75 175.75 0.05 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.857 2.063 . . . . 0.0 113.79 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.01 -63.66 0.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.827 2.051 . . . . 0.0 114.433 -172.389 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -82.6 -12.47 57.67 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.324 1.85 . . . . 0.0 115.382 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -83.47 -23.42 32.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.619 1.168 . . . . 0.0 111.992 171.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.9 t -61.25 -52.8 68.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 120.908 -1.12 . . . . 0.0 113.386 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.49 -179.68 5.55 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.849 2.366 . . . . 0.0 111.936 168.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -72.16 33.21 0.06 Allowed 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 126.116 1.766 . . . . 0.0 114.878 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.4 mt -109.33 160.49 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 127.774 2.43 . . . . 0.0 110.095 -173.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.4 pt -54.69 128.68 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.877 1.271 . . . . 0.0 112.623 178.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 17.3 p -78.99 -21.98 46.21 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 t -157.39 -162.63 1.23 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.125 2.17 . . . . 0.0 110.014 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.18 49.29 0.67 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.285 1.834 . . . . 0.0 112.253 174.559 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.3 p -147.85 150.51 34.3 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.636 1.974 . . . . 0.0 110.954 177.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.11 -179.12 28.75 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 124.958 1.266 . . . . 0.0 113.363 -167.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -107.3 145.95 32.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.426 1.49 . . . . 0.0 110.662 172.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.1 t -66.88 -5.28 11.82 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -114.03 -11.17 12.78 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 126.267 1.827 . . . . 0.0 114.178 170.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -157.27 105.7 2.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.532 1.533 . . . . 0.0 111.205 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -130.83 -21.34 2.74 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.514 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -64.23 -40.31 95.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.691 1.132 . . . . 0.0 112.143 173.645 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t 50.03 -152.78 0.15 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.673 1.189 . . . . 0.0 111.878 -170.727 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.8 mmp_? -80.43 -38.59 29.86 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.592 -1.318 . . . . 0.0 110.283 150.205 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -136.92 87.67 2.3 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.324 1.45 . . . . 0.0 111.784 177.601 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t 17.04 -74.1 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 129.572 3.149 . . . . 0.0 117.654 157.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -71.09 72.89 2.06 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 124.612 3.541 . . . . 0.0 112.995 177.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 tptm -134.33 -173.34 3.25 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.526 2.33 . . . . 0.0 110.958 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.09 -41.36 0.19 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 128.481 2.713 . . . . 0.0 116.956 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.1 mt -133.61 93.7 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.68 1.592 . . . . 0.0 109.285 -174.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -139.59 167.45 22.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.661 1.584 . . . . 0.0 111.86 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 94.5 m -70.34 161.49 30.32 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.292 1.044 . . . . 0.0 111.996 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.4 m -71.41 -20.78 62.08 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.158 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -134.41 2.35 3.24 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -175.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.8 p -152.37 165.95 33.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.769 1.227 . . . . 0.0 112.288 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.7 134.1 39.32 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.557 1.543 . . . . 0.0 113.807 -172.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 59.23 156.99 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 127.225 2.21 . . . . 0.0 115.296 -172.255 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.2 m -88.85 -22.76 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 120.222 -1.549 . . . . 0.0 110.196 153.747 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.83 -20.11 63.91 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 126.402 1.953 . . . . 0.0 115.512 -173.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -79.87 -14.35 58.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -169.35 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -150.77 124.4 9.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.974 0.91 . . . . 0.0 111.793 174.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 52.97 12.05 0.25 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 126.854 2.062 . . . . 0.0 115.138 -173.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.304 33.0 p 48.4 23.95 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.917 2.087 . . . . 0.0 115.183 -161.472 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -147.35 -36.11 0.23 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 25.4 t 42.78 65.51 5.2 Favored Pre-proline 0 CA--C 1.556 1.178 0 C-N-CA 126.548 1.939 . . . . 0.0 114.2 -178.522 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.17 150.61 72.03 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.943 2.429 . . . . 0.0 112.865 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -77.24 148.33 35.85 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.756 0.822 . . . . 0.0 111.739 172.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -91.13 157.83 16.99 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -173.085 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -144.28 -171.81 3.65 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.748 2.019 . . . . 0.0 109.376 163.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -51.51 120.77 5.46 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.418 1.087 . . . . 0.0 111.248 175.108 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -74.49 123.43 24.73 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.149 0.98 . . . . 0.0 111.236 -174.414 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.5 t -78.0 -37.56 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.757 1.223 . . . . 0.0 112.504 -169.259 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 62.6 -36.37 0.13 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 128.226 2.61 . . . . 0.0 115.809 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.5 m -78.59 -1.11 32.55 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.519 1.927 . . . . 0.0 114.902 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 15.0 t 56.36 -51.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 129.657 3.183 . . . . 0.0 118.59 -177.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 pp -86.37 -13.94 44.95 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.503 1.521 . . . . 0.0 113.828 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 96.7 m -79.67 168.79 18.88 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.308 1.043 . . . . 0.0 112.381 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -111.0 -30.33 7.55 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 177.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.2 p -87.27 172.89 9.54 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.388 1.475 . . . . 0.0 112.906 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 162.61 7.54 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.129 0.972 . . . . 0.0 113.376 174.823 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -52.82 147.05 9.51 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -173.422 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -148.19 17.34 1.07 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.564 1.545 . . . . 0.0 112.914 172.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.7 p -75.22 -38.77 60.5 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -152.035 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 47.89 34.78 4.24 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.657 1.583 . . . . 0.0 113.248 -169.276 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 56.73 18.04 3.51 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 126.546 1.938 . . . . 0.0 115.528 -172.448 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.3 tpt85 -125.08 -30.14 3.24 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.217 2.207 . . . . 0.0 114.136 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.8 t 49.55 66.07 6.15 Favored Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 125.543 1.537 . . . . 0.0 112.441 -166.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.02 168.99 20.31 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.392 2.728 . . . . 0.0 112.474 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.3 p -70.22 161.29 30.57 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.809 0.814 . . . . 0.0 112.662 166.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.2 tp -60.46 149.83 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.327 1.051 . . . . 0.0 111.808 176.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 73.0 t-105 -59.47 140.73 55.95 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.769 0.795 . . . . 0.0 113.025 -175.76 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 35.0 ptt85 -156.12 158.63 38.03 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.962 2.105 . . . . 0.0 111.443 -165.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.44 156.11 33.41 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -179.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -64.74 143.37 57.98 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.627 0.771 . . . . 0.0 112.336 177.461 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 31.0 mm -84.44 142.15 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 124.46 1.104 . . . . 0.0 110.545 -177.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.48 150.31 49.13 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.873 0.869 . . . . 0.0 111.918 176.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -65.21 135.91 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.456 0.703 . . . . 0.0 111.807 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -80.47 150.42 29.7 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.882 1.273 . . . . 0.0 113.419 -176.899 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -148.69 156.33 42.24 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.391 1.477 . . . . 0.0 111.442 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -110.96 157.42 19.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.23 1.812 . . . . 0.0 112.236 -174.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.92 163.87 31.19 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.592 1.557 . . . . 0.0 112.51 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 56.19 23.96 7.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.54 1.936 . . . . 0.0 114.893 176.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.41 156.9 29.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.362 1.065 . . . . 0.0 112.949 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -139.47 136.7 17.98 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 126.563 1.945 . . . . 0.0 110.57 178.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.91 143.37 54.77 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.731 2.287 . . . . 0.0 111.734 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -126.54 113.33 16.65 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.942 1.297 . . . . 0.0 110.824 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.12 19.21 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 126.391 1.876 . . . . 0.0 112.267 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.9 mt -72.56 155.76 90.79 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 125.49 1.516 . . . . 0.0 112.409 -176.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -62.13 152.9 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.062 2.508 . . . . 0.0 112.397 172.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -93.53 148.58 21.95 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.045 0.938 . . . . 0.0 112.794 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 24.2 m80 60.43 0.51 0.32 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 175.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 6.9 p -84.04 134.67 34.61 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.03 1.332 . . . . 0.0 111.296 173.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.31 18.03 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.485 1.514 . . . . 0.0 113.836 -173.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -136.57 156.16 48.94 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.383 1.473 . . . . 0.0 112.505 -175.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.4 t -124.73 12.19 8.52 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 -162.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -56.66 -35.84 68.86 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.294 -1.504 . . . . 0.0 114.084 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.05 -13.76 62.37 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -86.34 -6.43 58.95 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.985 1.714 . . . . 0.0 112.743 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 114.99 -7.64 21.56 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.313 1.911 . . . . 0.0 114.384 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 165.14 149.65 5.92 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-N 118.614 1.207 . . . . 0.0 113.89 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -65.2 -17.91 64.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.491 1.917 . . . . 0.0 114.257 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -71.86 -5.4 61.18 Favored Glycine 0 CA--C 1.538 1.482 0 N-CA-C 118.602 2.201 . . . . 0.0 118.602 -164.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -147.35 150.68 35.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.897 2.349 . . . . 0.0 115.535 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 39.16 29.44 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 129.978 3.311 . . . . 0.0 117.658 164.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.34 -11.7 35.09 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.961 1.267 . . . . 0.0 115.025 -174.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -67.86 -33.51 74.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.499 1.519 . . . . 0.0 113.92 174.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -151.39 -26.66 0.2 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -166.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 14.9 p -65.44 136.67 56.76 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 120.579 1.536 . . . . 0.0 113.535 -168.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . 0.408 ' HA ' ' HE2' ' A' ' 122' ' ' LYS . 0.7 OUTLIER -155.78 -29.23 0.1 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.007 1.323 . . . . 0.0 113.45 -176.251 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -74.94 163.56 27.5 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.895 2.078 . . . . 0.0 113.102 -179.395 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.1 tptp . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -61.81 153.23 29.32 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.966 1.706 . . . . 0.0 112.926 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -116.83 130.65 56.85 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.367 1.067 . . . . 0.0 112.804 -177.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -75.41 -51.4 3.3 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.001 0.92 . . . . 0.0 112.471 159.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -76.05 -41.39 0.51 Allowed 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.548 2.166 . . . . 0.0 114.74 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.295 0.1 OUTLIER 50.85 -33.95 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 131.343 3.857 . . . . 0.0 119.286 -171.98 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.9 t -157.79 164.49 36.97 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.416 1.886 . . . . 0.0 112.652 171.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -74.54 -40.21 61.86 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.515 1.126 . . . . 0.0 113.307 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -158.37 -31.3 0.07 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.741 1.617 . . . . 0.0 113.101 -171.343 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 m -73.21 -163.82 0.16 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.856 0.862 . . . . 0.0 110.654 169.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.1 p -135.87 155.69 49.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.893 -1.129 . . . . 0.0 112.9 170.884 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 56.51 -173.59 0.07 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.87 2.068 . . . . 0.0 114.716 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.265 9.1 ttp180 65.6 27.19 11.52 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.2 2.2 . . . . 0.0 115.659 172.48 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.48 -17.02 0.66 Allowed Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.907 1.923 . . . . 0.0 117.907 160.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -81.14 77.63 8.01 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.202 1.501 . . . . 0.0 111.142 -178.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -56.99 178.74 0.05 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 128.107 2.563 . . . . 0.0 113.693 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.21 -64.44 0.32 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.616 1.966 . . . . 0.0 114.252 -171.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -78.71 -13.97 59.54 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.083 1.753 . . . . 0.0 115.296 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.87 -14.78 31.08 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.336 1.454 . . . . 0.0 113.139 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.94 -53.91 45.12 Favored Pre-proline 0 CA--C 1.549 0.923 0 CA-C-O 118.08 -0.962 . . . . 0.0 113.018 171.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.26 154.44 41.3 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.199 1.932 . . . . 0.0 111.68 169.636 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -122.55 0.77 9.43 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -102.18 15.6 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.301 1.44 . . . . 0.0 114.073 -175.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.8 mm -107.17 134.62 48.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.645 1.578 . . . . 0.0 110.631 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.7 p -87.59 141.61 28.48 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.323 1.059 . . . . 0.0 112.272 173.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.2 p -70.17 137.5 51.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.314 1.446 . . . . 0.0 114.119 -164.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 50.66 14.29 0.17 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.121 1.768 . . . . 0.0 115.217 -169.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -150.39 29.49 0.7 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.183 0.993 . . . . 0.0 112.159 -163.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.7 153.99 24.86 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 120.297 -1.502 . . . . 0.0 114.863 -176.754 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -142.58 140.72 31.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.557 1.543 . . . . 0.0 110.101 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -21.54 64.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -171.374 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -138.84 15.0 2.68 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -138.7 -1.06 1.87 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -172.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 37.0 t-80 -106.37 150.19 26.25 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.068 1.347 . . . . 0.0 113.226 -172.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -142.37 147.21 35.88 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.158 1.383 . . . . 0.0 111.188 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.5 t -54.62 -40.95 69.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.692 1.597 . . . . 0.0 114.47 -172.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -79.13 -13.38 59.77 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -104.49 -18.21 14.46 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.218 1.407 . . . . 0.0 113.42 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' CYS . . . . . 0.437 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.288 1.2 m 24.43 -88.63 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 129.989 3.316 . . . . 0.0 116.561 172.44 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.437 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 25.0 Cg_exo -70.17 -19.95 33.54 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.284 1.851 . . . . 0.0 116.709 -158.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.03 1.91 22.36 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -174.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.52 60.59 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -175.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 mt -130.21 141.22 46.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.813 1.645 . . . . 0.0 108.854 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -147.6 161.44 41.13 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.0 t -67.04 156.91 34.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.525 1.53 . . . . 0.0 112.036 168.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.4 m -65.71 -17.72 64.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.18 1.392 . . . . 0.0 114.63 174.324 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -129.63 -2.57 4.81 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.33 1.452 . . . . 0.0 114.696 -171.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 31.1 p -149.27 156.01 41.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.368 1.067 . . . . 0.0 111.835 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.39 151.52 45.11 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.647 -0.658 . . . . 0.0 112.163 174.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 59.18 175.06 0.07 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.739 1.216 . . . . 0.0 113.278 -170.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.8 m -75.94 71.14 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 O-C-N 119.813 -1.805 . . . . 0.0 109.66 167.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.39 -116.29 0.09 OUTLIER Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.458 1.98 . . . . 0.0 117.132 -159.209 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -67.9 -7.92 32.4 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 117.704 2.483 . . . . 0.0 117.704 -154.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -128.93 118.67 23.04 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.475 1.034 . . . . 0.0 112.24 176.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 43.98 26.16 0.13 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.724 2.81 . . . . 0.0 116.66 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.0 m 52.66 30.25 8.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.31 1.444 . . . . 0.0 114.786 -172.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -145.02 -34.34 0.35 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.127 1.371 . . . . 0.0 113.38 -174.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 86.7 m 45.71 58.33 15.6 Favored Pre-proline 0 CA--C 1.555 1.17 0 C-N-CA 126.189 1.796 . . . . 0.0 114.813 -174.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -70.69 170.47 17.61 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.551 2.834 . . . . 0.0 113.065 175.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.8 p-80 -133.25 158.32 43.21 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.162 1.385 . . . . 0.0 112.123 172.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -86.38 140.3 30.14 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.965 1.306 . . . . 0.0 112.372 -176.753 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -74.17 158.7 33.68 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.226 1.01 . . . . 0.0 113.242 176.264 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -125.15 41.12 3.59 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 126.215 1.806 . . . . 0.0 111.739 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.9 tptt -70.9 154.16 42.06 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.639 1.176 . . . . 0.0 111.746 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.2 p -70.58 131.13 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.327 0.651 . . . . 0.0 112.044 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -103.69 6.7 37.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.285 1.434 . . . . 0.0 113.735 -173.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.4 m -74.11 -17.67 60.91 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 62.86 -47.76 0.2 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.212 2.605 . . . . 0.0 117.608 -166.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -86.36 0.07 54.8 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 91.8 m -111.37 156.28 21.83 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.866 1.266 . . . . 0.0 112.854 -178.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -114.48 160.95 18.62 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 126.027 1.731 . . . . 0.0 109.619 161.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.8 m -76.04 -20.83 57.44 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.638 1.347 . . . . 0.0 114.638 -172.323 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -66.84 134.13 51.47 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.521 0.728 . . . . 0.0 112.262 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.2 tttp 47.61 35.22 4.18 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.764 2.025 . . . . 0.0 114.221 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -82.51 131.61 35.21 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.824 0.85 . . . . 0.0 112.668 -171.227 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.8 m -94.3 110.96 22.68 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.914 0.886 . . . . 0.0 111.956 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.86 135.45 57.33 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.782 0.833 . . . . 0.0 111.578 -177.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 54.52 20.07 2.67 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.355 1.862 . . . . 0.0 115.669 -173.421 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -130.87 -40.04 1.2 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.43 1.492 . . . . 0.0 113.356 177.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.8 m 63.91 148.64 0.1 Allowed Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 128.655 2.782 . . . . 0.0 115.667 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.91 -32.69 17.48 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.057 2.505 . . . . 0.0 112.812 171.582 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.4 t -126.36 151.99 46.87 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.483 1.913 . . . . 0.0 111.476 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 16.8 tt -137.74 -28.47 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -174.602 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 13.6 t-105 -96.29 -19.4 19.3 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -163.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -92.36 25.54 2.93 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.542 1.537 . . . . 0.0 113.824 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -87.22 -8.29 57.0 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -173.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -82.6 -18.91 39.59 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -170.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 73.1 mt -88.35 132.5 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.603 1.161 . . . . 0.0 110.443 -178.241 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.2 mt -124.66 8.11 8.24 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.441 1.497 . . . . 0.0 113.934 -172.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 41.1 t -82.12 110.58 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 124.121 0.968 . . . . 0.0 111.562 -171.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -156.69 136.73 12.7 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.605 1.562 . . . . 0.0 111.298 172.7 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -155.05 150.22 27.01 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.115 1.366 . . . . 0.0 113.052 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -150.4 170.91 17.93 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.101 1.761 . . . . 0.0 112.087 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -97.28 141.91 29.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.387 1.075 . . . . 0.0 112.296 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -137.15 -59.2 0.7 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 125.25 1.42 . . . . 0.0 112.869 -172.358 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.66 157.04 36.02 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.973 0.909 . . . . 0.0 112.945 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 7.9 ptpp? -148.58 146.43 22.36 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.624 1.57 . . . . 0.0 112.347 -178.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo -70.69 -33.86 12.4 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.741 2.294 . . . . 0.0 114.822 -178.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -138.17 158.35 44.48 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.414 1.885 . . . . 0.0 111.633 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -121.05 -4.65 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.375 1.47 . . . . 0.0 113.777 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 21.2 tp -68.71 124.41 90.08 Favored Pre-proline 0 CA--C 1.551 1.01 0 O-C-N 121.183 -0.948 . . . . 0.0 110.974 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -80.64 159.42 21.98 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.84 2.36 . . . . 0.0 113.774 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -144.42 158.47 43.73 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 127.72 2.408 . . . . 0.0 109.607 173.797 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 32.6 p80 -73.1 -23.74 60.55 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -170.699 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.1 t -87.81 61.81 6.62 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 123.786 1.755 . . . . 0.0 113.569 -178.156 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.7 pt -72.35 11.72 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 C-N-CA 126.165 1.786 . . . . 0.0 115.172 -171.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -99.25 9.33 43.61 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 -152.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 59.05 164.11 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -172.956 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -70.87 -17.64 62.72 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -168.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -64.6 -32.09 73.59 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.159 0.89 . . . . 0.0 111.81 170.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 55.6 m -99.1 -3.64 34.15 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.393 1.877 . . . . 0.0 113.3 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.66 8.74 76.31 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.431 1.491 . . . . 0.0 115.801 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -106.94 -157.97 21.2 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 126.404 1.954 . . . . 0.0 113.606 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -140.49 150.99 44.45 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.051 2.14 . . . . 0.0 111.601 174.441 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 88.2 -152.18 23.37 Favored Glycine 0 CA--C 1.54 1.636 0 N-CA-C 116.271 1.268 . . . . 0.0 116.271 176.257 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.305 0.6 OUTLIER 47.52 -161.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 128.952 2.901 . . . . 0.0 115.661 -170.014 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -67.07 36.89 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.729 2.012 . . . . 0.0 113.736 171.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.17 -30.04 16.6 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 126.53 2.014 . . . . 0.0 113.877 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.1 -38.62 65.55 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.518 1.927 . . . . 0.0 114.189 172.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -97.68 -34.16 11.03 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.798 1.639 . . . . 0.0 111.798 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.3 t -71.18 -7.63 48.08 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.486 1.514 . . . . 0.0 113.839 -177.385 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.6 -8.49 57.94 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.205 1.402 . . . . 0.0 114.313 169.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -107.82 146.45 32.24 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.237 1.415 . . . . 0.0 112.455 173.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? . . . . . 0 C--O 1.253 1.265 0 C-N-CA 126.499 1.92 . . . . 0.0 111.076 174.127 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.68 -51.14 22.3 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 124.259 1.024 . . . . 0.0 113.289 165.829 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.44 -38.25 0.78 Allowed 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 122.616 2.211 . . . . 0.0 114.267 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.403 0.0 OUTLIER 49.73 -42.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 130.843 3.657 . . . . 0.0 118.537 -169.526 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.7 t -159.66 160.57 34.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.685 1.994 . . . . 0.0 111.693 174.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -71.01 -29.25 65.14 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 173.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -161.64 -35.67 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.9 m -76.19 -21.19 56.78 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.8 m 58.49 11.87 1.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 119.012 2.967 . . . . 0.0 119.012 171.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -133.08 -3.25 3.15 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 -175.082 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -126.14 160.39 30.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.383 1.473 . . . . 0.0 111.857 -172.556 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.01 -19.23 69.7 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.03 92.57 3.18 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -57.38 179.21 0.06 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.891 2.077 . . . . 0.0 114.049 170.502 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -63.8 0.53 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.489 1.916 . . . . 0.0 114.475 -170.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -79.22 -11.46 59.96 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.57 1.548 . . . . 0.0 114.887 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -81.04 -37.82 28.45 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.175 0.99 . . . . 0.0 111.475 176.301 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.2 t -58.34 -37.4 54.5 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo . . . . . 0 C--N 1.353 0.813 0 C-N-CA 122.777 2.318 . . . . 0.0 114.754 174.783 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 123.099 1.428 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.3 mm -87.88 133.87 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 127.442 2.297 . . . . 0.0 108.546 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 m -61.81 142.41 57.33 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.989 -0.444 . . . . 0.0 110.812 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 73.5 m -51.1 -30.35 15.92 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 -159.477 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -142.26 11.79 1.95 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 174.657 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 44.3 m -64.59 -48.52 74.67 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.58 -1.325 . . . . 0.0 113.03 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLY . . . . . 0.473 ' HA2' ' H ' ' A' ' 43' ' ' ILE . . . -165.79 178.45 40.54 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -153.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.63 138.8 47.69 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.36 1.464 . . . . 0.0 109.915 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 t -56.37 -19.24 13.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.959 1.704 . . . . 0.0 114.361 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -65.65 -19.26 65.84 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 172.445 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -139.23 -34.87 0.57 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.376 1.47 . . . . 0.0 114.485 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -66.51 123.97 21.5 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.144 1.778 . . . . 0.0 112.053 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -155.22 169.37 24.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.42 1.488 . . . . 0.0 110.673 -174.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -63.12 -13.15 33.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.003 1.721 . . . . 0.0 115.509 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -109.35 2.55 20.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.295 1.838 . . . . 0.0 113.652 170.355 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -136.55 0.71 2.52 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -172.347 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.3 t -37.29 -51.88 2.37 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.194 2.198 . . . . 0.0 114.93 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.87 -8.45 19.06 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.436 2.758 . . . . 0.0 116.066 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -102.1 5.99 40.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.362 1.865 . . . . 0.0 113.653 -173.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -86.81 -152.64 0.19 Allowed 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.122 1.369 . . . . 0.0 113.355 -173.783 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ILE . . . . . 0.473 ' H ' ' HA2' ' A' ' 29' ' ' GLY . 95.3 mt -55.43 -40.37 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.621 1.569 . . . . 0.0 113.48 -169.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -118.74 154.33 32.96 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 24.6 p -83.29 -34.29 25.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.855 1.262 . . . . 0.0 114.031 -175.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.0 t -159.37 -155.77 0.48 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.097 1.359 . . . . 0.0 111.322 -170.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -62.79 -24.99 68.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 127.013 2.125 . . . . 0.0 112.692 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 24.4 p -89.82 155.08 19.41 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.045 1.338 . . . . 0.0 112.467 172.373 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -72.3 134.17 45.39 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -166.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 60.26 148.48 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 128.827 2.851 . . . . 0.0 117.006 176.331 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.6 m -71.8 -15.66 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 119.783 -1.823 . . . . 0.0 110.714 161.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.91 18.87 1.32 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 128.025 2.726 . . . . 0.0 116.457 -170.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.0 155.31 44.64 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.809 1.304 . . . . 0.0 112.171 174.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.9 t80 59.9 137.64 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 128.069 2.547 . . . . 0.0 115.722 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.99 148.58 20.98 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.483 1.113 . . . . 0.0 112.486 -175.251 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 m 57.32 32.68 22.15 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -168.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 54.96 45.88 25.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.625 1.97 . . . . 0.0 113.495 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.7 t . . . . . 0 CA--C 1.555 1.144 0 C-N-CA 126.881 2.072 . . . . 0.0 113.585 -175.875 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.5 t . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.649 0.261 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -69.98 -35.84 74.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.489 0.716 . . . . 0.0 112.019 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 22.2 m -76.55 156.74 32.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 123.688 1.709 . . . . 0.0 112.168 166.163 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 36.9 p -113.31 -15.26 12.71 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.673 2.389 . . . . 0.0 111.702 -161.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.19 -21.46 21.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.078 1.751 . . . . 0.0 111.861 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 76.0 m -99.5 -22.35 15.53 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.715 1.206 . . . . 0.0 114.222 -164.687 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.62 -55.48 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 129.617 3.167 . . . . 0.0 118.91 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 58.2 m -112.76 122.37 47.47 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -162.104 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt 56.54 -51.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.746 3.619 . . . . 0.0 119.24 168.18 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -80.33 151.03 29.69 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -160.158 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 54.84 177.68 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 119.241 3.052 . . . . 0.0 119.241 159.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 68.4 m -139.63 170.61 15.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 127.492 2.317 . . . . 0.0 111.39 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -56.87 -31.76 65.15 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -176.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -73.83 -19.31 60.78 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -102.01 -17.36 16.12 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.227 1.811 . . . . 0.0 112.97 174.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 43.8 t . . . . . 0 CA--C 1.553 1.085 0 C-N-CA 125.851 1.66 . . . . 0.0 112.471 176.216 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -68.09 134.13 50.09 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -172.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -150.68 161.75 42.0 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.776 1.63 . . . . 0.0 111.073 -175.372 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -59.51 156.47 13.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.006 1.322 . . . . 0.0 113.442 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -141.22 175.36 9.71 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 112.433 -176.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? 43.89 59.49 12.45 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 127.497 2.319 . . . . 0.0 115.835 174.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -76.8 70.8 6.37 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.272 3.314 . . . . 0.0 112.62 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -137.16 161.19 36.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.302 2.641 . . . . 0.0 111.104 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 26.9 m -65.1 148.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.141 0.976 . . . . 0.0 112.487 176.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.8 mt -84.92 156.6 60.81 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.281 1.032 . . . . 0.0 112.652 -177.597 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.25 159.6 30.17 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.798 2.999 . . . . 0.0 114.444 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.9 p90 . . . . . 0 CA--C 1.542 0.668 0 C-N-CA 124.324 1.05 . . . . 0.0 112.931 176.929 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.6 p . . . . . 0 CA--C 1.552 1.044 0 N-CA-C 119.397 3.11 . . . . 0.0 119.397 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.3 t80 60.94 6.46 1.22 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.619 2.367 . . . . 0.0 114.847 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -106.96 -25.02 11.81 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.716 1.607 . . . . 0.0 112.168 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.2 p -145.38 18.43 1.53 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.77 1.628 . . . . 0.0 113.963 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 162.62 -133.94 3.27 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.016 1.293 . . . . 0.0 113.292 175.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.31 -159.64 1.07 Allowed Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.908 1.718 . . . . 0.0 113.014 171.034 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -109.65 150.71 27.86 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.46 1.63 . . . . 0.0 112.941 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 154.57 -103.46 0.24 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 115.265 0.866 . . . . 0.0 115.265 -177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -70.67 151.31 45.07 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 -153.218 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 45.89 28.14 0.56 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.409 2.283 . . . . 0.0 116.835 164.039 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.21 -16.47 34.29 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.725 1.155 . . . . 0.0 115.669 -170.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.43 -33.64 76.0 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.754 1.621 . . . . 0.0 113.958 173.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -138.6 -21.14 1.02 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.951 1.301 . . . . 0.0 114.367 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.55 0.944 0 C-N-CA 125.524 1.53 . . . . 0.0 111.135 172.522 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.839 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.05 61.08 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 123.993 0.917 . . . . 0.0 112.061 164.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.42 -46.02 0.23 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.551 2.167 . . . . 0.0 113.196 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.252 1.8 pttm 41.98 -165.72 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.324 1.45 . . . . 0.0 112.45 -149.154 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 m -56.2 155.38 6.75 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.077 -1.64 . . . . 0.0 114.442 178.614 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -61.18 -44.33 97.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.439 1.496 . . . . 0.0 114.636 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -157.57 -34.61 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.335 2.654 . . . . 0.0 109.974 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.9 t -55.61 168.48 0.41 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.486 1.514 . . . . 0.0 111.309 153.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.2 m -134.54 76.51 1.64 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -175.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -132.92 161.01 35.38 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.268 1.427 . . . . 0.0 110.586 162.534 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -78.15 -32.82 50.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.933 1.293 . . . . 0.0 112.822 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -73.76 -177.64 35.85 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 124.666 1.127 . . . . 0.0 112.81 169.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.331 0.6 OUTLIER 21.62 64.92 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 128.006 2.523 . . . . 0.0 114.85 -176.181 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.596 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.47 -178.28 0.18 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.438 1.895 . . . . 0.0 114.103 -174.718 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -22.72 -69.98 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 127.782 2.433 . . . . 0.0 115.068 -174.962 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -77.06 -14.29 59.84 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.059 1.744 . . . . 0.0 115.645 -178.043 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.33 -26.34 16.61 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.567 1.947 . . . . 0.0 113.219 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -56.94 -46.7 99.84 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.057 1.343 . . . . 0.0 114.437 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo . . . . . 0 CA--C 1.543 0.972 0 C-N-CA 122.892 2.395 . . . . 0.0 113.822 178.847 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.5 mt . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.0 mt -118.98 58.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.426 1.49 . . . . 0.0 109.585 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.5 m 49.3 50.92 17.26 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.702 1.601 . . . . 0.0 113.541 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.1 m 56.51 46.52 20.44 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.709 1.204 . . . . 0.0 113.667 -173.509 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 12.1 t80 56.64 56.01 5.91 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.574 1.95 . . . . 0.0 113.558 -177.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 p -72.04 -30.09 64.83 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.052 -1.03 . . . . 0.0 112.48 173.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -177.69 -159.44 22.62 Favored Glycine 0 CA--C 1.53 0.986 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 -169.005 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.16 174.22 10.36 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.364 1.066 . . . . 0.0 111.613 173.009 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.2 t -110.12 -18.87 13.23 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -177.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -97.04 -39.2 9.45 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.862 -1.149 . . . . 0.0 113.829 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -85.86 11.73 10.66 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.766 1.227 . . . . 0.0 112.433 169.38 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -70.99 126.44 29.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.668 1.987 . . . . 0.0 112.681 -174.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -152.0 150.59 30.15 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.66 1.184 . . . . 0.0 111.031 171.786 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.1 m -61.35 -27.43 68.5 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.593 1.557 . . . . 0.0 114.616 -171.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -75.67 -29.96 59.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.797 1.239 . . . . 0.0 113.149 174.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.2 m170 -101.47 -28.39 12.59 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -170.281 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.3 m -5.03 -75.22 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 129.833 3.253 . . . . 0.0 117.7 -174.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -76.87 -12.76 17.87 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.12 2.546 . . . . 0.0 115.574 -172.705 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -92.52 33.03 1.14 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.478 1.911 . . . . 0.0 113.02 -172.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -110.51 -38.16 5.28 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -163.873 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 58.6 mt -128.19 126.73 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.87 0.868 . . . . 0.0 111.681 -167.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.89 158.09 43.95 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 127.135 2.174 . . . . 0.0 110.113 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.1 t -75.96 143.64 41.45 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.453 0.701 . . . . 0.0 110.96 173.311 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.1 p -61.13 -37.4 82.69 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.929 1.292 . . . . 0.0 114.034 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -122.14 -7.7 8.81 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.742 1.617 . . . . 0.0 114.619 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 39.7 m -117.03 8.04 13.27 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 61.65 0.6 0.5 Allowed 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 119.119 3.007 . . . . 0.0 119.119 166.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -141.64 148.5 39.26 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 120.78 1.627 . . . . 0.0 112.73 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.292 11.2 m 53.55 -9.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 1 N-CA-C 121.847 4.017 . . . . 0.0 121.847 164.229 . . . . . . . . 3 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 117.02 -177.22 16.59 Favored Glycine 0 N--CA 1.48 1.567 0 CA-C-N 121.136 1.789 . . . . 0.0 114.308 171.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -117.98 0.04 11.78 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 115.779 1.77 . . . . 0.0 115.779 -170.292 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -83.44 153.32 24.54 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.581 -1.324 . . . . 0.0 111.908 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -60.65 -24.85 65.89 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -167.531 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -80.48 -12.4 59.55 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -132.79 -19.02 2.35 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -172.832 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 13.4 t . . . . . 0 CA--C 1.548 0.88 0 CA-C-N 119.992 1.269 . . . . 0.0 112.021 179.051 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 N--CA 1.484 1.256 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 61.92 6.62 1.74 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 126.865 2.066 . . . . 0.0 115.753 177.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 71.0 m -88.37 0.8 55.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.594 1.158 . . . . 0.0 113.702 173.615 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.281 6.3 t 57.29 -42.94 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 129.452 3.101 . . . . 0.0 117.768 -169.073 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -101.35 7.9 42.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 178.224 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 71.9 m -112.26 147.4 36.34 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.186 0.994 . . . . 0.0 112.229 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -106.92 178.9 4.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.913 1.685 . . . . 0.0 110.371 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.1 p -66.29 -29.48 69.7 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -80.79 160.03 24.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.273 1.429 . . . . 0.0 112.77 171.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . 0.265 22.5 pttp 49.52 30.29 3.39 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.962 2.505 . . . . 0.0 116.202 174.173 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -109.16 120.17 41.74 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.076 0.95 . . . . 0.0 112.529 -174.248 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.3 m -144.05 139.85 29.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.229 1.412 . . . . 0.0 111.78 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.64 -38.93 89.5 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.121 0.968 . . . . 0.0 112.871 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -80.98 -10.03 59.77 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.365 1.066 . . . . 0.0 113.775 179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -108.49 -24.58 11.34 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.429 1.491 . . . . 0.0 113.716 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.9 t . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 125.139 1.376 . . . . 0.0 114.383 179.818 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.8 t70 . . . . . 0 CA--C 1.549 0.924 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.41 14.54 4.83 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 129.039 2.936 . . . . 0.0 115.494 176.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -137.61 152.42 49.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.096 1.758 . . . . 0.0 111.726 176.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -134.88 4.13 3.26 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.583 1.553 . . . . 0.0 114.75 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.21 154.44 23.37 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.028 1.331 . . . . 0.0 112.411 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -79.25 161.65 66.99 Favored Pre-proline 0 N--CA 1.476 0.836 0 C-N-CA 124.604 1.162 . . . . 0.0 112.665 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.46 162.98 19.0 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.312 2.675 . . . . 0.0 114.173 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -118.3 155.18 31.07 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.164 1.786 . . . . 0.0 111.172 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.2 t -128.17 138.03 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 125.145 1.378 . . . . 0.0 110.743 -176.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.598 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 60.5 tp -126.33 -49.26 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.743 1.617 . . . . 0.0 113.686 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.598 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 90.7 Cg_endo -73.15 162.36 40.89 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.064 1.842 . . . . 0.0 112.629 176.758 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 59.7 t80 . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.206 1.402 . . . . 0.0 111.721 -179.919 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 40.4 t . . . . . 0 CA--C 1.541 0.614 0 CA-C-O 121.27 0.557 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -69.85 -37.34 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -169.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -100.02 -33.77 10.36 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 68.4 m -95.05 -11.71 27.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -161.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 75.65 -20.64 2.19 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.056 1.312 . . . . 0.0 114.367 -169.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -76.15 177.56 50.37 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.2 1.381 . . . . 0.0 113.95 170.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -141.93 147.7 37.48 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.585 1.554 . . . . 0.0 111.609 -172.487 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.29 9.83 55.55 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 162.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.409 ' C ' ' H ' ' A' ' 118' ' ' GLY . 3.0 p80 -83.05 -154.35 0.14 Allowed 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.489 1.644 . . . . 0.0 112.103 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -65.05 25.96 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 126.572 1.949 . . . . 0.0 114.556 167.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 118' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -43.13 -29.43 0.94 Allowed Glycine 0 CA--C 1.538 1.482 0 C-N-CA 129.083 3.23 . . . . 0.0 115.044 168.792 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.83 -38.06 84.18 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.745 1.618 . . . . 0.0 114.08 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -102.85 -21.47 14.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.49 1.516 . . . . 0.0 112.36 176.449 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 24.9 t . . . . . 0 CA--C 1.554 1.116 0 C-N-CA 126.721 2.008 . . . . 0.0 111.097 169.762 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -80.95 -54.35 0.74 Allowed Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 123.824 0.849 . . . . 0.0 112.076 155.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -76.7 -48.32 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.382 2.055 . . . . 0.0 114.313 -177.413 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.262 7.0 pttm 42.17 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.571 1.549 . . . . 0.0 112.587 -148.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.8 m -54.13 148.74 10.56 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 119.848 -1.782 . . . . 0.0 113.8 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.416 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 56.0 t30 -60.33 -39.69 87.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.558 0.743 . . . . 0.0 112.0 174.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -136.81 -48.31 0.62 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -169.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.5 p -97.95 16.78 19.92 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -167.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.0 m 52.23 59.1 4.76 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 118.054 2.612 . . . . 0.0 118.054 164.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -129.67 164.76 23.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.897 1.279 . . . . 0.0 111.899 165.711 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -94.31 155.59 16.93 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.256 1.822 . . . . 0.0 111.828 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.77 -19.37 29.62 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 125.087 1.327 . . . . 0.0 115.958 170.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.279 11.8 p-80 -126.73 55.95 1.51 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 123.756 1.741 . . . . 0.0 109.925 170.61 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.659 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.67 -179.4 0.18 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.528 2.331 . . . . 0.0 114.808 -173.878 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -14.81 -71.52 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 128.788 2.835 . . . . 0.0 115.74 -177.845 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -77.01 -20.56 55.87 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -94.34 -2.97 51.26 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.217 2.207 . . . . 0.0 113.243 175.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.9 t -61.76 -41.12 75.69 Favored Pre-proline 0 CA--C 1.557 1.223 0 C-N-CA 126.491 1.917 . . . . 0.0 114.329 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo . . . . . 0 C--N 1.359 1.097 0 C-N-CA 122.542 2.161 . . . . 0.0 112.926 171.081 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.4 pt -60.42 147.23 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 119.947 1.249 . . . . 0.0 112.876 177.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.0 m -73.08 -65.09 0.85 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 m -149.2 -61.54 0.22 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.274 1.03 . . . . 0.0 112.215 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -146.55 59.16 1.21 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.72 1.608 . . . . 0.0 110.267 -178.079 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.4 p -151.99 168.18 26.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.976 1.711 . . . . 0.0 111.112 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 52.09 -152.93 6.16 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.792 1.663 . . . . 0.0 113.454 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.89 146.41 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.202 1.401 . . . . 0.0 108.946 164.449 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.1 t -60.41 -23.77 64.63 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -92.85 -11.32 33.88 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.537 1.535 . . . . 0.0 113.991 175.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -156.26 100.03 1.97 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.268 1.427 . . . . 0.0 111.622 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -150.26 143.54 25.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.008 0.923 . . . . 0.0 112.857 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -165.57 170.9 13.77 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 128.668 2.787 . . . . 0.0 108.472 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.8 m -57.36 -32.41 66.73 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.343 -1.473 . . . . 0.0 114.545 177.947 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -96.5 3.83 52.47 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.86 1.264 . . . . 0.0 114.288 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -116.92 0.55 12.48 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.348 1.459 . . . . 0.0 113.354 173.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -37.28 -50.64 2.41 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.253 1.421 . . . . 0.0 112.445 155.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -82.1 23.57 0.77 Allowed 'Trans proline' 0 CA--C 1.552 1.376 0 C-N-CA 124.639 3.559 . . . . 0.0 116.437 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -75.19 -84.73 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.196 -1.565 . . . . 0.0 112.643 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.22 -12.22 30.75 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -167.375 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.0 mt -141.46 112.9 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.756 1.622 . . . . 0.0 107.09 -169.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.271 3.8 pm0 47.48 174.1 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.891 1.676 . . . . 0.0 115.072 -159.219 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 59.3 m -140.48 151.63 44.98 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 127.112 2.165 . . . . 0.0 109.483 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 p -71.76 -32.11 67.34 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.258 1.423 . . . . 0.0 113.192 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -99.81 -34.14 10.28 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.052 1.741 . . . . 0.0 113.004 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 3.1 m -103.67 -1.43 28.12 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.4 t0 58.45 -155.96 0.34 Allowed 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.402 1.481 . . . . 0.0 113.19 -171.968 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -42.51 8.27 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 C-N-CA 134.139 4.976 . . . . 0.0 121.123 -169.709 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -101.75 -36.01 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.527 1.531 . . . . 0.0 114.498 -161.064 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.44 164.83 6.45 Favored Glycine 0 CA--C 1.541 1.672 0 C-N-CA 124.351 0.977 . . . . 0.0 114.462 -174.606 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -87.12 28.61 0.91 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.899 1.28 . . . . 0.0 114.078 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -65.68 154.04 40.0 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.122 -0.986 . . . . 0.0 112.126 171.646 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -23.68 44.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.612 1.965 . . . . 0.0 114.946 -172.159 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.7 m -104.37 4.18 33.17 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -119.47 -37.92 3.09 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.992 1.717 . . . . 0.0 111.847 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 91.0 m . . . . . 0 CA--C 1.55 0.946 0 C-N-CA 126.582 1.953 . . . . 0.0 110.97 169.122 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -66.19 -30.58 71.07 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.729 0.412 . . . . 0.0 111.807 -175.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.3 m -74.32 170.24 16.01 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.764 1.745 . . . . 0.0 113.109 175.158 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.2 p -135.16 -23.29 1.51 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 127.796 2.438 . . . . 0.0 111.209 -162.618 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mp -78.39 -23.78 46.64 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.373 1.869 . . . . 0.0 111.441 165.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.2 m -104.28 155.51 18.69 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.708 1.203 . . . . 0.0 113.568 -163.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -81.86 164.77 21.37 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.736 1.215 . . . . 0.0 109.904 164.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 p -73.25 41.29 0.11 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.604 2.762 . . . . 0.0 114.501 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -98.08 163.13 12.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.424 2.29 . . . . 0.0 110.983 177.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -55.31 146.35 19.54 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.081 1.352 . . . . 0.0 112.643 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -133.77 160.73 36.72 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.079 1.752 . . . . 0.0 111.167 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.7 t -100.68 146.04 27.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.055 0.942 . . . . 0.0 112.565 164.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -62.2 -40.55 96.43 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.128 1.371 . . . . 0.0 113.499 -177.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.83 -19.81 19.31 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.985 1.105 . . . . 0.0 113.985 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -124.89 -2.34 7.77 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -167.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . 0.417 21.7 t . . . . . 0 CA--C 1.556 1.208 0 CA-C-O 115.165 -2.35 . . . . 0.0 114.745 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 . . . . . 0 CA--C 1.547 0.83 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -131.82 132.78 44.02 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.07 1.748 . . . . 0.0 110.954 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -78.56 -30.32 46.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.998 1.319 . . . . 0.0 113.465 -178.055 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -108.87 157.38 18.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.409 1.483 . . . . 0.0 114.098 -171.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.28 160.61 41.78 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.952 1.701 . . . . 0.0 111.472 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -70.81 134.17 86.05 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 124.112 0.965 . . . . 0.0 111.171 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -66.76 -28.46 43.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.853 2.369 . . . . 0.0 114.748 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -150.27 161.94 41.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.449 1.9 . . . . 0.0 112.126 -173.291 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.2 m -89.03 -5.97 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.481 1.112 . . . . 0.0 113.588 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.07 149.07 40.88 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.451 1.101 . . . . 0.0 111.8 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -63.42 175.29 2.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.937 3.091 . . . . 0.0 114.616 172.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 . . . . . 0 CA--C 1.548 0.866 0 C-N-CA 125.382 1.473 . . . . 0.0 113.935 173.499 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t . . . . . 0 CA--C 1.551 1.016 0 CA-C-O 120.763 0.316 . . . . 0.0 111.563 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -141.0 -23.27 0.77 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.932 1.693 . . . . 0.0 114.471 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -114.36 172.94 6.71 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.899 2.08 . . . . 0.0 111.827 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.326 14.5 p 51.65 12.36 0.17 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 128.809 2.844 . . . . 0.0 118.6 170.776 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 163.6 -165.79 36.99 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.45 1.5 . . . . 0.0 112.942 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -72.86 149.58 43.22 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 123.938 0.78 . . . . 0.0 112.823 172.544 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -62.43 -15.49 49.73 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -170.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -78.9 -22.0 67.1 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 118.563 -1.132 . . . . 0.0 115.83 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -79.67 134.74 36.43 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.13 1.965 . . . . 0.0 114.761 -162.127 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 31.62 36.25 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 130.378 3.471 . . . . 0.0 117.388 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.76 -17.67 43.13 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.859 1.219 . . . . 0.0 115.153 -170.403 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -63.39 -35.24 79.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.247 1.819 . . . . 0.0 113.799 172.701 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -131.51 -12.38 3.47 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.822 1.649 . . . . 0.0 113.816 -170.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 26.8 t . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 124.474 1.11 . . . . 0.0 111.454 177.767 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.52 28.6 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 0.0 113.229 164.334 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.78 -39.34 0.99 Allowed 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 122.707 2.271 . . . . 0.0 114.988 -175.826 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? 58.37 -57.77 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 128.441 2.696 . . . . 0.0 116.283 -170.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -155.22 159.47 40.11 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.257 2.223 . . . . 0.0 111.525 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -72.99 -30.16 63.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -161.23 -42.2 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.208 1.403 . . . . 0.0 112.74 -172.206 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.4 -12.75 60.6 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -168.279 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m 54.31 26.34 6.78 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.956 1.836 . . . . 0.0 115.956 -173.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -98.12 161.32 13.77 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.041 1.336 . . . . 0.0 112.717 175.077 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -72.28 161.33 30.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.63 1.572 . . . . 0.0 113.882 -175.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.05 -71.4 2.62 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.177 1.37 . . . . 0.0 114.174 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.278 0.6 OUTLIER -83.51 77.46 9.82 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 123.15 1.452 . . . . 0.0 112.9 -172.371 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -60.6 -179.4 0.12 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.261 2.225 . . . . 0.0 113.498 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.7 -62.84 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 126.164 1.786 . . . . 0.0 114.062 -171.393 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -80.41 -2.75 46.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.62 1.968 . . . . 0.0 115.419 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.31 -17.9 13.89 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.746 1.618 . . . . 0.0 113.664 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.6 t -48.91 -48.66 71.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -172.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo . . . . . 0 CA--C 1.544 1.016 0 C-N-CA 122.461 2.108 . . . . 0.0 114.545 179.52 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.4 pt -81.56 152.03 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.556 1.143 . . . . 0.0 112.109 173.592 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.6 p -134.79 152.85 52.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.484 1.514 . . . . 0.0 111.109 174.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.71 20.82 1.2 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.584 1.554 . . . . 0.0 115.028 176.504 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.2 t80 47.87 34.31 3.89 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.863 2.065 . . . . 0.0 114.45 -169.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 p -93.56 2.38 56.41 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 115.143 1.535 . . . . 0.0 115.143 -172.284 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -157.63 167.31 34.09 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 123.833 0.73 . . . . 0.0 114.639 -177.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.09 135.15 34.52 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.807 0.843 . . . . 0.0 110.736 172.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -64.6 -14.63 58.71 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -85.76 -18.11 33.93 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.931 1.292 . . . . 0.0 114.275 176.46 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -140.76 -5.29 1.18 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 116.477 2.029 . . . . 0.0 116.477 -174.374 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -63.48 142.29 58.45 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.419 1.087 . . . . 0.0 112.288 174.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -136.08 111.77 9.38 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.289 1.435 . . . . 0.0 109.189 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 61.9 p -64.27 -20.59 66.16 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -168.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -69.14 -24.83 64.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.388 1.475 . . . . 0.0 112.973 173.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -132.83 -34.02 1.16 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 -167.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 m 60.78 166.51 0.09 OUTLIER Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 126.89 2.076 . . . . 0.0 114.059 -166.969 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -119.6 -170.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 122.495 2.13 . . . . 0.0 114.365 -155.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.96 66.64 0.91 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.817 2.047 . . . . 0.0 109.48 167.101 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.05 -36.64 2.33 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -163.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.3 mt -126.93 35.04 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 126.832 2.053 . . . . 0.0 108.453 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -145.57 154.76 42.52 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.287 3.035 . . . . 0.0 107.817 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 31.3 p -70.46 170.32 12.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 122.027 0.918 . . . . 0.0 112.237 167.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -70.21 134.65 48.28 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.724 -0.61 . . . . 0.0 111.04 165.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.318 19.4 ptpt 53.65 136.94 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 129.62 3.168 . . . . 0.0 115.463 -165.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . 0.298 0.5 OUTLIER 55.55 179.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 126.355 1.862 . . . . 0.0 114.874 -160.498 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -120.06 32.27 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.301 1.841 . . . . 0.0 114.854 -158.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -133.24 162.19 32.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.379 1.472 . . . . 0.0 112.136 -176.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.7 t -69.06 129.88 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.353 1.461 . . . . 0.0 112.42 -174.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.98 -169.13 7.61 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 124.703 1.144 . . . . 0.0 115.046 174.471 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.79 2.36 4.43 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 168.959 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -71.0 158.74 35.99 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.699 0.8 . . . . 0.0 111.802 173.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -64.26 149.96 46.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.664 0.786 . . . . 0.0 110.607 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 m 63.96 -18.61 0.07 Allowed 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 116.645 2.091 . . . . 0.0 116.645 -170.254 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -86.64 -47.13 9.44 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.476 1.11 . . . . 0.0 110.93 169.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 27.9 t . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 126.289 1.836 . . . . 0.0 110.86 176.785 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.4 t . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 121.101 0.476 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -66.23 -25.21 66.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.491 1.117 . . . . 0.0 113.398 -169.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 60.6 m -76.49 -3.14 35.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.586 1.554 . . . . 0.0 114.906 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 10.8 t 58.64 -42.45 0.06 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.865 3.266 . . . . 0.0 118.072 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 pp -104.87 -9.41 18.02 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.994 1.717 . . . . 0.0 114.333 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.4 t -74.07 138.9 44.29 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.403 0.62 . . . . 0.0 112.468 -172.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -155.19 142.26 19.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.509 1.924 . . . . 0.0 109.356 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.3 m 58.16 34.85 24.56 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt 54.86 34.8 22.85 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.332 1.853 . . . . 0.0 114.53 174.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -69.44 152.11 45.29 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.973 0.909 . . . . 0.0 111.342 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 49.77 6.84 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.827 2.451 . . . . 0.0 117.359 -173.851 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.0 m -80.4 -22.4 41.29 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -155.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -57.79 117.5 4.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.86 0.864 . . . . 0.0 111.433 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 55.76 20.9 4.31 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.093 1.757 . . . . 0.0 115.138 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -115.33 -44.14 3.01 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.096 1.758 . . . . 0.0 112.541 171.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m . . . . . 0 CA--C 1.553 1.093 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -176.957 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.4 t0 . . . . . 0 CA--C 1.546 0.809 0 CA-C-O 120.944 0.402 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 61.72 164.73 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.115 2.566 . . . . 0.0 114.409 -174.602 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 55.0 32.18 17.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.765 2.026 . . . . 0.0 113.63 -175.323 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -111.94 -3.79 14.73 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.31 1.844 . . . . 0.0 114.816 -171.228 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.9 149.6 48.71 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -171.048 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -139.49 152.56 69.2 Favored Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 127.15 2.18 . . . . 0.0 110.668 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -68.68 -29.09 30.13 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 122.983 2.456 . . . . 0.0 113.073 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.274 60.8 pttt 52.52 174.9 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.773 3.229 . . . . 0.0 117.459 173.733 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -151.51 158.22 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 127.204 2.201 . . . . 0.0 109.556 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.38 109.19 62.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 124.734 1.214 . . . . 0.0 109.926 174.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -71.09 -12.42 30.31 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.5 2.8 . . . . 0.0 114.83 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 50.4 t80 . . . . . 0 CA--C 1.548 0.897 0 C-N-CA 125.414 1.486 . . . . 0.0 113.591 -178.281 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 13.6 t . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -76.11 145.08 40.27 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.287 171.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.3 t30 63.21 -53.32 0.19 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.863 2.465 . . . . 0.0 115.341 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 93.7 m -69.85 134.56 48.61 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.222 1.809 . . . . 0.0 112.874 -174.012 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -72.16 -14.54 76.53 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 123.849 0.738 . . . . 0.0 114.279 172.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.07 -11.69 79.12 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 125.132 1.349 . . . . 0.0 116.068 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt 43.67 -85.22 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.795 2.838 . . . . 0.0 116.166 169.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -73.57 7.03 14.28 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 126.203 1.858 . . . . 0.0 116.546 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -158.07 0.08 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 119.072 1.436 . . . . 0.0 112.442 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -61.42 20.48 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.824 2.049 . . . . 0.0 115.056 169.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.14 -16.5 26.66 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 127.635 2.541 . . . . 0.0 116.378 -170.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.37 -35.79 71.22 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.195 1.398 . . . . 0.0 113.373 172.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -117.94 -16.97 9.84 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.936 2.094 . . . . 0.0 113.193 -167.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 21.2 p . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -169.561 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.582 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.66 21.31 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 123.966 0.906 . . . . 0.0 112.98 165.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -79.55 -35.23 0.84 Allowed 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 122.304 2.003 . . . . 0.0 113.942 -178.326 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt 48.04 -166.19 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.211 1.005 . . . . 0.0 111.431 -151.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.9 m -57.93 158.09 7.0 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 120.513 -1.367 . . . . 0.0 111.926 163.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.405 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 42.7 t30 -66.38 97.0 0.39 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.185 -0.947 . . . . 0.0 110.032 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 61.28 -33.86 0.09 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.529 2.732 . . . . 0.0 117.543 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.8 p -81.54 -2.6 50.5 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -172.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.4 p 49.34 0.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 120.003 3.334 . . . . 0.0 120.003 170.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -118.84 125.75 50.25 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.643 1.565 . . . . 0.0 113.695 -169.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.263 39.6 ptt180 50.22 122.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 130.983 3.713 . . . . 0.0 118.744 167.72 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 66.85 -143.82 44.16 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 124.148 0.88 . . . . 0.0 114.107 173.66 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -6.3 97.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 129.318 3.047 . . . . 0.0 117.609 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -62.33 -176.64 0.11 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.23 1.412 . . . . 0.0 114.187 170.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -39.3 -67.47 0.22 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.404 1.882 . . . . 0.0 114.377 -174.154 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -74.55 -1.13 20.08 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.807 1.643 . . . . 0.0 115.111 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -98.69 -33.21 11.03 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.665 1.586 . . . . 0.0 111.886 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.6 m -46.63 -39.98 18.03 Favored Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo . . . . . 0 CA--C 1.544 0.993 0 CA-C-N 122.372 1.883 . . . . 0.0 115.37 -178.923 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.0 pp . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.2 pt -83.53 122.77 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.578 1.151 . . . . 0.0 111.434 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 p -84.5 143.52 29.3 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.309 0.644 . . . . 0.0 111.054 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.7 p 44.35 23.25 0.06 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 127.306 2.242 . . . . 0.0 116.752 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 50.18 32.82 6.39 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 126.135 1.774 . . . . 0.0 114.724 -171.666 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 p -79.32 -25.9 42.28 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.425 -1.422 . . . . 0.0 113.766 -173.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.32 172.35 18.71 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.854 1.692 . . . . 0.0 111.879 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.52 148.28 29.26 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.531 0.732 . . . . 0.0 110.99 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 t -66.02 -17.8 64.92 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.006 -1.059 . . . . 0.0 113.723 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.21 -4.53 29.29 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.202 1.401 . . . . 0.0 113.882 172.135 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -153.62 89.84 1.36 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 0.0 111.291 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -155.33 126.23 7.04 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.467 1.507 . . . . 0.0 109.426 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -149.7 152.9 36.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.473 0.709 . . . . 0.0 112.818 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.6 m -63.88 -26.35 68.57 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -168.802 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -103.21 145.81 29.36 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.816 0.847 . . . . 0.0 110.507 156.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.5 m170 67.46 -12.93 0.25 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.328 2.251 . . . . 0.0 116.48 -173.456 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.491 ' HB3' ' HD3' ' A' ' 40' ' ' PRO 0.313 2.8 t 21.56 -75.6 0.0 OUTLIER Pre-proline 0 CA--C 1.56 1.351 0 C-N-CA 129.841 3.256 . . . . 0.0 118.409 152.809 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 68.1 Cg_endo -79.47 -9.07 14.96 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.872 3.048 . . . . 0.0 116.555 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -86.04 22.63 1.68 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.499 1.52 . . . . 0.0 114.921 -166.848 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.62 0.14 9.82 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 38.4 mm -101.33 39.87 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 125.009 1.324 . . . . 0.0 109.559 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -151.46 160.33 43.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.237 1.415 . . . . 0.0 112.176 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 38.6 t -102.82 166.99 10.15 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.797 1.639 . . . . 0.0 110.602 170.28 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.7 m -50.97 135.01 25.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.328 1.051 . . . . 0.0 112.413 170.282 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.302 22.2 ptmt 47.74 22.36 0.34 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.127 2.171 . . . . 0.0 116.13 -170.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 58.0 m -118.61 154.82 32.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.226 1.811 . . . . 0.0 110.54 172.577 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -102.61 -6.05 23.19 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.762 1.225 . . . . 0.0 113.774 171.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -138.58 178.83 6.85 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.346 2.258 . . . . 0.0 109.187 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.8 m -75.54 58.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 120.423 -1.423 . . . . 0.0 110.686 165.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.76 -5.9 88.98 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 118.534 2.174 . . . . 0.0 118.534 -147.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -147.67 160.48 42.64 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.851 1.825 . . . . 0.0 112.4 177.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 38.1 t80 57.02 116.37 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.658 2.383 . . . . 0.0 115.459 -176.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 48.65 22.84 0.56 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 126.632 1.973 . . . . 0.0 114.329 -175.152 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.1 m 51.6 30.28 6.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 114.962 -170.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -143.17 -17.36 0.65 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.039 1.335 . . . . 0.0 113.887 -170.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 60.7 m . . . . . 0 CA--C 1.557 1.231 0 C-N-CA 124.43 1.092 . . . . 0.0 110.622 -161.995 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.304 7.5 p . . . . . 0 N--CA 1.488 1.427 0 N-CA-C 116.189 1.922 . . . . 0.0 116.189 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -69.66 -4.51 19.78 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.485 -1.384 . . . . 0.0 114.728 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.1 m -146.72 131.52 18.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.728 1.611 . . . . 0.0 111.974 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.6 t -52.22 -34.53 46.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.996 0.918 . . . . 0.0 112.924 163.325 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.91 -18.41 65.37 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.275 1.43 . . . . 0.0 114.66 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 55.8 m -88.48 6.73 36.32 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -50.97 109.28 0.31 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.902 1.281 . . . . 0.0 110.284 163.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.6 m 55.44 21.96 4.68 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -152.28 142.99 22.87 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.137 1.775 . . . . 0.0 110.667 -178.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.1 ttmm -128.01 134.88 49.28 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.585 1.154 . . . . 0.0 112.138 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.12 15.18 2.83 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.683 1.593 . . . . 0.0 113.548 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.9 m -66.75 -32.78 74.3 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -151.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -65.14 -23.68 67.19 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.152 0.981 . . . . 0.0 113.339 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -100.06 -17.53 17.43 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.044 1.338 . . . . 0.0 113.964 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -133.87 -36.28 0.94 Allowed 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -167.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m . . . . . 0 CA--C 1.543 0.698 0 CA-C-N 119.716 1.143 . . . . 0.0 112.342 -169.406 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -116.83 7.69 13.41 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.885 1.274 . . . . 0.0 114.317 -171.39 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -136.21 148.26 48.02 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.101 1.36 . . . . 0.0 111.524 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -135.67 143.99 45.76 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.742 2.017 . . . . 0.0 112.224 -172.106 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -92.47 161.01 14.8 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.511 1.124 . . . . 0.0 111.71 169.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -132.96 59.27 41.53 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 125.009 1.324 . . . . 0.0 112.905 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -71.31 144.82 46.89 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.09 2.527 . . . . 0.0 112.483 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -153.06 150.12 28.82 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.214 1.806 . . . . 0.0 111.163 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 44.4 t -131.86 136.35 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.472 1.509 . . . . 0.0 110.374 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.5 mt -132.81 94.64 20.9 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 125.994 1.717 . . . . 0.0 109.855 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -65.62 140.38 62.18 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 123.476 2.784 . . . . 0.0 114.563 -174.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 23.0 t80 . . . . . 0 CA--C 1.545 0.775 0 C-N-CA 125.826 1.65 . . . . 0.0 111.436 174.174 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 34.7 t . . . . . 0 CA--C 1.548 0.892 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -154.85 -16.96 0.12 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.6 m-20 -67.69 -18.4 64.91 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -172.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 19.1 p -134.12 32.32 3.46 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.843 1.257 . . . . 0.0 114.383 -173.813 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 81.55 16.06 74.39 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.699 1.44 . . . . 0.0 116.699 164.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -154.87 151.31 22.96 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.96 1.267 . . . . 0.0 112.026 176.44 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.18 -35.61 5.84 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 -168.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.58 11.96 50.48 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -171.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.267 1.2 p80 -99.89 -137.05 0.31 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.911 1.356 . . . . 0.0 114.078 -168.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -74.34 35.7 0.1 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 127.669 2.388 . . . . 0.0 113.139 -169.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.0 -18.35 8.79 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 128.05 2.738 . . . . 0.0 115.79 -172.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.21 -40.51 94.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.529 1.532 . . . . 0.0 113.304 170.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -130.51 -22.73 2.69 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -165.711 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 16.2 p . . . . . 0 CA--C 1.55 0.944 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -165.921 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.64 -46.54 60.79 Favored Pre-proline 0 CA--C 1.554 1.117 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 168.099 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -79.25 -42.37 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.931 0 C-N-CA 122.262 1.975 . . . . 0.0 114.093 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? 57.69 -56.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.923 2.889 . . . . 0.0 116.285 -171.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.8 t -156.96 160.02 38.65 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.58 2.352 . . . . 0.0 110.925 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -72.64 -24.57 61.07 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.026 -1.047 . . . . 0.0 113.703 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -159.28 -37.65 0.06 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.256 1.423 . . . . 0.0 112.978 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.9 m -77.3 -163.88 0.42 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.59 1.156 . . . . 0.0 111.489 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 78.2 p -136.73 19.31 3.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -115.56 143.57 45.13 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.318 1.047 . . . . 0.0 112.47 172.016 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ptt85 -78.69 -3.18 42.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.43 -20.82 71.98 Favored Glycine 0 CA--C 1.537 1.463 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -176.4 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.43 89.72 1.52 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.846 1.258 . . . . 0.0 112.14 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -60.96 -179.55 0.14 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.884 1.674 . . . . 0.0 113.445 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.31 -65.08 0.37 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 126.354 1.862 . . . . 0.0 114.675 -171.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ptmm? -76.21 -9.7 58.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 126.329 1.852 . . . . 0.0 115.303 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.17 -20.48 17.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.263 1.425 . . . . 0.0 112.723 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -66.0 -51.06 49.01 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 124.644 1.178 . . . . 0.0 113.835 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo . . . . . 0 C--N 1.353 0.773 0 C-N-CA 122.282 1.988 . . . . 0.0 112.481 174.532 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 CA--C 1.546 0.82 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.5 pt -73.14 161.66 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 126.631 1.972 . . . . 0.0 112.908 172.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 59.5 m -77.77 7.05 6.3 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m 64.24 130.64 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.453 2.301 . . . . 0.0 114.57 -164.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 52.18 25.76 3.5 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.707 1.603 . . . . 0.0 114.261 -172.288 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.2 t -153.93 113.01 3.71 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.444 1.897 . . . . 0.0 108.6 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.55 174.19 45.89 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.917 1.246 . . . . 0.0 115.441 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.67 139.11 47.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.342 1.457 . . . . 0.0 109.55 166.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.5 t -64.01 -22.93 67.14 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -89.07 -14.19 36.93 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -151.01 95.07 2.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.386 1.475 . . . . 0.0 111.707 -172.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -155.47 134.67 12.28 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.261 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -158.12 160.96 37.87 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.342 1.457 . . . . 0.0 110.6 172.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -58.47 -28.63 65.52 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.063 1.745 . . . . 0.0 115.055 -175.254 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -72.6 -24.89 61.15 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.794 1.238 . . . . 0.0 113.367 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -122.05 -0.58 9.45 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.524 1.529 . . . . 0.0 114.414 -171.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -25.03 -60.06 0.14 Allowed Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 129.034 2.934 . . . . 0.0 117.665 -177.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -80.49 54.51 5.26 Favored 'Trans proline' 0 CA--C 1.55 1.291 0 C-N-CA 123.571 2.847 . . . . 0.0 114.298 -168.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.41 171.53 8.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.608 1.963 . . . . 0.0 113.533 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.67 -60.89 0.17 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 128.565 2.746 . . . . 0.0 116.622 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.2 mt -106.93 49.2 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 123.245 1.498 . . . . 0.0 110.261 -164.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.0 mm-40 -148.19 165.15 31.77 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.939 2.496 . . . . 0.0 109.725 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 10.6 p -126.0 124.38 40.58 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.529 1.132 . . . . 0.0 111.405 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.4 p -71.32 -16.12 62.43 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -165.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -93.05 -13.02 29.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.578 1.151 . . . . 0.0 113.269 176.663 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.3 t -143.3 -20.79 0.62 Allowed 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -157.365 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 60.58 141.5 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 128.114 2.566 . . . . 0.0 114.666 -162.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.284 10.5 pt-20 46.54 126.23 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 131.298 3.839 . . . . 0.0 119.225 -175.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.47 -12.15 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 119.08 -2.262 . . . . 0.0 112.04 163.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.43 4.94 3.37 Favored Glycine 0 CA--C 1.541 1.715 0 C-N-CA 126.43 1.967 . . . . 0.0 116.986 -177.23 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.26 169.87 14.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.732 1.613 . . . . 0.0 112.075 173.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 53.42 88.21 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.055 1.742 . . . . 0.0 112.926 -172.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 53.64 26.05 5.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 126.349 1.86 . . . . 0.0 114.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.6 m 55.12 23.04 4.96 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.645 1.578 . . . . 0.0 114.733 -172.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -141.35 -17.05 0.81 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.288 1.435 . . . . 0.0 114.022 -169.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 35.4 m . . . . . 0 CA--C 1.555 1.141 0 C-N-CA 125.827 1.651 . . . . 0.0 114.09 -154.789 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.4 m . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 pp0? -68.17 -19.65 64.81 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -168.097 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.8 m -76.13 -20.23 57.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 172.727 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 61.47 -28.47 0.06 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.105 2.162 . . . . 0.0 115.155 -156.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 44.7 mt -89.72 -15.82 31.69 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.397 1.879 . . . . 0.0 114.533 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -176.25 2.47 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -174.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.7 tptt 66.7 -24.59 0.11 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 128.217 2.607 . . . . 0.0 115.177 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.8 t -73.59 150.9 41.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.815 1.246 . . . . 0.0 113.312 168.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -70.23 -22.44 62.9 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.612 1.965 . . . . 0.0 114.178 177.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -75.95 -44.1 41.62 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.345 1.058 . . . . 0.0 113.136 -175.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -77.05 -42.95 36.32 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -165.531 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.1 m -76.42 -11.59 59.91 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.184 1.92 . . . . 0.0 116.184 -158.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -51.52 124.7 12.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.292 1.437 . . . . 0.0 112.029 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . 0.285 10.0 pt-20 49.97 4.6 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 128.909 2.884 . . . . 0.0 118.486 -178.065 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -124.58 -24.23 4.24 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.198 1.399 . . . . 0.0 114.605 -177.005 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 86.5 m . . . . . 0 CA--C 1.549 0.918 0 C-N-CA 124.921 1.288 . . . . 0.0 112.007 168.232 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -79.98 151.36 30.07 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.553 1.141 . . . . 0.0 112.251 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -138.5 139.82 38.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.409 1.484 . . . . 0.0 111.716 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -108.58 150.12 27.94 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.817 1.647 . . . . 0.0 110.85 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -101.5 -16.18 16.89 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -82.34 137.64 45.38 Favored Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 124.023 0.929 . . . . 0.0 111.204 176.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.32 160.35 50.19 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.871 2.381 . . . . 0.0 113.081 173.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -85.02 -26.53 27.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.179 1.791 . . . . 0.0 112.949 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.7 t -124.46 145.53 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.997 1.719 . . . . 0.0 110.543 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -120.05 164.76 20.58 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 126.053 1.741 . . . . 0.0 111.739 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -58.28 156.48 30.12 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.821 3.014 . . . . 0.0 115.787 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 . . . . . 0 CA--C 1.542 0.659 0 C-N-CA 125.768 1.627 . . . . 0.0 112.799 -179.446 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 CA--C 1.549 0.924 0 CA-C-O 121.762 0.791 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -61.49 -9.3 5.45 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -176.206 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -64.96 -22.06 66.94 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.398 1.079 . . . . 0.0 113.119 170.196 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 95.6 m -105.95 176.03 5.3 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.972 2.109 . . . . 0.0 112.354 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.05 -7.76 38.98 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 124.937 1.256 . . . . 0.0 115.712 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -159.54 154.13 25.18 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.427 1.489 . . . . 0.0 112.47 172.735 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -86.16 -22.08 27.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -77.99 33.16 1.71 Allowed Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.825 1.679 . . . . 0.0 117.149 -163.722 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.99 151.17 31.7 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.827 1.314 . . . . 0.0 113.108 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 44.39 28.74 0.32 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.359 2.264 . . . . 0.0 116.905 154.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.93 -18.45 59.88 Favored Glycine 0 CA--C 1.536 1.348 0 O-C-N 121.017 -1.052 . . . . 0.0 114.898 -167.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.32 -46.42 41.09 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.37 1.468 . . . . 0.0 113.483 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -111.44 -20.85 12.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.764 1.626 . . . . 0.0 114.463 -162.14 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -170.721 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.698 0 CA-C-O 121.269 0.557 . . . . 0.0 112.221 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.97 -51.64 79.17 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 171.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.75 -35.44 0.53 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.482 2.122 . . . . 0.0 113.993 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.401 0.0 OUTLIER 51.87 -53.64 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 130.138 3.375 . . . . 0.0 117.482 -168.608 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 16' ' ' LEU . 4.5 m -163.56 165.82 23.17 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 131.564 3.946 . . . . 0.0 109.623 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -72.84 -94.8 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.901 -1.125 . . . . 0.0 112.502 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -90.22 -22.3 21.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.527 1.131 . . . . 0.0 111.476 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -67.17 166.77 13.39 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.713 1.605 . . . . 0.0 110.792 165.032 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.5 p -134.52 15.56 3.71 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -165.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -84.14 164.28 19.27 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.693 0.797 . . . . 0.0 112.312 174.336 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.6 mtt-85 -91.67 111.82 23.49 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 170.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.25 152.33 16.34 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.522 1.534 . . . . 0.0 112.586 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.363 13.3 p-80 51.53 62.87 2.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-O 123.438 1.589 . . . . 0.0 111.644 -161.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.531 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.13 -170.42 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.387 1.875 . . . . 0.0 114.391 -175.407 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -34.94 -64.75 0.25 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.504 1.922 . . . . 0.0 114.522 -169.689 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -74.68 -11.17 60.11 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.151 1.78 . . . . 0.0 115.437 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -99.98 -13.63 19.01 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.376 1.87 . . . . 0.0 113.635 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.9 m -65.1 167.32 10.05 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.74 1.216 . . . . 0.0 112.274 159.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 CA--C 1.54 0.815 0 C-N-CA 124.147 3.231 . . . . 0.0 114.759 176.586 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.8 pp . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.1 mt -68.76 127.23 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.121 1.369 . . . . 0.0 110.331 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.0 p -62.43 128.37 35.7 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 121.897 0.856 . . . . 0.0 112.204 -175.119 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.9 m 51.32 14.56 0.24 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.3 t80 45.65 35.89 2.37 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.777 1.631 . . . . 0.0 113.359 -166.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 p -86.5 -14.44 43.07 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.96 -173.0 18.55 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 114.977 0.751 . . . . 0.0 114.977 -174.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.0 -176.89 1.2 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.956 0.902 . . . . 0.0 111.731 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -119.69 -40.86 2.72 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 173.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -79.61 -24.84 41.69 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.3 p30 -133.39 32.96 3.6 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.304 1.842 . . . . 0.0 112.652 174.937 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 23.1 t-160 -46.42 -55.14 7.84 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.48 2.712 . . . . 0.0 115.427 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.23 -43.58 56.5 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 m -70.12 -16.71 63.15 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -167.136 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -77.72 22.78 0.25 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.682 1.593 . . . . 0.0 113.289 172.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.8 m80 50.99 58.2 5.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.83 1.252 . . . . 0.0 111.258 -163.139 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.348 32.2 t 34.38 -90.75 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 129.379 3.072 . . . . 0.0 115.93 176.74 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 97.0 Cg_endo -73.13 -5.72 17.67 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 123.327 2.685 . . . . 0.0 115.768 -175.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -90.5 36.05 0.88 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.471 1.508 . . . . 0.0 113.536 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -131.14 -13.71 3.49 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 117.188 2.292 . . . . 0.0 117.188 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.1 mm -120.18 45.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-N 120.49 1.496 . . . . 0.0 110.473 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.76 158.29 43.96 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 120.65 -1.281 . . . . 0.0 112.888 166.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 43.4 t -55.02 155.77 4.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.143 2.177 . . . . 0.0 112.064 169.39 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -62.22 -28.47 69.71 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.621 -1.3 . . . . 0.0 114.423 -174.633 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -131.74 4.11 4.19 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.74 1.616 . . . . 0.0 113.987 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 m -135.3 158.82 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.094 1.358 . . . . 0.0 111.333 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -88.56 0.19 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -160.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -122.49 153.08 39.63 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.954 -1.091 . . . . 0.0 113.375 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.6 t -6.32 -60.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.241 1 C-N-CA 132.581 4.352 . . . . 0.0 119.021 -167.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.03 165.26 32.61 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 124.872 1.225 . . . . 0.0 112.238 -169.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -79.62 9.48 4.96 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 116.717 2.118 . . . . 0.0 116.717 -159.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -61.27 151.34 32.08 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.503 -1.373 . . . . 0.0 112.301 174.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -0.02 1.48 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -175.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.8 p -127.47 3.63 6.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.368 1.867 . . . . 0.0 113.289 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -119.4 -27.23 5.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.266 1.826 . . . . 0.0 112.733 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 19.8 t . . . . . 0 CA--C 1.555 1.157 0 C-N-CA 125.932 1.693 . . . . 0.0 111.569 169.503 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.293 2.2 p . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 54.36 0.85 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.54 2.336 . . . . 0.0 116.264 -170.543 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.3 m -145.02 144.8 31.2 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.61 1.096 . . . . 0.0 112.662 -169.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.0 t -77.65 -24.62 49.38 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.674 0.79 . . . . 0.0 113.124 161.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.9 mt -74.55 -15.74 60.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.906 1.283 . . . . 0.0 113.966 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 87.4 m -112.51 159.39 18.83 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.671 1.189 . . . . 0.0 112.866 -169.171 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -126.27 154.09 43.87 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.086 1.754 . . . . 0.0 110.368 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 p -51.93 137.01 27.58 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.379 1.071 . . . . 0.0 112.483 176.584 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.304 8.8 ptpp? 48.23 20.23 0.26 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 127.978 2.511 . . . . 0.0 116.775 -171.717 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -133.59 30.95 3.75 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.894 2.078 . . . . 0.0 112.698 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -73.22 171.94 12.05 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.876 0.87 . . . . 0.0 112.809 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.2 m 66.59 -7.04 0.46 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 127.989 2.516 . . . . 0.0 117.532 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -53.66 151.21 6.29 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.587 1.555 . . . . 0.0 112.25 171.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 51.85 37.83 21.73 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.301 1.44 . . . . 0.0 113.135 -174.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? 53.44 62.59 2.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.761 2.025 . . . . 0.0 112.256 -177.238 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.561 1.377 0 C-N-CA 125.762 1.625 . . . . 0.0 114.322 177.674 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 51.9 30.41 7.14 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.372 1.869 . . . . 0.0 114.726 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -144.27 152.11 40.34 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.068 1.747 . . . . 0.0 111.146 -175.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -143.68 153.5 42.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.439 1.896 . . . . 0.0 112.915 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.38 -15.04 56.46 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.88 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -106.92 126.58 29.88 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 124.924 1.289 . . . . 0.0 112.215 -174.634 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -80.41 166.71 19.91 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.646 2.897 . . . . 0.0 112.583 173.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -138.69 125.23 20.64 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.653 1.581 . . . . 0.0 109.863 167.411 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.0 t -104.01 -35.74 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -162.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.1 tp -143.68 127.57 9.21 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.782 1.233 . . . . 0.0 110.757 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -91.2 -13.92 1.87 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.118 2.546 . . . . 0.0 114.415 -177.362 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 41.9 t80 . . . . . 0 N--CA 1.472 0.637 0 C-N-CA 125.028 1.331 . . . . 0.0 112.855 -171.741 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.9 m . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -77.35 -10.21 59.31 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 120.847 -1.158 . . . . 0.0 113.803 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -110.32 -20.63 12.56 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.0 p -154.79 164.89 38.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.239 1.016 . . . . 0.0 113.087 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -67.92 123.3 18.22 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.013 0.815 . . . . 0.0 113.994 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.78 142.26 1.08 Allowed Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.746 1.641 . . . . 0.0 114.514 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -80.28 56.38 2.47 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.935 1.694 . . . . 0.0 112.614 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -76.11 -12.38 84.13 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.177 1.37 . . . . 0.0 116.434 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 34.8 p-80 -144.6 -161.29 1.26 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.028 1.414 . . . . 0.0 112.452 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -70.24 44.37 0.07 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.427 2.291 . . . . 0.0 113.023 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -43.84 -19.67 0.12 Allowed Glycine 0 CA--C 1.532 1.094 1 C-N-CA 131.359 4.314 . . . . 0.0 118.452 -170.161 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.78 -38.81 89.45 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.401 1.601 . . . . 0.0 112.352 169.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -112.44 -14.14 13.29 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.648 1.979 . . . . 0.0 113.007 171.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.543 0.695 0 C-N-CA 127.357 2.263 . . . . 0.0 114.78 166.145 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 120.866 0.365 . . . . 0.0 111.731 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.96 -52.18 1.61 Allowed Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.328 1.051 . . . . 0.0 112.947 165.202 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.14 -36.49 1.88 Allowed 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.763 2.308 . . . . 0.0 114.556 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 60.92 -64.84 0.06 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 127.91 2.484 . . . . 0.0 114.368 -169.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.5 t -159.55 161.29 35.21 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 128.416 2.686 . . . . 0.0 110.368 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -68.26 -35.45 77.91 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.063 -1.023 . . . . 0.0 112.933 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -145.4 -62.83 0.34 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 p -87.76 95.94 10.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.601 1.161 . . . . 0.0 111.934 -176.351 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.0 p -71.66 63.53 0.43 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 128.373 2.669 . . . . 0.0 115.887 -168.157 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 pp0? -121.09 148.16 44.55 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 127.376 2.27 . . . . 0.0 110.545 165.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.8 mtm180 -73.07 136.26 44.94 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.639 0.776 . . . . 0.0 111.727 -172.786 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 147.07 -37.67 1.15 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.798 1.19 . . . . 0.0 113.79 176.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -139.72 101.06 4.11 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.179 0.991 . . . . 0.0 112.992 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.86 -178.69 0.33 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.557 1.143 . . . . 0.0 112.938 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.83 -66.21 0.35 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.945 1.698 . . . . 0.0 113.802 -171.706 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -74.34 -11.1 60.16 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.865 1.431 . . . . 0.0 114.865 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -85.64 -26.76 25.83 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.347 1.059 . . . . 0.0 112.263 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.2 t -59.1 -42.34 93.06 Favored Pre-proline 0 CA--C 1.557 1.235 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo . . . . . 0 C--N 1.357 0.988 0 C-N-CA 122.442 2.095 . . . . 0.0 114.389 -173.369 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.4 pp . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 mt -113.86 145.36 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.163 1.385 . . . . 0.0 111.595 -170.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.7 t -43.22 117.47 1.11 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.853 2.061 . . . . 0.0 114.136 -174.22 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.7 m 51.58 20.34 1.04 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.661 1.984 . . . . 0.0 116.245 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.9 t80 52.15 26.38 3.85 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 125.298 1.439 . . . . 0.0 113.789 -167.709 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.4 p -115.48 -25.86 7.76 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.945 1.698 . . . . 0.0 113.627 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -96.99 155.5 20.74 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.688 1.613 . . . . 0.0 113.779 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -109.92 142.54 41.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.437 1.095 . . . . 0.0 110.849 166.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -59.62 -26.18 65.26 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.413 1.485 . . . . 0.0 114.875 -168.587 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.16 1.27 28.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -140.91 -13.59 0.94 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 115.931 1.826 . . . . 0.0 115.931 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -64.24 138.57 58.5 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.868 -1.145 . . . . 0.0 113.409 -176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.46 133.75 46.56 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.799 1.639 . . . . 0.0 110.227 171.375 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.9 t -58.67 -29.68 66.77 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 171.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -62.93 -25.19 68.22 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.627 1.571 . . . . 0.0 114.087 174.639 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -131.64 -16.29 3.01 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -165.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.53 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.346 2.1 m 41.22 -98.18 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 128.057 2.543 . . . . 0.0 115.927 178.59 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.53 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 19.9 Cg_exo -77.33 -3.38 13.61 Favored 'Trans proline' 0 C--N 1.36 1.146 0 CA-C-N 123.544 2.301 . . . . 0.0 117.626 -155.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.75 -3.96 2.75 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -171.653 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.3 -23.38 17.23 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.031 1.332 . . . . 0.0 114.148 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.5 mt -128.51 -15.75 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.266 1.427 . . . . 0.0 112.623 -176.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -128.81 173.28 10.5 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.725 -1.234 . . . . 0.0 111.625 155.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 28.0 p -117.3 -176.67 3.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.51 1.524 . . . . 0.0 110.392 167.439 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.1 p -75.99 -17.93 59.5 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -176.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -96.1 -31.81 12.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.571 1.148 . . . . 0.0 113.768 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -156.09 167.56 30.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.795 1.238 . . . . 0.0 112.263 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.96 18.38 0.18 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.378 1.871 . . . . 0.0 114.853 -169.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -132.09 158.12 42.42 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.86 1.664 . . . . 0.0 112.359 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.99 121.75 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 125.032 1.333 . . . . 0.0 113.465 -165.972 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 54.44 -150.77 15.58 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 124.786 1.184 . . . . 0.0 115.776 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.3 m80 -139.46 10.37 2.5 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.096 1.358 . . . . 0.0 113.705 170.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -72.09 148.98 45.22 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.129 -0.982 . . . . 0.0 112.146 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.0 tpt85 -60.68 -23.21 64.65 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.715 1.606 . . . . 0.0 114.266 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -90.92 -8.09 50.32 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.287 1.835 . . . . 0.0 114.45 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -119.61 -42.14 2.65 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.966 1.306 . . . . 0.0 113.944 -171.716 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 CA--C 1.543 0.687 0 C-N-CA 123.891 0.876 . . . . 0.0 112.211 -171.785 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -92.08 -12.27 33.5 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.4 m -87.15 99.91 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.428 0.691 . . . . 0.0 112.451 -172.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.4 p 33.23 -79.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 117.483 2.401 . . . . 0.0 117.483 136.151 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 pp -109.65 -10.03 14.84 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.63 2.772 . . . . 0.0 114.729 -170.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.26 161.39 26.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.423 1.089 . . . . 0.0 113.1 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -125.73 148.31 49.1 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.157 1.783 . . . . 0.0 109.662 171.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.8 p -58.33 137.22 57.35 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.476 1.511 . . . . 0.0 112.197 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.4 tttt 53.45 23.55 3.47 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.294 1.837 . . . . 0.0 114.798 -174.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -132.14 12.07 4.65 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.19 1.396 . . . . 0.0 114.386 -175.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -147.83 171.1 16.25 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.904 0.882 . . . . 0.0 111.966 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.9 t -129.26 153.6 47.63 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 79' ' ' ARG . 56.7 mtmt -66.33 -4.23 7.56 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.851 2.06 . . . . 0.0 114.046 165.237 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -66.99 43.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 126.54 1.936 . . . . 0.0 111.676 155.552 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' ARG . . . . . 0.438 ' H ' ' C ' ' A' ' 77' ' ' LYS . 62.9 mmt-85 48.94 50.4 17.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 129.829 3.252 . . . . 0.0 115.423 175.575 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m . . . . . 0 CA--C 1.556 1.193 0 C-N-CA 126.118 1.767 . . . . 0.0 115.602 166.663 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -123.04 157.43 32.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.142 1.377 . . . . 0.0 112.944 -173.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 60.96 161.47 0.06 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.776 2.431 . . . . 0.0 116.305 -177.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -129.19 161.3 30.45 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.597 2.359 . . . . 0.0 110.574 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -136.01 152.91 51.41 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.316 1.046 . . . . 0.0 113.182 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.49 158.6 60.12 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.594 2.358 . . . . 0.0 110.435 170.247 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.45 154.58 58.11 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.129 2.553 . . . . 0.0 114.103 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -87.44 22.49 2.16 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.804 1.642 . . . . 0.0 113.105 174.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -149.85 150.61 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 127.218 2.207 . . . . 0.0 110.008 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -130.16 146.31 61.0 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.252 1.421 . . . . 0.0 111.214 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.03 -13.72 19.24 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.81 3.007 . . . . 0.0 114.127 -176.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 31.9 t80 . . . . . 0 CA--C 1.547 0.838 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -172.913 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 120.954 0.407 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -137.46 11.54 2.98 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.898 1.279 . . . . 0.0 112.925 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -142.88 158.18 43.87 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.415 1.886 . . . . 0.0 110.157 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 p 52.64 -5.4 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 119.684 3.216 . . . . 0.0 119.684 173.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.68 -167.94 39.66 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.29 1.424 . . . . 0.0 114.002 -178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.77 161.78 48.79 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.648 1.118 . . . . 0.0 113.954 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -65.28 -19.0 65.76 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -166.409 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.27 -37.22 15.45 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 116.293 1.277 . . . . 0.0 116.293 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.28 141.77 30.71 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.382 1.591 . . . . 0.0 115.016 -164.747 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 37.71 31.78 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 129.486 3.114 . . . . 0.0 117.17 164.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.54 -11.41 41.51 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.302 1.43 . . . . 0.0 115.441 -165.132 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.16 -35.27 73.88 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.671 1.588 . . . . 0.0 113.747 173.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -143.99 -27.54 0.53 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -159.522 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.0 p . . . . . 0 N--CA 1.475 0.775 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -175.744 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -45.64 -47.44 38.15 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 173.186 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 -40.36 0.33 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 122.056 1.838 . . . . 0.0 114.067 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm 40.63 -158.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.693 1.197 . . . . 0.0 111.773 -146.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.1 t -59.77 157.7 11.69 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.408 -1.433 . . . . 0.0 112.834 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -63.58 -35.8 81.68 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.272 -0.892 . . . . 0.0 111.763 168.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -150.15 -48.08 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -166.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 55.6 m -70.25 -40.24 74.52 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.743 1.156 . . . . 0.0 113.924 -170.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.8 m 56.8 21.71 6.28 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 117.446 2.387 . . . . 0.0 117.446 176.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -129.26 8.55 5.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.313 1.445 . . . . 0.0 112.9 175.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -143.49 150.68 39.32 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.629 1.572 . . . . 0.0 111.707 -172.114 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -68.31 -10.83 60.65 Favored Glycine 0 CA--C 1.533 1.215 0 N-CA-C 116.19 1.236 . . . . 0.0 116.19 -170.134 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.58 92.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.124 1.462 . . . . 0.0 112.432 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -59.02 175.57 0.27 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.089 1.356 . . . . 0.0 113.169 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -32.79 -68.98 0.09 Allowed 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 126.751 2.02 . . . . 0.0 114.45 -173.117 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -78.49 -8.03 58.1 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -27.32 26.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.046 1.339 . . . . 0.0 111.821 171.658 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.09 139.49 95.99 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.257 1.423 . . . . 0.0 112.013 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 CA--C 1.541 0.844 0 C-N-CA 123.574 2.849 . . . . 0.0 114.995 178.107 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.0 pt . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 121.105 0.479 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.9 mt 54.69 22.97 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 126.678 1.991 . . . . 0.0 113.585 175.554 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.1 m 46.82 27.58 0.71 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.136 1.774 . . . . 0.0 114.616 -174.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . 0.299 5.7 p 42.07 79.58 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.588 1.955 . . . . 0.0 113.315 -162.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 68.54 17.09 9.08 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.454 2.702 . . . . 0.0 116.984 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -109.09 66.1 0.63 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 108.434 164.492 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 164.29 -162.6 35.45 Favored Glycine 0 CA--C 1.524 0.631 0 O-C-N 121.195 -0.94 . . . . 0.0 114.0 173.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -136.41 158.03 45.39 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.617 1.567 . . . . 0.0 108.597 163.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.5 t -67.41 -24.76 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -175.667 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -119.63 -39.09 2.9 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -107.82 61.95 0.61 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.153 0.981 . . . . 0.0 112.959 -171.305 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -153.76 134.95 14.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.241 1.416 . . . . 0.0 111.031 -176.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -156.12 171.22 20.53 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.227 1.011 . . . . 0.0 112.648 -172.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -53.69 -32.08 50.38 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.083 1.753 . . . . 0.0 114.564 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -84.9 -8.96 58.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.015 1.726 . . . . 0.0 113.649 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -131.78 -0.55 3.85 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.839 1.656 . . . . 0.0 114.699 -170.42 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 t -27.96 -52.84 0.24 Allowed Pre-proline 0 CA--C 1.557 1.222 0 C-N-CA 127.969 2.508 . . . . 0.0 117.25 -175.355 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -65.41 -18.49 60.17 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 122.701 2.267 . . . . 0.0 116.167 -178.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -73.16 128.08 34.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.782 1.233 . . . . 0.0 110.692 174.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.73 138.96 21.3 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -172.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 35.9 mm 58.38 139.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 130.51 3.524 . . . . 0.0 116.709 165.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -162.24 158.94 25.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.345 1.858 . . . . 0.0 112.858 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.6 t -99.49 162.34 13.09 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.079 1.352 . . . . 0.0 110.14 159.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.5 p -56.2 140.46 44.39 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 120.938 -1.101 . . . . 0.0 111.692 177.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt 56.94 6.71 0.34 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.639 1.976 . . . . 0.0 115.687 -174.307 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.5 m -93.85 -36.44 12.24 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.225 1.01 . . . . 0.0 112.523 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 60.01 -20.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 128.087 2.555 . . . . 0.0 116.769 -176.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -136.58 127.58 27.72 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.959 2.103 . . . . 0.0 110.021 162.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.274 13.5 m 40.78 -62.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.026 1 C-N-CA 132.575 4.35 . . . . 0.0 118.949 178.943 . . . . . . . . 3 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 166.26 155.37 8.8 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.981 1.276 . . . . 0.0 114.051 -172.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -77.26 113.64 15.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.287 1.435 . . . . 0.0 112.602 175.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.6 t80 66.02 154.53 0.08 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.794 2.038 . . . . 0.0 115.662 -173.122 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 48.84 16.49 0.12 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 128.383 2.673 . . . . 0.0 114.982 -167.339 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.0 m 50.13 28.23 2.94 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.119 1.768 . . . . 0.0 114.515 -170.496 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -157.94 -14.79 0.08 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 115.861 1.8 . . . . 0.0 115.861 -174.621 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 CA--C 1.556 1.192 0 C-N-CA 127.793 2.437 . . . . 0.0 115.998 -172.897 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -81.02 -19.07 44.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.481 1.112 . . . . 0.0 113.076 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.0 m -97.89 148.35 23.52 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.042 0.937 . . . . 0.0 111.943 178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.2 t -74.72 -35.21 62.67 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 69' ' ' LEU . 1.7 pt? -95.23 -25.2 16.46 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.72 147.06 39.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.92 0.888 . . . . 0.0 112.853 -169.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -103.85 -31.4 9.8 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.608 1.163 . . . . 0.0 112.676 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.4 m -79.57 160.67 26.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.291 1.036 . . . . 0.0 113.542 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.49 163.7 22.1 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.857 1.663 . . . . 0.0 112.712 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.4 tppt? 56.53 31.25 18.67 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.467 1.907 . . . . 0.0 113.385 -173.666 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -89.72 158.84 17.37 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.724 1.609 . . . . 0.0 113.265 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.4 p -162.37 -65.27 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 176.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -56.04 147.64 19.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.7 2.0 . . . . 0.0 113.718 -161.49 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 55.93 27.31 10.92 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.851 1.66 . . . . 0.0 113.72 -171.64 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.5 mmt85 50.38 50.65 18.33 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 126.526 1.93 . . . . 0.0 111.917 -169.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m . . . . . 0 CA--C 1.549 0.93 0 C-N-CA 129.096 2.958 . . . . 0.0 113.681 -162.075 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.9 t70 . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.85 107.3 13.54 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.26 -0.9 . . . . 0.0 110.988 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.71 -11.54 59.61 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -173.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -121.27 119.44 32.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.435 1.494 . . . . 0.0 111.343 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -138.81 19.87 2.67 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.838 1.655 . . . . 0.0 112.136 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -91.77 153.33 43.74 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 126.203 1.801 . . . . 0.0 113.172 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.94 164.61 35.1 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.26 2.64 . . . . 0.0 112.943 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -123.76 168.31 12.88 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.604 1.962 . . . . 0.0 111.373 174.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.31 -2.3 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -168.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.47 HD23 ' H ' ' A' ' 101' ' ' LEU . 1.6 pt? -104.16 144.82 29.47 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.882 1.273 . . . . 0.0 113.738 -176.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -82.59 169.42 13.72 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.093 3.196 . . . . 0.0 113.94 -176.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 40.1 t80 . . . . . 0 CA--C 1.548 0.88 0 C-N-CA 125.902 1.681 . . . . 0.0 112.385 178.015 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 66.5 m . . . . . 0 CA--C 1.539 0.546 0 CA-C-O 121.374 0.607 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -72.18 172.7 9.72 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.873 -0.517 . . . . 0.0 111.068 159.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 56.0 t30 65.52 -61.71 0.24 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.555 2.342 . . . . 0.0 115.991 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.94 -21.79 26.04 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -170.171 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.51 -5.59 28.39 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 124.758 1.17 . . . . 0.0 115.457 -173.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -78.8 -171.81 40.56 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.866 1.222 . . . . 0.0 112.789 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -144.34 146.08 32.35 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.881 1.672 . . . . 0.0 110.697 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.47 17.71 48.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 162.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -140.01 132.64 28.83 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.547 1.673 . . . . 0.0 113.23 168.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 40.16 30.55 0.07 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 128.225 2.61 . . . . 0.0 117.141 168.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.7 -31.38 37.67 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.794 1.188 . . . . 0.0 115.514 -164.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.13 -38.34 86.01 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.022 1.729 . . . . 0.0 114.284 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -106.74 -19.98 13.49 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.728 2.011 . . . . 0.0 112.894 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 48.2 t . . . . . 0 CA--C 1.547 0.846 0 C-N-CA 126.684 1.994 . . . . 0.0 112.425 174.962 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.643 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.05 -51.91 25.5 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.371 1.068 . . . . 0.0 113.223 167.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.86 -39.73 1.68 Allowed 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.447 2.098 . . . . 0.0 113.763 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER 61.1 -55.05 0.1 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 128.251 2.62 . . . . 0.0 115.956 -176.377 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -158.92 158.72 33.89 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.3 2.24 . . . . 0.0 110.809 174.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -67.79 -39.06 84.06 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 112.923 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -160.03 -34.71 0.06 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.934 1.694 . . . . 0.0 113.391 -177.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.5 m -68.44 -30.17 68.98 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -171.579 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 m 53.2 22.63 2.72 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 170.717 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -134.82 6.06 3.4 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.298 1.039 . . . . 0.0 113.45 177.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 -141.02 154.93 46.23 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.971 1.708 . . . . 0.0 112.091 -164.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -72.07 -18.01 77.56 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 116.374 1.31 . . . . 0.0 116.374 -169.087 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.22 95.82 0.79 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 118.448 1.124 . . . . 0.0 111.921 172.073 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.32 178.15 0.57 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.138 1.375 . . . . 0.0 112.688 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.83 -64.56 0.48 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.149 1.779 . . . . 0.0 114.323 -170.784 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -74.67 -15.46 60.8 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.897 1.679 . . . . 0.0 115.075 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.26 -20.02 30.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.704 1.202 . . . . 0.0 111.773 178.367 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.98 154.09 90.86 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 124.18 0.992 . . . . 0.0 112.243 157.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo . . . . . 0 CA--C 1.54 0.796 0 C-N-CA 123.317 2.678 . . . . 0.0 111.585 177.188 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.8 mt . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 122.761 1.267 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.0 mt -101.1 120.03 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.72 1.608 . . . . 0.0 108.728 -174.078 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 p -62.66 126.82 28.64 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.449 1.022 . . . . 0.0 110.298 -176.784 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.0 m 46.87 29.02 0.93 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -175.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 t80 55.03 30.89 15.04 Favored 'General case' 0 CA--C 1.552 1.058 0 C-N-CA 126.704 2.002 . . . . 0.0 115.195 -172.882 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 91.4 m -73.87 106.63 5.68 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.545 1.538 . . . . 0.0 112.783 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.44 -151.28 50.55 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.538 -0.726 . . . . 0.0 113.951 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -105.12 139.62 39.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.669 1.188 . . . . 0.0 110.202 170.797 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.3 t -55.17 -27.34 45.03 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -172.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.89 -35.3 22.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -99.53 -13.02 19.64 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -63.9 130.27 43.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.849 1.66 . . . . 0.0 111.745 174.64 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -147.24 149.42 32.86 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.841 1.256 . . . . 0.0 109.804 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.4 p -64.97 -21.11 66.79 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -163.504 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.9 ptt180 -73.78 -19.41 60.78 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -108.5 -35.66 6.42 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.921 1.688 . . . . 0.0 112.323 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.502 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.449 1.6 t 47.72 -114.45 0.0 OUTLIER Pre-proline 0 CA--C 1.563 1.454 0 C-N-CA 128.063 2.545 . . . . 0.0 113.973 174.898 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.502 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 56.0 Cg_endo -79.99 -11.52 13.64 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 CA-C-N 124.491 2.64 . . . . 0.0 116.276 -167.177 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -83.48 54.87 2.98 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.212 1.405 . . . . 0.0 114.321 -165.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.07 -11.46 0.75 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 177.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 mm -119.12 11.55 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 125.565 1.546 . . . . 0.0 112.56 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.442 ' HA ' ' HA ' ' A' ' 50' ' ' GLU . 8.3 pt20 -133.06 160.06 38.27 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -173.934 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -65.57 165.34 12.46 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.638 1.175 . . . . 0.0 111.61 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 m -71.48 -31.29 66.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -134.61 19.74 3.59 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.06 1.744 . . . . 0.0 113.012 -176.884 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.0 t -153.13 169.13 23.73 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 126.632 1.973 . . . . 0.0 109.881 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -70.04 -174.43 0.78 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 125.335 1.454 . . . . 0.0 113.822 178.018 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 44' ' ' GLN . 1.5 mp0 -40.59 128.29 2.49 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.406 2.282 . . . . 0.0 114.967 -172.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m -66.85 -7.88 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 O-C-N 120.953 -1.092 . . . . 0.0 112.374 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 -15.51 31.18 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.928 1.251 . . . . 0.0 114.848 167.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.91 -178.12 6.5 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.289 1.544 . . . . 0.0 114.333 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.6 173.31 2.82 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 118.237 2.68 . . . . 0.0 118.237 -158.296 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 44.19 95.74 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.834 3.254 . . . . 0.0 115.114 161.427 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.5 m 61.46 22.06 12.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 52.72 72.52 0.41 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.916 1.286 . . . . 0.0 111.024 -167.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.0 t . . . . . 0 CA--C 1.553 1.095 0 C-N-CA 128.186 2.594 . . . . 0.0 112.237 -162.861 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 121.167 0.508 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -87.1 -12.03 48.34 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 46.2 m -84.18 150.62 25.37 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.29 1.036 . . . . 0.0 112.169 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.5 t -78.97 -36.04 42.06 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.828 1.251 . . . . 0.0 113.601 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -93.9 -9.36 37.45 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -172.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 72.2 m -89.28 148.93 23.3 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.022 0.929 . . . . 0.0 112.325 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -79.48 169.35 18.18 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.542 1.137 . . . . 0.0 111.081 166.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.0 m -82.48 26.92 0.53 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.369 1.068 . . . . 0.0 113.528 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.8 tppt? -150.1 162.06 41.15 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.119 2.168 . . . . 0.0 109.805 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 55.84 39.22 30.69 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.471 1.509 . . . . 0.0 113.113 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -119.6 160.49 22.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.646 1.578 . . . . 0.0 111.924 -174.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 p -152.5 158.86 43.16 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.403 1.081 . . . . 0.0 113.067 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -69.28 171.03 9.13 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.968 1.307 . . . . 0.0 112.912 -176.612 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 57.87 37.65 26.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.993 1.317 . . . . 0.0 112.826 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? 59.18 60.39 2.4 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.134 2.174 . . . . 0.0 112.851 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.6 p . . . . . 0 CA--C 1.556 1.206 0 C-N-CA 127.768 2.427 . . . . 0.0 116.895 171.403 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.9 p30 . . . . . 0 CA--C 1.549 0.911 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.311 0.5 OUTLIER 55.83 19.31 3.42 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 170.781 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -89.84 147.65 23.66 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.216 0.916 . . . . 0.0 111.595 166.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -135.95 -178.87 5.33 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.78 1.632 . . . . 0.0 113.233 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 68.67 134.43 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 129.004 2.922 . . . . 0.0 115.131 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -147.38 97.68 4.04 Favored Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 127.415 2.286 . . . . 0.0 108.941 -178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.63 -14.86 7.62 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.951 2.434 . . . . 0.0 113.952 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -76.72 152.14 35.81 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.529 1.132 . . . . 0.0 113.419 -175.454 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -139.01 160.82 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.691 1.597 . . . . 0.0 111.415 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.2 mt -111.39 86.24 6.43 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 125.921 1.689 . . . . 0.0 109.097 173.629 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -83.57 170.07 11.84 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.613 2.875 . . . . 0.0 113.905 -167.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 . . . . . 0 CA--C 1.548 0.894 0 C-N-CA 126.021 1.728 . . . . 0.0 115.254 170.252 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 12.7 t . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -144.2 -43.17 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -80.1 -30.9 39.25 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -164.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 24.2 p -149.6 139.71 22.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.886 1.274 . . . . 0.0 110.782 -176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 67.14 20.83 71.42 Favored Glycine 0 CA--C 1.541 1.665 0 O-C-N 121.415 -0.803 . . . . 0.0 114.459 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 61.07 -134.08 48.98 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-N 118.088 0.944 . . . . 0.0 112.168 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -92.26 -1.41 57.12 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.866 1.266 . . . . 0.0 114.084 169.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.25 -156.35 27.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.626 1.584 . . . . 0.0 115.355 -173.452 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.7 p80 45.53 -157.14 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.593 2.757 . . . . 0.0 115.516 -178.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -71.61 28.76 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.951 1.701 . . . . 0.0 113.097 168.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' GLY . . . . . 0.444 ' HA2' ' SG ' ' A' ' 121' ' ' CYS . . . -52.36 -24.52 16.82 Favored Glycine 0 CA--C 1.541 1.69 0 C-N-CA 127.962 2.696 . . . . 0.0 115.58 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -67.04 -40.25 87.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.267 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -98.09 -17.57 19.02 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.318 1.847 . . . . 0.0 113.176 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' CYS . . . . . 0.444 ' SG ' ' HA2' ' A' ' 118' ' ' GLY . 1.8 p . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 115.033 1.494 . . . . 0.0 115.033 -174.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.628 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.72 37.86 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.747 1.219 . . . . 0.0 113.58 165.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -46.16 0.36 Allowed 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.044 1.829 . . . . 0.0 114.029 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt 41.71 -163.31 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.95 1.3 . . . . 0.0 112.816 -149.183 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 m -58.52 150.13 23.58 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.08 -1.637 . . . . 0.0 113.129 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 38.4 t30 -64.43 -44.95 89.6 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.691 0.797 . . . . 0.0 112.277 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -121.72 -58.25 1.76 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.63 1.172 . . . . 0.0 112.249 -167.234 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.5 p -79.48 -166.37 0.95 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.684 0.793 . . . . 0.0 110.931 167.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 62.3 p -134.61 23.47 3.68 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -69.19 171.66 8.06 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.774 -0.579 . . . . 0.0 111.631 168.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.58 149.32 39.85 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.787 1.235 . . . . 0.0 111.964 168.238 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 122.03 -93.28 0.5 Allowed Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.093 1.33 . . . . 0.0 110.716 -169.087 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.08 74.8 2.95 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 121.956 0.884 . . . . 0.0 113.047 176.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.426 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.03 173.86 1.0 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.865 1.266 . . . . 0.0 113.008 173.583 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.1 OUTLIER -16.03 -73.63 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.776 2.83 . . . . 0.0 115.44 -171.589 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -67.46 -26.26 66.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.309 1.843 . . . . 0.0 115.65 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.94 -20.52 24.39 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.201 1.8 . . . . 0.0 112.828 176.513 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -56.92 -40.93 88.64 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.243 1.817 . . . . 0.0 114.56 -173.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo . . . . . 0 C--N 1.354 0.819 0 C-N-CA 122.865 2.377 . . . . 0.0 112.474 173.026 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.5 mt . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.16 155.65 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 126.8 2.04 . . . . 0.0 110.553 -176.51 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 73.9 m -87.05 1.05 54.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.093 1.357 . . . . 0.0 113.853 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.0 m 63.66 126.13 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.343 2.257 . . . . 0.0 114.065 -163.685 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 40.2 t80 57.83 -21.09 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 127.412 2.285 . . . . 0.0 116.012 -164.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.0 t -110.82 138.15 47.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.378 2.271 . . . . 0.0 111.036 178.396 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.55 -178.14 51.47 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.047 1.308 . . . . 0.0 114.864 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -140.03 144.66 37.01 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.51 1.524 . . . . 0.0 110.229 171.877 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.0 t -69.98 -16.04 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -172.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.2 -21.69 15.42 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.663 1.585 . . . . 0.0 114.006 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.83 108.61 4.03 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.533 1.133 . . . . 0.0 111.841 -175.687 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -148.4 143.19 26.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.871 1.269 . . . . 0.0 110.799 -178.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -135.99 105.47 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 -167.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.2 m 54.76 -160.01 0.17 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.533 1.533 . . . . 0.0 114.527 167.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.6 2.07 23.75 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 166.093 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -80.13 -40.54 27.23 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.71 1.204 . . . . 0.0 111.733 177.576 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.9 m 63.85 166.04 0.11 Allowed Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 128.121 2.568 . . . . 0.0 114.83 -178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -118.42 -153.78 0.0 OUTLIER 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.481 2.788 . . . . 0.0 112.814 -160.512 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -66.95 -15.58 63.79 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.064 1.746 . . . . 0.0 115.446 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 58.35 -166.39 0.16 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.008 1.723 . . . . 0.0 115.148 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.3 mt -83.43 52.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.123 1.769 . . . . 0.0 112.095 -163.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -150.32 148.83 29.31 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.579 1.552 . . . . 0.0 113.661 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.3 t -81.13 133.22 35.43 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.88 2.072 . . . . 0.0 109.503 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.7 p -67.16 -21.6 65.8 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -77.09 -26.22 53.14 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.917 1.287 . . . . 0.0 113.059 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.7 p -153.56 -92.91 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -136.67 -164.55 1.59 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.52 1.928 . . . . 0.0 111.772 -166.118 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -45.71 139.47 4.01 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.702 1.601 . . . . 0.0 113.946 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.0 m -64.83 -8.61 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 121.176 -0.952 . . . . 0.0 112.585 173.05 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.88 -8.14 2.02 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 127.159 2.314 . . . . 0.0 115.754 171.392 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -147.41 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.921 1.688 . . . . 0.0 112.445 163.818 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -52.64 126.16 18.87 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.814 -1.179 . . . . 0.0 112.732 176.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.4 mmt-85 -66.41 160.24 25.25 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.897 2.079 . . . . 0.0 112.852 -171.343 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m 55.71 36.66 27.67 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.441 1.096 . . . . 0.0 113.076 -166.501 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.271 10.6 pt20 42.12 90.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.941 2.896 . . . . 0.0 115.843 -178.04 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 CA--C 1.556 1.201 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 164.377 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.509 HG12 ' H ' ' A' ' 67' ' ' CYS . 21.6 t . . . . . 0 N--CA 1.476 0.827 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -77.81 -0.39 26.99 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.509 ' H ' HG12 ' A' ' 65' ' ' VAL . 80.8 m -124.63 165.58 17.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.965 1.706 . . . . 0.0 111.443 170.432 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.2 p -127.73 -28.48 2.71 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.061 2.144 . . . . 0.0 110.852 -159.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.4 -37.79 87.16 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.114 1.766 . . . . 0.0 110.501 161.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.9 m -82.79 129.55 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.01 1.324 . . . . 0.0 111.677 -173.992 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -114.59 14.57 17.69 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.488 1.515 . . . . 0.0 113.49 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.3 t -140.95 161.79 37.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.421 1.888 . . . . 0.0 112.401 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.6 -18.66 59.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.0 1.32 . . . . 0.0 114.262 173.787 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -79.18 147.05 32.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.085 0.954 . . . . 0.0 111.074 168.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -142.65 146.3 34.33 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.506 1.122 . . . . 0.0 111.878 -175.268 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.8 m -133.85 105.25 6.67 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -168.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -66.03 -17.35 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.144 1.377 . . . . 0.0 114.242 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -85.74 -9.77 56.61 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.077 0.951 . . . . 0.0 113.389 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -119.81 -43.6 2.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.533 1.533 . . . . 0.0 113.792 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 t . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -171.038 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.8 t0 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -110.97 144.2 40.44 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.574 1.549 . . . . 0.0 112.461 -175.41 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -134.45 138.94 45.16 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.241 1.416 . . . . 0.0 111.481 176.186 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -154.07 159.65 41.63 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.1 1.76 . . . . 0.0 112.416 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -114.14 167.11 10.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.628 1.571 . . . . 0.0 112.758 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -132.6 134.9 25.29 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.785 1.634 . . . . 0.0 112.089 -176.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -80.85 -177.54 3.81 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.371 3.381 . . . . 0.0 113.124 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -64.55 160.86 18.6 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 113.304 175.922 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.07 143.15 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 126.42 1.888 . . . . 0.0 108.778 166.379 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 146.34 99.02 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -173.453 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.41 140.65 9.7 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.336 2.69 . . . . 0.0 112.788 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.8 p90 . . . . . 0 CA--C 1.548 0.867 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 172.244 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 108' ' ' CYS . . . . . 0.426 ' HB2' ' H ' ' A' ' 115' ' ' GLY . 2.9 t . . . . . 0 CA--C 1.548 0.883 0 CA-C-O 121.333 0.587 . . . . 0.0 112.011 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -58.93 -18.21 31.53 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -168.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -62.63 -29.63 70.77 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.492 1.517 . . . . 0.0 114.802 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 22.8 p -150.68 -2.07 0.37 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.63 -169.09 46.59 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.809 1.195 . . . . 0.0 113.279 -171.641 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.58 0.64 87.81 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.289 0.947 . . . . 0.0 115.088 -174.307 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt 28.87 99.06 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 129.849 3.26 . . . . 0.0 116.256 170.337 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 115' ' ' GLY . . . . . 0.426 ' H ' ' HB2' ' A' ' 108' ' ' CYS . . . 98.06 3.9 57.79 Favored Glycine 0 CA--C 1.534 1.255 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 36.1 p-80 -91.51 121.4 33.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.991 . . . . 0.0 112.008 169.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 38.73 35.63 0.12 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.656 2.382 . . . . 0.0 115.274 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.32 -33.17 52.46 Favored Glycine 0 N--CA 1.476 1.307 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 -150.699 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.35 -48.64 49.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.242 1.417 . . . . 0.0 113.282 177.182 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -77.28 -26.82 52.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.142 1.377 . . . . 0.0 112.269 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 126.271 1.828 . . . . 0.0 113.382 -179.986 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -86.66 -51.03 0.46 Allowed Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.344 1.457 . . . . 0.0 113.404 158.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.15 -31.52 7.67 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 123.032 2.488 . . . . 0.0 115.314 -173.212 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.264 1.4 tmmt? 62.25 -60.93 0.12 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 128.115 2.566 . . . . 0.0 117.011 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -164.54 152.58 12.23 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.738 2.815 . . . . 0.0 109.54 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -68.53 -34.39 75.78 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -144.92 -39.98 0.25 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.254 1.421 . . . . 0.0 113.223 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.6 p -88.0 -156.4 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.731 1.612 . . . . 0.0 111.364 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -146.25 143.78 29.42 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -172.967 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 58.71 46.21 14.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.752 2.021 . . . . 0.0 115.004 160.509 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -126.54 14.25 7.6 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.979 1.711 . . . . 0.0 113.858 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.62 -41.73 1.92 Allowed Glycine 0 N--CA 1.477 1.39 0 C-N-CA 125.543 1.544 . . . . 0.0 115.704 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.54 84.4 0.43 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.265 1.426 . . . . 0.0 111.935 172.112 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.501 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -63.44 -179.66 0.36 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.678 1.591 . . . . 0.0 113.529 176.518 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.03 -68.08 0.06 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 127.171 2.189 . . . . 0.0 114.97 -171.182 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -73.96 -22.57 59.59 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.339 1.856 . . . . 0.0 115.386 -179.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.15 -26.92 26.53 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.58 1.552 . . . . 0.0 112.339 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.44 -50.85 83.81 Favored Pre-proline 0 CA--C 1.546 0.798 0 C-N-CA 125.789 1.636 . . . . 0.0 114.86 -173.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 C--N 1.355 0.905 0 C-N-CA 121.86 1.706 . . . . 0.0 112.014 -177.472 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.1 mt . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 122.344 1.069 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.2 mt -135.25 146.4 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.22 2.208 . . . . 0.0 109.285 172.696 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.1 t -71.16 125.55 27.23 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.344 0.658 . . . . 0.0 111.091 173.769 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 10.0 t -65.63 127.25 31.14 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -164.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 50.51 31.74 5.9 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.146 1.778 . . . . 0.0 114.329 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.8 t -135.39 -21.48 1.56 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.625 1.17 . . . . 0.0 113.868 -167.475 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.96 170.7 37.7 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.593 1.092 . . . . 0.0 113.13 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -100.96 158.6 15.87 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.557 1.543 . . . . 0.0 110.763 170.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.8 t -59.95 -31.28 69.72 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -100.13 -7.69 24.55 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.901 1.28 . . . . 0.0 113.705 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -149.21 87.57 1.54 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.496 1.119 . . . . 0.0 112.27 -173.307 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 78.0 t60 -153.34 174.6 14.12 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.03 2.132 . . . . 0.0 110.009 176.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . 0.297 1.7 p90 59.06 -30.24 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 131.157 3.783 . . . . 0.0 117.994 179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 86.6 p -60.83 163.56 5.59 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.487 1.039 . . . . 0.0 111.423 162.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.9 ttt-85 54.98 24.72 6.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.587 1.155 . . . . 0.0 112.508 -164.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 46.24 96.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.043 2.537 . . . . 0.0 114.263 -167.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.433 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.431 6.4 t 73.18 -105.02 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.236 0 C-N-CA 127.984 2.514 . . . . 0.0 115.602 177.636 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.433 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 61.2 Cg_endo -66.75 138.96 50.79 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.695 2.264 . . . . 0.0 113.773 -166.26 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -143.62 -29.19 0.52 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -171.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.46 174.67 13.6 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -173.167 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.276 2.7 mt 64.15 63.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 127.48 2.312 . . . . 0.0 114.174 169.269 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -128.83 168.74 15.47 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.478 1.511 . . . . 0.0 113.095 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 83.9 m -70.91 163.48 27.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.792 0.806 . . . . 0.0 112.237 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m -74.32 -24.02 59.14 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -120.64 -5.65 9.72 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.528 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.6 p -148.53 158.72 44.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.579 1.151 . . . . 0.0 111.995 178.73 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -74.37 137.92 43.08 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.562 1.145 . . . . 0.0 113.202 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.05 155.41 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 128.538 2.735 . . . . 0.0 115.203 -172.343 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m -88.4 -10.52 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 O-C-N 120.571 -1.33 . . . . 0.0 111.164 157.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.06 40.26 0.7 Allowed Glycine 0 CA--C 1.537 1.449 0 C-N-CA 128.593 2.996 . . . . 0.0 117.174 -164.278 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.06 -138.03 0.22 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.533 2.333 . . . . 0.0 111.33 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -51.92 121.91 7.46 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 124.957 1.303 . . . . 0.0 113.194 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 47.75 23.28 0.42 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.062 2.545 . . . . 0.0 114.562 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.28 77.3 p 44.63 27.99 0.29 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.807 2.443 . . . . 0.0 114.906 -166.635 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -145.67 -13.33 0.5 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -171.27 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.315 1.7 t . . . . . 0 CA--C 1.557 1.222 0 N-CA-C 118.987 2.958 . . . . 0.0 118.987 173.237 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.452 HG22 ' H ' ' A' ' 67' ' ' CYS . 1.9 p . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -94.77 -4.29 47.56 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.986 0.915 . . . . 0.0 113.36 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.452 ' H ' HG22 ' A' ' 65' ' ' VAL . 78.0 m -112.58 1.15 15.69 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.663 1.585 . . . . 0.0 114.879 -166.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.263 11.0 t 55.7 -46.72 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 129.292 3.037 . . . . 0.0 118.266 -171.462 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 pp -90.92 -18.04 25.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.958 1.703 . . . . 0.0 114.23 -176.124 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.05 166.63 23.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.153 0.981 . . . . 0.0 112.265 177.423 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.18 150.34 43.85 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.487 -0.758 . . . . 0.0 111.921 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.2 p -74.92 28.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 128.461 2.705 . . . . 0.0 116.064 -176.784 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -122.09 156.35 33.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.508 1.923 . . . . 0.0 110.48 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -65.26 116.42 6.58 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.728 0.811 . . . . 0.0 110.87 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 49.6 p-80 -137.71 2.82 2.45 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.131 1.772 . . . . 0.0 112.861 -174.472 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.7 m -81.28 34.61 0.37 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.029 1.731 . . . . 0.0 115.568 -156.719 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -54.15 139.16 36.31 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.274 1.43 . . . . 0.0 112.224 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 45.92 45.98 12.09 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.905 1.282 . . . . 0.0 113.522 -170.119 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.7 mtm180 58.26 38.75 26.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.374 1.87 . . . . 0.0 113.45 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.7 t . . . . . 0 CA--C 1.551 1.01 0 C-N-CA 129.085 2.954 . . . . 0.0 113.394 -165.176 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.7 t0 . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -78.65 136.19 37.4 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.519 1.128 . . . . 0.0 111.88 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -103.42 157.72 16.84 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.634 1.173 . . . . 0.0 113.229 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -78.3 128.56 33.88 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.27 1.028 . . . . 0.0 111.024 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -133.82 -0.93 3.09 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -176.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -88.07 147.91 41.78 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.522 1.129 . . . . 0.0 112.15 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.88 155.03 51.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.399 2.733 . . . . 0.0 114.204 175.545 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -149.65 -172.8 4.24 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.251 1.82 . . . . 0.0 111.07 177.364 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.5 p -53.05 144.32 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.068 1.347 . . . . 0.0 112.886 177.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.63 159.73 82.56 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.352 1.061 . . . . 0.0 112.51 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -59.42 -23.01 68.6 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.575 2.85 . . . . 0.0 115.064 177.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 60.0 t80 . . . . . 0 CA--C 1.537 0.467 0 C-N-CA 125.531 1.532 . . . . 0.0 110.244 172.678 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 43.5 t . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 121.513 0.673 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -70.63 -22.69 62.5 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.103 0.961 . . . . 0.0 113.538 -178.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -83.0 -19.62 36.65 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -171.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 31.5 p -150.08 10.12 0.69 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.07 3.71 85.21 Favored Glycine 0 CA--C 1.537 1.443 0 O-C-N 121.033 -1.042 . . . . 0.0 115.199 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -81.4 -159.76 23.95 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.758 1.171 . . . . 0.0 113.874 176.638 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.36 169.07 25.56 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 112.272 176.259 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 70.31 22.3 77.53 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 117.055 1.582 . . . . 0.0 117.055 158.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 116' ' ' HIS . . . . . 0.414 ' C ' ' H ' ' A' ' 118' ' ' GLY . 1.7 p80 -138.81 -165.45 1.83 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.845 1.323 . . . . 0.0 112.145 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -66.04 30.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.259 1.823 . . . . 0.0 113.998 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -53.42 -25.75 28.04 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 128.232 2.825 . . . . 0.0 114.869 -178.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.9 -40.24 94.75 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.298 1.839 . . . . 0.0 113.533 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -111.61 -15.35 13.49 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.056 1.742 . . . . 0.0 113.027 -172.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 1.6 p . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 121.809 0.814 . . . . 0.0 112.698 178.022 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 120.253 0.073 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.73 -48.31 93.82 Favored Pre-proline 0 CA--C 1.551 1.017 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 170.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -41.47 0.54 Allowed 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.63 2.22 . . . . 0.0 113.988 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? 59.01 -54.03 0.05 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 128.778 2.831 . . . . 0.0 116.122 -171.115 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 167.95 28.94 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.828 2.451 . . . . 0.0 111.703 175.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -74.48 -34.03 63.0 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -153.89 -47.32 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.966 1.306 . . . . 0.0 112.879 -175.508 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.9 p -79.06 -164.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.284 1.034 . . . . 0.0 111.96 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 t -139.15 29.26 2.25 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -162.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -94.83 156.33 16.41 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.966 1.306 . . . . 0.0 111.512 175.063 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -76.29 161.25 28.9 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.17 1.788 . . . . 0.0 112.49 178.129 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.22 -11.73 41.96 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.652 1.821 . . . . 0.0 117.652 162.156 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.253 0.6 OUTLIER -134.82 72.6 1.46 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.591 1.696 . . . . 0.0 111.744 173.95 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.75 177.9 0.1 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.129 2.172 . . . . 0.0 113.858 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.24 -68.84 0.06 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 127.184 2.194 . . . . 0.0 115.271 -173.144 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -75.5 -18.54 59.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -92.09 -21.97 20.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.837 1.655 . . . . 0.0 113.114 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.1 t -56.97 -43.66 99.49 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.58 1.552 . . . . 0.0 114.934 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo . . . . . 0 C--N 1.355 0.9 0 C-N-CA 122.519 2.146 . . . . 0.0 117.044 -168.937 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.6 tt . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mt -104.85 129.62 57.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.421 1.888 . . . . 0.0 109.414 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 p -75.95 133.44 40.47 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.416 -0.803 . . . . 0.0 110.375 168.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 p -57.71 120.61 8.67 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.658 1.583 . . . . 0.0 113.774 -164.798 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 55.3 -13.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.358 2.663 . . . . 0.0 116.984 -171.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -87.63 46.34 1.37 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 110.941 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.23 159.73 10.24 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 120.594 -1.316 . . . . 0.0 114.864 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.58 134.14 53.05 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.034 1.333 . . . . 0.0 109.524 163.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.7 t -66.77 -9.54 37.94 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -162.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -104.08 -10.27 18.14 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.278 1.431 . . . . 0.0 114.519 172.602 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.94 -17.91 8.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.043 1.737 . . . . 0.0 113.682 -174.976 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -87.47 145.07 26.42 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.833 1.653 . . . . 0.0 112.922 -173.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -150.66 155.43 39.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.504 1.522 . . . . 0.0 109.855 174.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.1 p -61.43 -30.26 70.46 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -173.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.6 mtp-105 -82.79 -28.65 30.15 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.145 1.378 . . . . 0.0 112.915 171.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -85.94 -9.35 57.03 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.314 1.446 . . . . 0.0 113.448 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.5 t -17.51 -61.87 0.04 OUTLIER Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 130.558 3.543 . . . . 0.0 117.3 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -63.57 -21.76 70.54 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.757 2.305 . . . . 0.0 115.982 -174.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -83.93 112.1 19.85 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.803 1.183 . . . . 0.0 110.165 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.77 -155.8 0.66 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.838 1.255 . . . . 0.0 112.331 -159.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.5 87.29 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 124.709 1.204 . . . . 0.0 109.511 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -128.38 160.37 32.45 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.181 1.792 . . . . 0.0 113.154 -171.66 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.62 -4.11 35.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.379 2.271 . . . . 0.0 113.63 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 48.2 m 64.66 -28.75 0.1 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 128.102 2.561 . . . . 0.0 117.471 -171.782 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -124.45 3.84 8.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.155 1.782 . . . . 0.0 113.71 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.3 t -154.44 47.3 0.58 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.896 1.278 . . . . 0.0 111.031 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 49.39 -159.11 0.06 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.864 1.266 . . . . 0.0 114.203 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' H ' ' A' ' 52' ' ' GLY . 21.0 tt0 -48.17 140.17 7.59 Favored 'General case' 0 CA--C 1.552 1.054 0 O-C-N 120.018 -1.677 . . . . 0.0 113.193 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.4 m -63.73 -23.21 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 119.742 -1.849 . . . . 0.0 111.507 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLY . . . . . 0.463 ' H ' ' HG2' ' A' ' 50' ' ' GLU . . . -81.13 -13.94 80.02 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.962 1.744 . . . . 0.0 116.294 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -79.86 -17.7 52.55 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.098 1.949 . . . . 0.0 115.152 -168.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -131.74 144.16 50.77 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.904 1.282 . . . . 0.0 110.922 169.263 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -58.84 152.8 18.43 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.392 1.477 . . . . 0.0 112.395 -173.128 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.7 m 58.91 40.81 22.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 113.175 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.275 18.7 pt20 48.14 49.16 17.82 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.809 2.044 . . . . 0.0 114.454 -175.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 CA--C 1.552 1.02 0 C-N-CA 128.362 2.665 . . . . 0.0 115.762 -170.595 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.2 p . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 120.642 0.258 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 8.5 tm0? -84.03 24.62 0.9 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.039 1.336 . . . . 0.0 113.298 -173.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.8 m -137.05 154.36 50.38 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.783 1.633 . . . . 0.0 110.701 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -70.5 -177.37 1.47 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 122.098 -0.376 . . . . 0.0 110.588 149.643 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.305 2.9 pp 55.25 9.92 0.39 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.865 2.466 . . . . 0.0 116.805 173.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 46.7 m -116.43 164.21 14.89 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.577 1.551 . . . . 0.0 114.022 -171.401 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 59.78 1.55 0.31 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.989 2.916 . . . . 0.0 118.353 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.0 p -72.67 -32.71 66.02 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.124 0.969 . . . . 0.0 112.137 156.833 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -139.25 -179.03 5.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.011 2.925 . . . . 0.0 110.23 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -54.97 148.44 13.51 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.424 1.49 . . . . 0.0 113.107 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -85.11 114.83 22.53 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.96 0.904 . . . . 0.0 111.882 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.9 m -77.25 78.04 3.78 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.443 1.497 . . . . 0.0 112.759 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -57.15 -28.27 62.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.336 1.455 . . . . 0.0 114.1 -174.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.06 -9.91 59.76 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -131.72 -31.28 1.56 Allowed 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -169.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 49.8 t . . . . . 0 CA--C 1.55 0.952 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -175.981 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -102.23 14.23 32.53 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -170.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -67.53 122.41 17.94 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.421 -1.424 . . . . 0.0 111.243 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -83.02 -26.92 30.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 57.64 -19.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 128.68 2.792 . . . . 0.0 118.295 -179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 46.4 71.69 1.49 Allowed Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 128.256 2.623 . . . . 0.0 113.587 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -63.6 150.4 88.58 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.284 1.99 . . . . 0.0 110.929 168.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -131.16 154.29 48.51 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.38 1.472 . . . . 0.0 111.735 -176.08 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.5 m -110.86 13.35 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.889 1.676 . . . . 0.0 112.906 176.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.5 tp -66.96 -30.95 3.5 Favored Pre-proline 0 CA--C 1.553 1.058 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 172.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -58.94 162.1 14.15 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 122.862 2.375 . . . . 0.0 113.779 171.268 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.5 t80 . . . . . 0 CA--C 1.545 0.766 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -177.261 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 CA--C 1.546 0.814 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -130.14 -41.42 1.27 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.621 1.168 . . . . 0.0 113.317 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -79.74 4.19 17.05 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.736 1.214 . . . . 0.0 113.524 175.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 36.0 t -139.01 145.54 39.79 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.091 2.157 . . . . 0.0 108.785 168.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.25 164.64 40.47 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.559 1.076 . . . . 0.0 115.191 -175.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.5 -13.29 23.09 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.35 1.452 . . . . 0.0 116.269 174.565 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . 0.278 64.4 pttt 45.92 31.41 1.08 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 127.804 2.442 . . . . 0.0 116.411 172.863 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.26 -17.07 19.02 Favored Glycine 0 CA--C 1.537 1.443 0 N-CA-C 117.095 1.598 . . . . 0.0 117.095 -168.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.0 p-80 -151.53 156.19 40.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.211 1.505 . . . . 0.0 114.508 -166.159 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 19.3 t80 46.71 33.67 2.2 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.269 2.227 . . . . 0.0 115.33 166.803 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.74 -14.54 30.03 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.653 1.597 . . . . 0.0 116.73 -166.7 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.95 -34.49 78.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.575 1.15 . . . . 0.0 113.523 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -141.79 -11.21 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -172.208 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 46.5 t . . . . . 0 CA--C 1.545 0.783 0 O-C-N 121.017 -1.052 . . . . 0.0 113.374 -174.445 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -72.92 -54.63 4.48 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.134 0.974 . . . . 0.0 112.798 172.088 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -80.42 -27.71 3.3 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.0 2.466 . . . . 0.0 114.132 178.119 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 tptt 57.61 -67.92 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.31 2.644 . . . . 0.0 115.524 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 36.0 t -166.17 154.88 11.08 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 129.145 2.978 . . . . 0.0 108.675 177.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -67.32 -55.28 14.51 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.85 -1.156 . . . . 0.0 112.747 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -121.13 -58.59 1.79 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.835 0.854 . . . . 0.0 113.056 -168.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.5 p -86.81 -159.05 0.47 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.896 1.279 . . . . 0.0 111.194 172.502 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 61.4 m -149.9 169.37 21.29 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.606 1.162 . . . . 0.0 113.646 -174.952 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 61.55 27.11 16.68 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.184 1.793 . . . . 0.0 115.418 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.8 mtp85 -120.3 6.02 10.7 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.343 1.457 . . . . 0.0 114.837 -177.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.51 -33.69 0.98 Allowed Glycine 0 CA--C 1.536 1.377 0 C-N-CA 125.44 1.495 . . . . 0.0 115.71 175.227 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -71.13 96.29 1.34 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.387 1.094 . . . . 0.0 112.263 175.063 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.03 179.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 127.186 2.195 . . . . 0.0 113.404 169.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.2 -64.37 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.506 1.522 . . . . 0.0 114.077 -169.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.95 -1.8 41.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.81 1.644 . . . . 0.0 115.29 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -94.53 -26.89 16.23 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.101 1.361 . . . . 0.0 111.166 172.803 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.5 t -62.81 149.73 88.95 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 125.555 1.542 . . . . 0.0 110.958 173.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo . . . . . 0 CA--C 1.541 0.873 0 C-N-CA 122.748 2.299 . . . . 0.0 115.888 -161.913 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.547 0.689 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.5 mm -62.53 136.14 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 125.776 1.631 . . . . 0.0 110.334 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.4 p -69.06 -43.38 74.73 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.178 -0.951 . . . . 0.0 113.562 -173.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.7 p -159.72 171.15 20.05 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 128.808 2.843 . . . . 0.0 108.851 162.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -76.34 37.74 0.17 Allowed 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -173.586 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.5 p -99.15 -31.54 11.7 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.144 2.177 . . . . 0.0 112.706 167.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 174.41 170.84 38.09 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 115.392 0.917 . . . . 0.0 115.392 -177.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.52 106.92 3.62 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 67.3 -150.09 0.18 Allowed 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 114.577 -1.192 . . . . 0.0 113.496 135.565 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -92.57 1.49 57.23 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.419 -1.426 . . . . 0.0 113.182 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -86.64 -31.31 21.18 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -173.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.86 157.13 24.5 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.814 0.846 . . . . 0.0 112.351 171.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -115.83 179.21 4.04 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.167 1.387 . . . . 0.0 111.409 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.7 m -69.44 16.67 0.05 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.283 2.233 . . . . 0.0 116.111 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -125.75 -3.47 7.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.962 2.105 . . . . 0.0 113.156 166.713 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.01 4.7 3.81 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.491 2.316 . . . . 0.0 113.324 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.0 t -47.75 -48.32 60.51 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 125.06 1.344 . . . . 0.0 113.012 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -85.02 80.35 2.14 Favored 'Trans proline' 0 CA--C 1.55 1.317 0 C-N-CA 123.296 2.664 . . . . 0.0 112.512 167.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -151.99 153.39 33.96 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.04 1.336 . . . . 0.0 112.401 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.24 -31.64 0.1 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.159 2.584 . . . . 0.0 117.202 -175.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 16.2 mm -112.78 55.52 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 126.143 1.777 . . . . 0.0 109.527 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . 0.432 ' HA ' ' C ' ' A' ' 50' ' ' GLU . 5.5 pm0 -140.91 148.29 40.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.525 1.13 . . . . 0.0 112.246 174.143 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 29.7 p -86.98 167.39 14.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.092 0.957 . . . . 0.0 111.718 170.299 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.9 t -58.66 133.7 56.13 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt 55.47 19.15 3.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.819 2.048 . . . . 0.0 114.441 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.4 m -130.14 178.51 6.51 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.473 1.909 . . . . 0.0 112.522 -175.655 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -111.65 -15.91 13.35 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -166.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.432 ' C ' ' HA ' ' A' ' 44' ' ' GLN . 47.4 mt-10 -134.19 167.32 20.89 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.766 2.027 . . . . 0.0 108.996 173.019 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.6 -11.3 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.408 -1.432 . . . . 0.0 113.99 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.93 140.18 3.04 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 127.153 2.311 . . . . 0.0 109.936 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -125.73 -3.96 7.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.763 1.625 . . . . 0.0 112.525 -176.485 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -134.53 141.9 46.84 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 126.546 1.938 . . . . 0.0 108.884 163.9 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.68 47.52 2.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.037 1.735 . . . . 0.0 112.855 178.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 m 64.16 -30.52 0.11 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -139.12 -4.26 1.53 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.826 1.651 . . . . 0.0 114.071 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.292 18.1 p . . . . . 0 CA--C 1.557 1.221 0 C-N-CA 128.789 2.836 . . . . 0.0 116.914 -172.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 N--CA 1.476 0.87 0 CA-C-O 120.729 0.299 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -72.4 -17.82 61.77 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' CYS . . . . . 0.405 ' C ' ' H ' ' A' ' 69' ' ' LEU . 77.0 m -87.11 -28.95 22.2 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.311 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 58.1 -36.28 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 127.482 2.313 . . . . 0.0 116.081 -151.19 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 67' ' ' CYS . 29.3 tp -70.55 -15.68 62.8 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 129.907 3.283 . . . . 0.0 114.12 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.7 t -107.03 156.77 18.39 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.625 1.17 . . . . 0.0 112.587 -170.529 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -115.52 1.03 13.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.681 1.592 . . . . 0.0 114.418 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.7 t -87.34 147.97 25.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -111.17 2.07 17.6 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.532 2.333 . . . . 0.0 115.115 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -112.75 -8.33 13.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.543 1.937 . . . . 0.0 113.599 -172.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -78.09 165.3 24.16 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -165.284 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.3 t -69.59 145.66 52.36 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.9 -22.71 65.95 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 127.265 2.226 . . . . 0.0 114.965 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -77.25 33.76 0.16 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 125.117 1.367 . . . . 0.0 112.519 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 46.19 47.47 13.26 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.485 2.314 . . . . 0.0 112.815 -165.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 27.6 p . . . . . 0 CA--C 1.552 1.053 0 C-N-CA 127.707 2.403 . . . . 0.0 116.204 168.262 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.7 t70 . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -143.8 159.54 42.33 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.452 1.501 . . . . 0.0 112.004 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.36 -5.88 6.53 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -174.002 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -138.56 159.67 41.51 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.824 1.25 . . . . 0.0 113.591 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.75 165.08 30.72 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.946 1.699 . . . . 0.0 111.529 175.393 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.58 146.59 42.4 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.243 1.417 . . . . 0.0 112.273 172.614 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -64.5 160.59 38.85 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.262 2.642 . . . . 0.0 114.023 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -134.78 157.16 47.45 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.186 1.794 . . . . 0.0 111.477 173.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.6 m -90.28 -10.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 124.918 1.287 . . . . 0.0 114.301 -177.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.9 tp -73.33 -35.15 2.56 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -61.8 148.69 92.53 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.031 2.487 . . . . 0.0 114.578 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 24.7 p90 . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.754 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 57.3 m . . . . . 0 CA--C 1.548 0.902 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 63.42 -26.91 0.07 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 118.132 2.642 . . . . 0.0 118.132 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -133.16 -12.04 2.85 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -176.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 28.4 p -151.26 172.27 16.12 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.348 0.976 . . . . 0.0 112.915 -173.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -62.31 161.29 30.38 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 124.203 0.906 . . . . 0.0 113.695 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.29 172.07 39.58 Favored Glycine 0 CA--C 1.537 1.425 0 CA-C-O 121.677 0.598 . . . . 0.0 112.797 -165.085 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -125.58 -20.84 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -165.831 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -171.43 22.18 0.08 OUTLIER Glycine 0 CA--C 1.535 1.337 0 N-CA-C 117.538 1.775 . . . . 0.0 117.538 -175.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -66.97 -51.0 60.53 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 120.183 1.991 . . . . 0.0 112.459 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -135.29 30.52 3.25 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.395 2.278 . . . . 0.0 108.716 161.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -16.25 22.99 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 127.18 2.324 . . . . 0.0 115.258 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -63.26 -37.27 86.6 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.459 1.504 . . . . 0.0 113.542 171.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -141.97 -4.16 1.07 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -166.354 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.7 p . . . . . 0 CA--C 1.555 1.15 0 O-C-N 120.329 -1.482 . . . . 0.0 114.922 176.047 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.71 0 CA-C-O 120.84 0.353 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.66 -50.54 71.47 Favored Pre-proline 0 CA--C 1.552 1.027 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 175.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.43 -44.35 0.12 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.023 1.815 . . . . 0.0 113.773 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? 61.48 -55.09 0.11 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 128.047 2.539 . . . . 0.0 114.612 -167.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -153.8 159.83 42.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.656 2.782 . . . . 0.0 111.359 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -76.3 -53.17 8.6 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.614 -0.679 . . . . 0.0 109.945 157.682 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -134.84 161.54 34.91 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.632 1.973 . . . . 0.0 110.207 176.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . 0.318 14.6 p 47.02 -159.39 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 126.397 1.879 . . . . 0.0 112.967 -161.461 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -145.43 28.96 1.17 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -163.219 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -91.29 145.62 24.5 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.287 1.035 . . . . 0.0 112.357 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.19 -28.79 66.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -165.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -81.81 -13.65 79.26 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 116.169 1.227 . . . . 0.0 116.169 -164.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -142.65 81.85 1.75 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.642 1.221 . . . . 0.0 113.437 -169.771 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.12 -178.33 0.16 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.224 1.41 . . . . 0.0 113.211 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.63 -68.81 0.11 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 126.495 1.918 . . . . 0.0 114.81 -166.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -68.9 -20.63 64.25 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -91.7 -24.53 19.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.746 1.618 . . . . 0.0 113.103 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.7 t -57.06 -43.99 99.58 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.657 1.583 . . . . 0.0 114.83 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo . . . . . 0 CA--C 1.544 1.013 0 C-N-CA 122.554 2.169 . . . . 0.0 115.454 -174.701 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 12.4 pt -83.98 142.34 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.041 1.336 . . . . 0.0 112.774 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.37 101.99 12.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.215 1.006 . . . . 0.0 110.2 171.716 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m 44.39 49.72 8.07 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.232 1.813 . . . . 0.0 115.681 170.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.9 t80 57.85 32.72 22.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.976 1.71 . . . . 0.0 115.255 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 52.8 t -66.61 -19.73 65.84 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.191 1.396 . . . . 0.0 112.791 170.236 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -166.58 -171.09 32.3 Favored Glycine 0 CA--C 1.531 1.09 0 O-C-N 120.695 -1.253 . . . . 0.0 114.688 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -88.41 127.92 35.51 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.419 1.087 . . . . 0.0 111.98 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -58.15 -22.54 51.62 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -83.78 -11.47 57.04 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -141.18 -1.32 1.37 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -169.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -83.97 142.8 30.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.82 -1.175 . . . . 0.0 113.345 -175.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -156.45 159.48 38.7 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.074 1.349 . . . . 0.0 111.116 175.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.1 m -60.47 -29.96 69.38 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -169.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.93 4.47 34.76 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 173.2 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -108.44 -19.05 13.59 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.886 1.674 . . . . 0.0 112.941 176.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 m -14.35 -65.55 0.03 OUTLIER Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 130.198 3.399 . . . . 0.0 117.191 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -67.63 -17.44 48.05 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.927 2.418 . . . . 0.0 115.802 -171.516 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -100.53 53.43 0.87 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.468 1.507 . . . . 0.0 112.143 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -134.42 -107.67 0.23 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.954 1.302 . . . . 0.0 112.253 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.262 33.4 mt -96.54 22.5 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 125.37 1.468 . . . . 0.0 110.736 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -133.5 153.79 51.35 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.318 -1.489 . . . . 0.0 112.031 165.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 19.7 p -102.17 169.32 8.8 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 112.125 174.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.3 m -59.63 143.33 50.79 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt 58.63 11.02 1.6 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.351 1.86 . . . . 0.0 114.716 -173.69 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 73.0 m -138.79 174.72 10.23 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.915 1.686 . . . . 0.0 112.843 -170.644 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -114.5 5.04 15.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.413 1.485 . . . . 0.0 114.088 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -153.2 150.51 29.09 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.472 1.509 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.8 m -77.75 13.64 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.666 -1.271 . . . . 0.0 111.858 168.539 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.72 -136.29 0.13 Allowed Glycine 0 CA--C 1.531 1.062 0 C-N-CA 127.833 2.635 . . . . 0.0 114.359 -172.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 57.0 -147.38 0.53 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.095 0.958 . . . . 0.0 111.532 -173.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.9 p90 -93.37 176.49 6.37 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.805 1.242 . . . . 0.0 113.764 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -23.36 134.13 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 130.618 3.567 . . . . 0.0 116.133 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.1 m 55.59 47.52 20.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.657 1.583 . . . . 0.0 113.918 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.255 14.4 pt20 50.39 43.86 26.79 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.725 2.01 . . . . 0.0 114.593 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.555 1.138 0 C-N-CA 127.527 2.331 . . . . 0.0 115.267 -171.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.477 0.909 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.1 pm0 -108.83 -2.41 18.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.476 1.91 . . . . 0.0 114.372 -173.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 57.1 m -77.31 -5.17 48.51 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -163.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.284 10.9 t 59.34 -39.47 0.07 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 129.034 2.934 . . . . 0.0 118.211 -174.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -81.35 -1.96 47.39 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.575 -1.328 . . . . 0.0 113.558 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.3 m -107.84 177.84 4.7 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.719 1.608 . . . . 0.0 111.994 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.9 tptt 68.5 138.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.867 2.067 . . . . 0.0 111.32 -156.295 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 t 54.95 -171.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.34 -143.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 62.7 mttm 60.91 -8.94 0.07 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 129.047 2.939 . . . . 0.0 116.301 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 83.0 tttt 57.81 111.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 128.302 2.641 . . . . 0.0 112.508 -161.736 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -76.45 148.73 37.05 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.6 p -133.59 113.95 12.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.916 1.686 . . . . 0.0 110.891 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -66.9 140.05 57.76 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.116 -0.99 . . . . 0.0 111.419 -175.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 60.22 10.18 2.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 126.903 2.081 . . . . 0.0 116.115 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtm180 -130.43 -50.18 1.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.289 1.436 . . . . 0.0 113.14 -175.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 85.0 m . . . . . 0 CA--C 1.554 1.125 0 C-N-CA 128.538 2.735 . . . . 0.0 114.468 -170.749 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 CA--C 1.541 0.633 0 CA-C-O 120.8 0.333 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -142.9 154.79 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.276 1.43 . . . . 0.0 111.642 -177.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -136.92 143.69 43.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.258 1.823 . . . . 0.0 111.164 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -132.85 157.9 43.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.881 1.672 . . . . 0.0 112.327 176.302 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.76 -177.75 2.9 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.196 0.999 . . . . 0.0 112.145 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -57.29 150.83 40.48 Favored Pre-proline 0 N--CA 1.478 0.936 0 C-N-CA 124.011 0.924 . . . . 0.0 111.192 171.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 149.37 88.21 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.355 2.703 . . . . 0.0 113.348 -173.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -69.79 160.62 31.39 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -170.912 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.2 t -121.72 151.88 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.023 2.129 . . . . 0.0 108.506 169.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 99.1 mt -57.28 142.1 76.27 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 123.803 0.841 . . . . 0.0 112.607 -174.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -77.27 -15.16 16.16 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.302 2.668 . . . . 0.0 113.606 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 125.22 1.408 . . . . 0.0 112.019 -179.974 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.552 1.034 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -63.56 -16.11 59.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 -166.259 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -63.91 -20.12 65.62 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.181 1.392 . . . . 0.0 114.545 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.1 p -107.63 8.13 28.95 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.638 1.575 . . . . 0.0 113.819 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.51 131.83 1.94 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 126.017 1.77 . . . . 0.0 112.284 -166.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.85 112.99 0.26 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.25 1.405 . . . . 0.0 113.232 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -69.84 -9.3 54.26 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -174.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 179.96 124.08 0.87 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.801 1.191 . . . . 0.0 111.638 170.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -144.16 -46.15 0.26 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.614 0.766 . . . . 0.0 113.045 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -130.3 37.31 3.89 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.23 1.812 . . . . 0.0 109.266 165.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.44 -17.9 27.55 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 126.815 2.15 . . . . 0.0 115.077 -170.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.62 -34.56 67.38 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.497 1.519 . . . . 0.0 113.455 171.096 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -129.07 -25.26 2.78 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.722 1.609 . . . . 0.0 113.675 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 CA--C 1.551 1.007 0 C-N-CA 124.619 1.168 . . . . 0.0 113.699 -177.404 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.675 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.36 -51.5 13.13 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 123.957 0.903 . . . . 0.0 112.783 165.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.64 -29.95 2.65 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.811 2.34 . . . . 0.0 114.328 178.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 58.76 -63.78 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.438 2.695 . . . . 0.0 115.962 -175.335 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -158.11 164.34 36.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 128.07 2.548 . . . . 0.0 110.302 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -68.28 -31.42 70.86 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.997 -1.064 . . . . 0.0 113.171 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.79 -51.02 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.653 1.581 . . . . 0.0 112.466 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 p -91.11 63.07 4.99 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.64 1.576 . . . . 0.0 113.387 -172.16 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.6 m -35.92 89.46 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.665 3.586 . . . . 0.0 117.387 -172.339 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -137.67 143.09 41.17 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.998 2.119 . . . . 0.0 108.68 164.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -74.39 158.25 34.24 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -169.432 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.25 -23.54 23.87 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 125.567 1.556 . . . . 0.0 115.145 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.264 13.9 p-80 -123.9 78.16 1.6 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 123.235 1.493 . . . . 0.0 111.756 173.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.63 -179.54 0.38 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.613 1.965 . . . . 0.0 113.472 174.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.47 -66.55 0.19 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.967 2.107 . . . . 0.0 114.512 -174.073 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -74.76 -16.49 60.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -94.78 -14.14 24.97 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.374 1.47 . . . . 0.0 113.203 -177.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -64.0 143.54 98.21 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 124.409 1.084 . . . . 0.0 111.607 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo . . . . . 0 CA--C 1.54 0.802 0 C-N-CA 122.862 2.375 . . . . 0.0 115.591 -164.629 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.7 tt . . . . . 0 N--CA 1.47 0.54 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.6 mt 56.04 -74.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 127.642 2.377 . . . . 0.0 112.708 -172.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 38.9 t -156.03 78.71 0.97 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.28 2.632 . . . . 0.0 106.955 172.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m 49.75 51.51 16.38 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 8.8 t80 61.51 42.94 10.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.065 2.146 . . . . 0.0 113.908 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -102.54 172.63 6.75 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.122 1.369 . . . . 0.0 112.374 169.059 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.93 -171.64 38.33 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.829 1.491 . . . . 0.0 116.829 158.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -123.86 5.82 8.72 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.585 1.554 . . . . 0.0 112.684 174.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.303 5.0 t 53.88 154.71 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.716 2.006 . . . . 0.0 115.133 -150.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.1 t70 59.21 -52.58 0.06 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 129.984 3.314 . . . . 0.0 115.085 -168.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -94.98 67.1 3.08 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.231 2.212 . . . . 0.0 111.021 176.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -147.85 138.66 23.25 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.739 1.615 . . . . 0.0 110.646 177.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -150.75 157.42 42.92 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.928 1.291 . . . . 0.0 110.394 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' SER . . . . . 0.442 ' HA ' ' SG ' ' A' ' 39' ' ' CYS . 72.2 p -60.18 -22.04 62.45 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.455 1.902 . . . . 0.0 115.031 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -72.6 -25.93 61.51 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.932 1.293 . . . . 0.0 112.724 173.299 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -112.95 -34.15 5.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.959 1.303 . . . . 0.0 114.435 -169.14 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 36' ' ' SER 0.335 64.6 m 36.07 -101.69 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.163 0 C-N-CA 128.354 2.662 . . . . 0.0 116.485 172.856 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -76.48 -17.33 16.47 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.14 1.893 . . . . 0.0 115.124 -165.435 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.44 -1.83 14.54 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -162.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -20.81 53.55 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.421 1.488 . . . . 0.0 114.659 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.67 64.01 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.476 1.51 . . . . 0.0 109.199 -169.656 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -170.11 163.72 9.19 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.867 2.067 . . . . 0.0 111.041 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 81.3 m -131.5 173.41 11.13 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.644 1.577 . . . . 0.0 110.282 168.359 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -78.95 -42.52 26.66 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.009 1.724 . . . . 0.0 114.054 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.44 -27.78 22.51 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.876 1.27 . . . . 0.0 112.493 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 6.6 p -129.59 124.4 33.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.166 1.386 . . . . 0.0 110.995 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -84.39 149.69 25.84 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.226 1.41 . . . . 0.0 114.107 -168.264 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 62.32 9.8 3.5 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.4 m -134.82 137.29 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.851 1.26 . . . . 0.0 113.437 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.71 160.64 26.63 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.82 1.2 . . . . 0.0 112.474 170.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -75.08 81.05 2.25 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -174.444 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -136.31 160.3 39.14 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 127.48 2.312 . . . . 0.0 110.872 170.392 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 146.21 36.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.118 0.485 . . . . 0.0 110.256 169.129 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 21.2 m 61.67 -2.5 0.26 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -171.233 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -102.25 -53.51 2.9 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.383 1.073 . . . . 0.0 111.184 170.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.4 m . . . . . 0 CA--C 1.558 1.278 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -178.587 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.9 t . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -96.36 4.88 51.94 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.016 1.726 . . . . 0.0 113.13 -171.401 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 85.3 m -85.18 -16.21 41.1 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.256 7.1 t 56.8 -46.66 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 129.35 3.06 . . . . 0.0 117.809 -168.339 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -85.07 -22.62 28.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.455 1.502 . . . . 0.0 113.186 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 58.1 m -82.97 131.09 35.2 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.801 0.841 . . . . 0.0 110.799 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -115.19 2.01 13.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 83.8 p -78.94 169.68 17.84 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.441 1.496 . . . . 0.0 113.43 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -95.71 8.96 41.98 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.497 1.519 . . . . 0.0 114.425 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.05 -148.32 0.38 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.077 2.151 . . . . 0.0 109.783 177.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 44.8 t60 58.01 -123.39 1.49 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.025 1.33 . . . . 0.0 113.292 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t 59.32 -47.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.95 2.5 . . . . 0.0 115.936 -159.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.4 tptp 51.65 40.33 27.05 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.978 2.511 . . . . 0.0 113.86 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 57.08 61.31 2.62 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.958 1.303 . . . . 0.0 113.222 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 61.0 56.08 2.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.192 2.197 . . . . 0.0 114.593 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t . . . . . 0 CA--C 1.556 1.193 0 C-N-CA 126.529 1.932 . . . . 0.0 115.816 164.574 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 N--CA 1.475 0.785 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.7 t30 61.09 6.66 1.32 Allowed 'General case' 0 CA--C 1.56 1.356 0 N-CA-C 118.008 2.596 . . . . 0.0 118.008 175.436 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -131.44 -23.22 2.39 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -176.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 85.7 mttt 66.12 149.53 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 130.041 3.336 . . . . 0.0 115.634 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -88.82 156.65 18.82 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.413 1.085 . . . . 0.0 113.11 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -150.98 152.67 31.98 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.487 1.915 . . . . 0.0 111.83 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.87 -15.06 12.14 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.35 2.7 . . . . 0.0 114.358 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt 60.53 -5.52 0.1 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.093 2.557 . . . . 0.0 116.688 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 20.2 m -133.72 145.63 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 127.045 2.138 . . . . 0.0 109.86 166.422 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -147.6 99.78 3.81 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 123.815 0.846 . . . . 0.0 112.233 -173.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -65.74 148.06 86.34 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.495 2.797 . . . . 0.0 112.295 167.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.5 p90 . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 177.734 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 25.1 p . . . . . 0 CA--C 1.545 0.77 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -40.26 -37.16 0.61 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 127.984 2.514 . . . . 0.0 116.31 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -92.81 -12.5 31.01 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -166.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 12.1 p -131.28 179.33 6.09 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.331 1.052 . . . . 0.0 113.245 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -58.84 154.22 28.21 Favored Glycine 0 CA--C 1.538 1.523 0 C-N-CA 124.155 0.883 . . . . 0.0 114.054 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.57 -36.15 1.82 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 125.096 1.332 . . . . 0.0 114.701 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt 45.88 48.56 12.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.571 2.348 . . . . 0.0 113.69 171.396 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 174.0 17.5 0.02 OUTLIER Glycine 0 CA--C 1.536 1.385 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 -174.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -141.13 144.31 34.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.54 1.67 . . . . 0.0 113.106 -176.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 35.08 40.55 0.06 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 128.202 2.601 . . . . 0.0 116.571 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.23 -19.9 41.23 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 116.225 1.25 . . . . 0.0 116.225 -165.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -78.63 -44.18 24.5 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.097 1.359 . . . . 0.0 113.438 173.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -103.43 -20.75 13.95 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.898 1.679 . . . . 0.0 113.883 -165.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 15.9 p . . . . . 0 CA--C 1.545 0.766 0 C-N-CA 124.742 1.217 . . . . 0.0 114.243 178.667 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.667 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.8 -47.24 62.76 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.436 1.094 . . . . 0.0 113.553 164.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -77.88 -31.44 3.13 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.667 2.245 . . . . 0.0 114.033 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 59.83 -65.99 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 128.278 2.631 . . . . 0.0 114.488 -169.029 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -160.68 170.15 21.39 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 128.078 2.551 . . . . 0.0 110.746 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -73.82 -31.98 63.5 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.808 -1.183 . . . . 0.0 114.15 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -157.58 -58.72 0.08 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.768 1.227 . . . . 0.0 112.201 -177.374 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.1 p -77.3 130.7 37.53 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.468 0.707 . . . . 0.0 111.657 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.4 m -81.15 42.37 0.65 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.632 1.716 . . . . 0.0 115.632 -165.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -95.22 150.89 19.73 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.954 1.702 . . . . 0.0 111.45 176.422 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 ptm85 -76.01 171.56 14.24 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 113.871 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.8 -78.72 1.98 Allowed Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.839 1.209 . . . . 0.0 112.692 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -79.93 85.9 5.51 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.592 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -54.69 176.71 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.047 1.739 . . . . 0.0 113.669 168.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.58 -66.19 0.21 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.945 2.098 . . . . 0.0 114.444 -174.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -78.07 -5.46 51.56 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -89.94 -37.4 14.4 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.127 1.371 . . . . 0.0 111.939 175.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.8 t -56.13 -47.58 98.55 Favored Pre-proline 0 CA--C 1.549 0.914 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--N 1.354 0.859 0 C-N-CA 122.294 1.996 . . . . 0.0 115.473 -164.773 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.6 pp . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.88 148.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 125.204 1.402 . . . . 0.0 110.757 172.55 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.8 m -68.54 158.58 33.59 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.64 -0.662 . . . . 0.0 112.033 163.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -67.19 105.29 1.67 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.26 1.024 . . . . 0.0 112.492 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.5 t80 61.15 5.2 1.0 Allowed 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 117.999 2.592 . . . . 0.0 117.999 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 20.3 p -106.1 1.14 26.06 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -150.41 154.35 25.59 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.43 1.014 . . . . 0.0 114.937 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -113.44 20.44 16.07 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.887 1.675 . . . . 0.0 113.896 -174.601 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.277 2.8 t 60.44 -29.46 0.05 Allowed 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 129.608 3.163 . . . . 0.0 118.036 174.327 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.22 -24.81 27.69 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.506 1.522 . . . . 0.0 113.796 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -132.39 5.67 4.08 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.954 1.302 . . . . 0.0 114.049 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -89.86 148.5 23.13 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.139 -0.975 . . . . 0.0 113.383 -171.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -147.46 132.51 18.24 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.117 0.967 . . . . 0.0 111.725 170.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.9 m -58.7 -26.04 63.49 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.161 1.784 . . . . 0.0 114.677 -173.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -70.7 -21.32 62.58 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.068 1.347 . . . . 0.0 113.744 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -125.14 -19.8 5.05 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.809 1.244 . . . . 0.0 114.313 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.383 63.3 m 47.77 -106.92 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 127.822 2.449 . . . . 0.0 115.602 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -62.33 102.41 0.27 Allowed 'Trans proline' 0 C--N 1.356 0.962 0 CA-C-N 123.503 2.287 . . . . 0.0 113.771 -164.725 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -135.67 -15.37 1.84 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.662 1.985 . . . . 0.0 113.181 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -133.52 177.52 7.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.891 1.676 . . . . 0.0 111.409 -178.077 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 76.6 mt 65.1 -76.25 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 127.219 2.208 . . . . 0.0 111.687 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -59.54 162.82 4.63 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.643 0.777 . . . . 0.0 112.519 162.774 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 7.8 t -109.08 123.9 49.9 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.332 1.053 . . . . 0.0 109.284 163.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m 41.91 37.55 0.83 Allowed 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 165.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt 55.08 26.17 7.88 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.95 2.5 . . . . 0.0 115.221 -175.452 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.7 p -81.32 -61.73 1.86 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.154 0.888 . . . . 0.0 111.687 170.455 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -153.68 168.79 25.08 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.301 1.84 . . . . 0.0 111.329 172.631 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -56.61 4.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 130.89 3.676 . . . . 0.0 117.337 -175.554 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 m -164.82 -30.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.859 1 C-N-CA 132.04 4.136 . . . . 0.0 108.807 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.49 -157.95 19.37 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 127.181 2.324 . . . . 0.0 113.526 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -75.44 64.24 1.56 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.781 2.033 . . . . 0.0 112.609 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.6 t80 49.15 -128.53 2.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.96 2.904 . . . . 0.0 112.851 178.944 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 52.47 43.63 30.8 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.854 1.661 . . . . 0.0 113.06 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.5 m 52.03 63.44 2.24 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.916 1.686 . . . . 0.0 113.836 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 58.5 41.38 22.7 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.796 1.639 . . . . 0.0 113.172 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 79.2 m . . . . . 0 CA--C 1.551 0.998 0 C-N-CA 129.202 3.001 . . . . 0.0 116.533 -179.937 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 120.887 0.375 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.98 -21.43 66.49 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 24.9 m -87.18 134.59 33.51 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.155 0.982 . . . . 0.0 111.697 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.2 t -63.31 -31.06 72.11 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' LEU . . . . . 0.537 HD23 ' H ' ' A' ' 69' ' ' LEU . 2.6 pt? -104.55 18.78 21.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.889 1.676 . . . . 0.0 115.24 -172.162 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 61.9 m -127.98 158.96 36.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.132 1.373 . . . . 0.0 111.25 176.522 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -151.23 112.82 4.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.436 1.094 . . . . 0.0 110.899 169.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m 57.24 12.22 1.3 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 118.028 2.603 . . . . 0.0 118.028 168.977 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -141.89 152.59 43.72 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.496 1.918 . . . . 0.0 110.754 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -84.29 157.56 21.5 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.244 1.018 . . . . 0.0 112.2 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 33.8 p80 -135.81 178.78 6.78 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.095 2.158 . . . . 0.0 111.028 -172.177 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.2 t -114.7 166.33 11.86 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.779 1.232 . . . . 0.0 112.841 173.451 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -61.66 -17.88 57.25 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 127.732 2.413 . . . . 0.0 114.159 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -67.99 -25.77 65.58 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 169.047 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -92.72 -57.83 2.54 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.762 1.625 . . . . 0.0 110.873 172.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 24.2 p . . . . . 0 CA--C 1.549 0.932 0 C-N-CA 124.986 1.315 . . . . 0.0 112.136 169.717 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -85.76 -14.97 43.61 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.45 55.53 3.22 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.046 1.338 . . . . 0.0 112.467 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -66.47 155.25 38.08 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.693 1.597 . . . . 0.0 113.441 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.05 164.27 30.49 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.634 1.574 . . . . 0.0 111.739 178.317 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -67.57 158.48 82.47 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 124.36 1.064 . . . . 0.0 112.199 178.664 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -64.77 -16.03 53.27 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.367 2.712 . . . . 0.0 116.659 -174.529 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.302 21.8 ptmt 52.72 -1.81 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 129.479 3.112 . . . . 0.0 118.679 179.533 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 70.0 t -83.32 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.979 1.312 . . . . 0.0 109.709 168.804 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' LEU . . . . . 0.562 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 3.2 tm? -124.06 -46.83 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.37 1.468 . . . . 0.0 114.364 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' PRO . . . . . 0.562 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 85.6 Cg_endo -73.45 158.77 47.58 Favored 'Trans proline' 0 C--N 1.355 0.906 0 CA-C-N 122.097 1.785 . . . . 0.0 113.347 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 125.671 1.588 . . . . 0.0 112.758 -175.422 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 17.6 t . . . . . 0 CA--C 1.55 0.948 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -136.52 24.32 3.17 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.802 1.641 . . . . 0.0 112.488 172.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -139.3 167.61 21.69 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.22 1.808 . . . . 0.0 111.725 -171.485 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.285 18.6 p 47.25 23.65 0.35 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.999 2.52 . . . . 0.0 117.341 173.409 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.54 -31.64 2.01 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.707 1.622 . . . . 0.0 114.283 178.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 138.24 -161.33 25.61 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.977 1.275 . . . . 0.0 114.719 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -77.39 -176.74 4.32 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.222 1.809 . . . . 0.0 114.377 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.14 -53.53 4.87 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.153 1.358 . . . . 0.0 114.742 173.218 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -77.69 142.28 38.88 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.099 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 40.79 22.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 129.767 3.227 . . . . 0.0 117.877 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.25 -23.31 52.76 Favored Glycine 0 CA--C 1.536 1.353 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 -161.691 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -61.18 -44.6 97.05 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.054 1.342 . . . . 0.0 112.963 173.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -105.76 -30.73 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.259 1.824 . . . . 0.0 113.031 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 53.6 t . . . . . 0 CA--C 1.538 0.487 0 C-N-CA 124.728 1.211 . . . . 0.0 110.445 179.697 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.29 -55.63 0.88 Allowed Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.304 1.041 . . . . 0.0 112.421 162.996 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.16 -37.03 3.68 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.949 2.432 . . . . 0.0 113.927 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.336 0.0 OUTLIER 53.12 -31.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 131.51 3.924 . . . . 0.0 118.271 -171.235 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.58 -179.79 8.53 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.488 1.915 . . . . 0.0 111.522 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -101.47 146.41 27.67 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.692 -0.63 . . . . 0.0 109.33 144.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.4 t30 59.45 -69.88 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 165.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.1 p -86.13 -15.35 41.38 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.611 1.565 . . . . 0.0 115.167 -170.036 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 m 55.92 30.73 16.53 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 160.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -142.62 19.79 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 175.312 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -144.59 143.08 30.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.166 1.386 . . . . 0.0 111.202 -177.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.98 -12.98 61.02 Favored Glycine 0 N--CA 1.475 1.244 0 N-CA-C 116.826 1.49 . . . . 0.0 116.826 -162.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -68.97 93.38 0.56 Allowed 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.576 1.188 . . . . 0.0 112.37 171.163 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -53.49 175.62 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.987 1.715 . . . . 0.0 113.595 172.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -62.01 0.94 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.943 1.297 . . . . 0.0 114.061 -165.463 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.48 -9.18 59.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -84.56 -31.55 24.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.075 1.35 . . . . 0.0 111.974 173.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.4 t -64.64 136.81 96.92 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.843 1.657 . . . . 0.0 111.073 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 CA--C 1.537 0.667 0 C-N-CA 123.797 2.998 . . . . 0.0 114.713 -170.851 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.9 pp . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.0 mt -125.14 137.15 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 111.027 -167.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 32.8 t -61.35 109.37 1.13 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.17 1.388 . . . . 0.0 111.708 170.702 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.6 m 47.38 16.97 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 127.722 2.409 . . . . 0.0 116.724 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 48.45 34.18 4.58 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.98 1.312 . . . . 0.0 113.347 -168.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.7 p -96.93 -22.77 16.67 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -164.61 157.69 30.16 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.851 1.215 . . . . 0.0 112.151 177.553 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.56 121.89 14.97 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.318 1.059 . . . . 0.0 112.631 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.5 t -59.13 -26.89 65.11 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -75.27 -22.16 57.99 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -141.41 -18.25 0.79 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 -168.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 149.92 45.74 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.077 1.308 . . . . 0.0 112.85 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -147.08 167.74 23.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.589 1.556 . . . . 0.0 110.029 176.148 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.7 t -38.81 -45.64 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.986 2.115 . . . . 0.0 115.899 -172.62 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -73.59 -15.89 61.26 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -127.38 0.55 6.32 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.104 1.762 . . . . 0.0 113.539 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.8 t -40.3 -50.99 6.41 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 128.005 2.522 . . . . 0.0 115.81 -172.572 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -79.33 -2.83 12.61 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 123.192 2.595 . . . . 0.0 116.483 -176.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -128.83 11.29 6.1 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -162.008 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.27 24.14 4.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.2 mt -128.77 62.96 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 126.578 1.951 . . . . 0.0 108.742 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -145.4 150.26 36.22 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.265 -1.522 . . . . 0.0 113.99 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -76.25 168.0 20.84 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.258 1.023 . . . . 0.0 112.042 174.625 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 21.2 m -85.1 -18.95 32.69 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.2 tppt? -127.95 -9.01 5.46 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.043 1.337 . . . . 0.0 114.37 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 p -145.55 167.33 23.28 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.033 1.333 . . . . 0.0 111.776 174.88 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -76.89 132.19 38.98 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.43 -0.794 . . . . 0.0 112.566 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.63 141.85 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.836 2.454 . . . . 0.0 116.186 179.481 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.2 m -80.33 -21.41 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 O-C-N 120.451 -1.405 . . . . 0.0 110.797 157.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.92 -6.48 24.85 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.949 1.738 . . . . 0.0 116.399 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . 0.263 0.7 OUTLIER -87.64 -132.49 0.07 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.746 1.273 . . . . 0.0 113.122 172.453 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -61.6 126.42 27.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -157.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 45.85 30.84 0.93 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.647 2.379 . . . . 0.0 113.761 -175.086 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.1 p 49.8 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.805 3.642 . . . . 0.0 119.061 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -147.34 8.55 0.92 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.696 1.998 . . . . 0.0 112.982 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.8 m . . . . . 0 CA--C 1.563 1.48 0 N-CA-C 117.306 2.335 . . . . 0.0 117.306 -170.928 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 -70.26 -12.66 61.74 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.412 1.485 . . . . 0.0 113.238 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.3 m -111.8 166.83 10.85 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.22 1.408 . . . . 0.0 112.131 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 57.1 p -116.09 -3.43 12.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.894 1.677 . . . . 0.0 112.882 -158.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 pp -132.15 -3.42 3.52 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.063 2.145 . . . . 0.0 113.252 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 67.3 m -86.7 157.15 19.71 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.575 1.15 . . . . 0.0 112.191 -177.321 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptt -133.99 7.23 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.7 t -149.27 154.4 38.98 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.676 1.19 . . . . 0.0 112.138 175.675 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -83.3 -28.05 29.37 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.283 1.433 . . . . 0.0 114.454 -174.113 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -88.82 70.22 8.67 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.517 1.127 . . . . 0.0 111.942 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.9 p-80 -139.55 175.56 9.46 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.083 1.353 . . . . 0.0 112.322 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -133.49 165.34 25.1 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.691 1.597 . . . . 0.0 111.336 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -58.56 -32.61 69.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.204 1.402 . . . . 0.0 112.981 175.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -74.47 -23.06 58.83 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.646 1.178 . . . . 0.0 112.985 173.015 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -103.85 -12.24 17.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.388 1.875 . . . . 0.0 114.059 -173.798 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 46.3 m . . . . . 0 CA--C 1.55 0.961 0 C-N-CA 125.346 1.458 . . . . 0.0 111.55 176.96 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 . . . . . 0 CA--C 1.547 0.86 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -75.93 172.8 12.1 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.314 1.046 . . . . 0.0 111.844 176.531 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -61.84 122.74 16.17 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.349 -0.845 . . . . 0.0 111.286 176.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -146.33 147.77 31.69 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.19 1.796 . . . . 0.0 111.567 -173.708 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 53.98 -176.66 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.397 1.479 . . . . 0.0 113.773 -165.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.15 161.8 33.04 Favored Pre-proline 0 N--CA 1.476 0.838 0 C-N-CA 125.354 1.461 . . . . 0.0 112.436 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.37 -172.66 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 124.296 3.331 . . . . 0.0 113.819 168.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -66.8 9.73 0.17 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 126.84 2.056 . . . . 0.0 115.278 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t 65.12 121.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 128.891 2.877 . . . . 0.0 113.489 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -72.05 151.75 92.71 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.003 0.921 . . . . 0.0 112.623 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -64.9 128.42 20.77 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.401 2.068 . . . . 0.0 113.025 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 . . . . . 0 N--CA 1.473 0.684 0 C-N-CA 124.071 0.948 . . . . 0.0 112.26 169.696 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 31.9 t . . . . . 0 CA--C 1.539 0.52 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -138.54 -10.11 1.41 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -176.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -90.11 -44.82 9.54 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -161.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.8 p -119.06 5.11 11.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.266 1.826 . . . . 0.0 113.558 177.44 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 170.8 -172.28 44.18 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.428 1.966 . . . . 0.0 111.44 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -75.92 177.3 50.24 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 123.545 0.593 . . . . 0.0 113.341 170.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -54.27 140.19 33.81 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.378 1.471 . . . . 0.0 111.908 173.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 156.83 -9.34 0.25 Allowed Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.776 1.87 . . . . 0.0 117.776 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -137.49 -167.26 2.09 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.955 1.877 . . . . 0.0 112.942 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -69.42 45.39 0.06 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.313 1.845 . . . . 0.0 113.236 173.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -53.46 -21.14 12.64 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 128.188 2.804 . . . . 0.0 115.573 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -75.57 -44.56 42.6 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.304 1.052 . . . . 0.0 112.825 171.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -88.3 -11.42 46.5 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.511 1.524 . . . . 0.0 113.167 -177.431 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 2.1 p . . . . . 0 CA--C 1.548 0.892 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -176.308 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.71 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -84.16 -49.18 0.66 Allowed Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 125.092 1.357 . . . . 0.0 113.19 159.731 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.2 -29.83 6.06 Favored 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.796 2.331 . . . . 0.0 114.857 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? 62.33 -63.45 0.1 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.968 2.507 . . . . 0.0 114.647 -172.282 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.4 t -156.82 172.3 18.88 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.758 2.423 . . . . 0.0 111.245 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -73.51 -39.62 64.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.13 -0.981 . . . . 0.0 113.417 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -155.97 -58.34 0.1 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.9 1.28 . . . . 0.0 113.105 -171.571 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.9 p -79.01 -9.74 59.62 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 46.62 51.76 11.77 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 159.829 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -143.84 6.12 1.38 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -175.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -150.41 157.52 43.13 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.295 1.838 . . . . 0.0 110.273 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.14 -9.52 42.1 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.267 1.267 . . . . 0.0 116.267 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -72.97 94.49 1.87 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.962 1.381 . . . . 0.0 113.098 175.514 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -54.75 175.75 0.05 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.857 2.063 . . . . 0.0 113.79 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.01 -63.66 0.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.827 2.051 . . . . 0.0 114.433 -172.389 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -82.6 -12.47 57.67 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.324 1.85 . . . . 0.0 115.382 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -83.47 -23.42 32.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.619 1.168 . . . . 0.0 111.992 171.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.9 t -61.25 -52.8 68.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 120.908 -1.12 . . . . 0.0 113.386 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo . . . . . 0 CA--C 1.542 0.922 0 C-N-CA 122.849 2.366 . . . . 0.0 111.936 168.222 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.4 mt . . . . . 0 CA--C 1.543 0.679 0 CA-C-O 121.165 0.507 . . . . 0.0 110.095 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.4 pt -54.69 128.68 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.877 1.271 . . . . 0.0 112.623 178.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 17.3 p -78.99 -21.98 46.21 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 t -157.39 -162.63 1.23 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.125 2.17 . . . . 0.0 110.014 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.18 49.29 0.67 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.285 1.834 . . . . 0.0 112.253 174.559 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.3 p -147.85 150.51 34.3 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.636 1.974 . . . . 0.0 110.954 177.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.11 -179.12 28.75 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 124.958 1.266 . . . . 0.0 113.363 -167.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -107.3 145.95 32.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.426 1.49 . . . . 0.0 110.662 172.966 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.1 t -66.88 -5.28 11.82 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -114.03 -11.17 12.78 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 126.267 1.827 . . . . 0.0 114.178 170.477 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -157.27 105.7 2.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.532 1.533 . . . . 0.0 111.205 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -130.83 -21.34 2.74 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.514 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -64.23 -40.31 95.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.691 1.132 . . . . 0.0 112.143 173.645 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t 50.03 -152.78 0.15 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.673 1.189 . . . . 0.0 111.878 -170.727 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.8 mmp_? -80.43 -38.59 29.86 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.592 -1.318 . . . . 0.0 110.283 150.205 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -136.92 87.67 2.3 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.324 1.45 . . . . 0.0 111.784 177.601 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t 17.04 -74.1 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 129.572 3.149 . . . . 0.0 117.654 157.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -71.09 72.89 2.06 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 124.612 3.541 . . . . 0.0 112.995 177.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 tptm -134.33 -173.34 3.25 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.526 2.33 . . . . 0.0 110.958 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.09 -41.36 0.19 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 128.481 2.713 . . . . 0.0 116.956 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.1 mt -133.61 93.7 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.68 1.592 . . . . 0.0 109.285 -174.271 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -139.59 167.45 22.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.661 1.584 . . . . 0.0 111.86 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 94.5 m -70.34 161.49 30.32 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.292 1.044 . . . . 0.0 111.996 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.4 m -71.41 -20.78 62.08 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.158 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -134.41 2.35 3.24 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -175.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.8 p -152.37 165.95 33.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.769 1.227 . . . . 0.0 112.288 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.7 134.1 39.32 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.557 1.543 . . . . 0.0 113.807 -172.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 59.23 156.99 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 127.225 2.21 . . . . 0.0 115.296 -172.255 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.2 m -88.85 -22.76 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 120.222 -1.549 . . . . 0.0 110.196 153.747 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.83 -20.11 63.91 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 126.402 1.953 . . . . 0.0 115.512 -173.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -79.87 -14.35 58.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -169.35 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -150.77 124.4 9.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.974 0.91 . . . . 0.0 111.793 174.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 52.97 12.05 0.25 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 126.854 2.062 . . . . 0.0 115.138 -173.414 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.304 33.0 p 48.4 23.95 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.917 2.087 . . . . 0.0 115.183 -161.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -147.35 -36.11 0.23 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 25.4 t . . . . . 0 CA--C 1.556 1.178 0 C-N-CA 126.548 1.939 . . . . 0.0 114.2 -178.522 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.5 t . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 62.6 -36.37 0.13 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 128.226 2.61 . . . . 0.0 115.809 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.5 m -78.59 -1.11 32.55 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.519 1.927 . . . . 0.0 114.902 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 15.0 t 56.36 -51.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 129.657 3.183 . . . . 0.0 118.59 -177.058 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 pp -86.37 -13.94 44.95 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.503 1.521 . . . . 0.0 113.828 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 96.7 m -79.67 168.79 18.88 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.308 1.043 . . . . 0.0 112.381 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -111.0 -30.33 7.55 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 177.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.2 p -87.27 172.89 9.54 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.388 1.475 . . . . 0.0 112.906 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 162.61 7.54 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.129 0.972 . . . . 0.0 113.376 174.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -52.82 147.05 9.51 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -173.422 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -148.19 17.34 1.07 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.564 1.545 . . . . 0.0 112.914 172.849 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.7 p -75.22 -38.77 60.5 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -152.035 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 47.89 34.78 4.24 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.657 1.583 . . . . 0.0 113.248 -169.276 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 56.73 18.04 3.51 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 126.546 1.938 . . . . 0.0 115.528 -172.448 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.3 tpt85 -125.08 -30.14 3.24 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.217 2.207 . . . . 0.0 114.136 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.8 t . . . . . 0 CA--C 1.553 1.081 0 C-N-CA 125.543 1.537 . . . . 0.0 112.441 -166.914 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 34.6 t0 . . . . . 0 CA--C 1.545 0.752 0 CA-C-O 120.929 0.395 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -110.96 157.42 19.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.23 1.812 . . . . 0.0 112.236 -174.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.92 163.87 31.19 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.592 1.557 . . . . 0.0 112.51 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 56.19 23.96 7.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.54 1.936 . . . . 0.0 114.893 176.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.41 156.9 29.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.362 1.065 . . . . 0.0 112.949 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -139.47 136.7 17.98 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 126.563 1.945 . . . . 0.0 110.57 178.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.91 143.37 54.77 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.731 2.287 . . . . 0.0 111.734 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -126.54 113.33 16.65 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.942 1.297 . . . . 0.0 110.824 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.12 19.21 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 126.391 1.876 . . . . 0.0 112.267 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.9 mt -72.56 155.76 90.79 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 125.49 1.516 . . . . 0.0 112.409 -176.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -62.13 152.9 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.062 2.508 . . . . 0.0 112.397 172.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 . . . . . 0 N--CA 1.47 0.535 0 C-N-CA 124.045 0.938 . . . . 0.0 112.794 -177.19 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.4 t . . . . . 0 CA--C 1.548 0.891 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -56.66 -35.84 68.86 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.294 -1.504 . . . . 0.0 114.084 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.05 -13.76 62.37 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -86.34 -6.43 58.95 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.985 1.714 . . . . 0.0 112.743 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 114.99 -7.64 21.56 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.313 1.911 . . . . 0.0 114.384 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 165.14 149.65 5.92 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-N 118.614 1.207 . . . . 0.0 113.89 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -65.2 -17.91 64.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.491 1.917 . . . . 0.0 114.257 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -71.86 -5.4 61.18 Favored Glycine 0 CA--C 1.538 1.482 0 N-CA-C 118.602 2.201 . . . . 0.0 118.602 -164.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -147.35 150.68 35.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.897 2.349 . . . . 0.0 115.535 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 39.16 29.44 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 129.978 3.311 . . . . 0.0 117.658 164.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.34 -11.7 35.09 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.961 1.267 . . . . 0.0 115.025 -174.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -67.86 -33.51 74.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.499 1.519 . . . . 0.0 113.92 174.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -151.39 -26.66 0.2 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -166.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 14.9 p . . . . . 0 CA--C 1.544 0.734 0 CA-C-N 120.579 1.536 . . . . 0.0 113.535 -168.306 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.568 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -75.41 -51.4 3.3 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.001 0.92 . . . . 0.0 112.471 159.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -76.05 -41.39 0.51 Allowed 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.548 2.166 . . . . 0.0 114.74 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.295 0.1 OUTLIER 50.85 -33.95 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 131.343 3.857 . . . . 0.0 119.286 -171.98 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.9 t -157.79 164.49 36.97 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.416 1.886 . . . . 0.0 112.652 171.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -74.54 -40.21 61.86 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.515 1.126 . . . . 0.0 113.307 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -158.37 -31.3 0.07 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.741 1.617 . . . . 0.0 113.101 -171.343 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 m -73.21 -163.82 0.16 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.856 0.862 . . . . 0.0 110.654 169.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.1 p -135.87 155.69 49.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.893 -1.129 . . . . 0.0 112.9 170.884 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 56.51 -173.59 0.07 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.87 2.068 . . . . 0.0 114.716 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.265 9.1 ttp180 65.6 27.19 11.52 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.2 2.2 . . . . 0.0 115.659 172.48 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.48 -17.02 0.66 Allowed Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.907 1.923 . . . . 0.0 117.907 160.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -81.14 77.63 8.01 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.202 1.501 . . . . 0.0 111.142 -178.483 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -56.99 178.74 0.05 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 128.107 2.563 . . . . 0.0 113.693 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.21 -64.44 0.32 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.616 1.966 . . . . 0.0 114.252 -171.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -78.71 -13.97 59.54 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.083 1.753 . . . . 0.0 115.296 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.87 -14.78 31.08 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.336 1.454 . . . . 0.0 113.139 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.94 -53.91 45.12 Favored Pre-proline 0 CA--C 1.549 0.923 0 CA-C-O 118.08 -0.962 . . . . 0.0 113.018 171.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo . . . . . 0 CA--C 1.543 0.933 0 C-N-CA 122.199 1.932 . . . . 0.0 111.68 169.636 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.8 mm -107.17 134.62 48.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.645 1.578 . . . . 0.0 110.631 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.7 p -87.59 141.61 28.48 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.323 1.059 . . . . 0.0 112.272 173.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.2 p -70.17 137.5 51.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.314 1.446 . . . . 0.0 114.119 -164.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 50.66 14.29 0.17 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.121 1.768 . . . . 0.0 115.217 -169.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -150.39 29.49 0.7 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.183 0.993 . . . . 0.0 112.159 -163.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.7 153.99 24.86 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 120.297 -1.502 . . . . 0.0 114.863 -176.754 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -142.58 140.72 31.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.557 1.543 . . . . 0.0 110.101 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -21.54 64.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -171.374 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -138.84 15.0 2.68 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -138.7 -1.06 1.87 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -172.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 37.0 t-80 -106.37 150.19 26.25 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.068 1.347 . . . . 0.0 113.226 -172.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -142.37 147.21 35.88 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.158 1.383 . . . . 0.0 111.188 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.5 t -54.62 -40.95 69.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.692 1.597 . . . . 0.0 114.47 -172.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -79.13 -13.38 59.77 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -104.49 -18.21 14.46 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.218 1.407 . . . . 0.0 113.42 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' CYS . . . . . 0.503 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.288 1.2 m 24.43 -88.63 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 129.989 3.316 . . . . 0.0 116.561 172.44 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.503 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 25.0 Cg_exo -70.17 -19.95 33.54 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.284 1.851 . . . . 0.0 116.709 -158.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.03 1.91 22.36 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -174.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.52 60.59 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -175.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 mt -130.21 141.22 46.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.813 1.645 . . . . 0.0 108.854 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -147.6 161.44 41.13 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.0 t -67.04 156.91 34.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.525 1.53 . . . . 0.0 112.036 168.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.4 m -65.71 -17.72 64.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.18 1.392 . . . . 0.0 114.63 174.324 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -129.63 -2.57 4.81 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.33 1.452 . . . . 0.0 114.696 -171.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 31.1 p -149.27 156.01 41.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.368 1.067 . . . . 0.0 111.835 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.39 151.52 45.11 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.647 -0.658 . . . . 0.0 112.163 174.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 59.18 175.06 0.07 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.739 1.216 . . . . 0.0 113.278 -170.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.8 m -75.94 71.14 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 O-C-N 119.813 -1.805 . . . . 0.0 109.66 167.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.39 -116.29 0.09 OUTLIER Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.458 1.98 . . . . 0.0 117.132 -159.209 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -67.9 -7.92 32.4 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 117.704 2.483 . . . . 0.0 117.704 -154.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -128.93 118.67 23.04 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.475 1.034 . . . . 0.0 112.24 176.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 43.98 26.16 0.13 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.724 2.81 . . . . 0.0 116.66 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.0 m 52.66 30.25 8.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.31 1.444 . . . . 0.0 114.786 -172.237 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -145.02 -34.34 0.35 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.127 1.371 . . . . 0.0 113.38 -174.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 86.7 m . . . . . 0 CA--C 1.555 1.17 0 C-N-CA 126.189 1.796 . . . . 0.0 114.813 -174.835 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 121.061 0.457 . . . . 0.0 112.044 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -103.69 6.7 37.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.285 1.434 . . . . 0.0 113.735 -173.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.4 m -74.11 -17.67 60.91 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 62.86 -47.76 0.2 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.212 2.605 . . . . 0.0 117.608 -166.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -86.36 0.07 54.8 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 91.8 m -111.37 156.28 21.83 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.866 1.266 . . . . 0.0 112.854 -178.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -114.48 160.95 18.62 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 126.027 1.731 . . . . 0.0 109.619 161.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.8 m -76.04 -20.83 57.44 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.638 1.347 . . . . 0.0 114.638 -172.323 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -66.84 134.13 51.47 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.521 0.728 . . . . 0.0 112.262 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.2 tttp 47.61 35.22 4.18 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.764 2.025 . . . . 0.0 114.221 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -82.51 131.61 35.21 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.824 0.85 . . . . 0.0 112.668 -171.227 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.8 m -94.3 110.96 22.68 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.914 0.886 . . . . 0.0 111.956 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.86 135.45 57.33 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.782 0.833 . . . . 0.0 111.578 -177.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 54.52 20.07 2.67 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.355 1.862 . . . . 0.0 115.669 -173.421 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -130.87 -40.04 1.2 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.43 1.492 . . . . 0.0 113.356 177.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.8 m . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 128.655 2.782 . . . . 0.0 115.667 -179.41 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -150.4 170.91 17.93 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.101 1.761 . . . . 0.0 112.087 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -97.28 141.91 29.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.387 1.075 . . . . 0.0 112.296 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -137.15 -59.2 0.7 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 125.25 1.42 . . . . 0.0 112.869 -172.358 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.66 157.04 36.02 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.973 0.909 . . . . 0.0 112.945 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 7.9 ptpp? -148.58 146.43 22.36 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.624 1.57 . . . . 0.0 112.347 -178.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 98' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 97' ' ' LYS . 31.6 Cg_exo -70.69 -33.86 12.4 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.741 2.294 . . . . 0.0 114.822 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -138.17 158.35 44.48 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.414 1.885 . . . . 0.0 111.633 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -121.05 -4.65 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.375 1.47 . . . . 0.0 113.777 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 21.2 tp -68.71 124.41 90.08 Favored Pre-proline 0 CA--C 1.551 1.01 0 O-C-N 121.183 -0.948 . . . . 0.0 110.974 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -80.64 159.42 21.98 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.84 2.36 . . . . 0.0 113.774 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 10.5 p90 . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 127.72 2.408 . . . . 0.0 109.607 173.797 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -70.87 -17.64 62.72 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -168.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -64.6 -32.09 73.59 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.159 0.89 . . . . 0.0 111.81 170.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 55.6 m -99.1 -3.64 34.15 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.393 1.877 . . . . 0.0 113.3 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.66 8.74 76.31 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.431 1.491 . . . . 0.0 115.801 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -106.94 -157.97 21.2 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 126.404 1.954 . . . . 0.0 113.606 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -140.49 150.99 44.45 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.051 2.14 . . . . 0.0 111.601 174.441 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 88.2 -152.18 23.37 Favored Glycine 0 CA--C 1.54 1.636 0 N-CA-C 116.271 1.268 . . . . 0.0 116.271 176.257 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.305 0.6 OUTLIER 47.52 -161.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 128.952 2.901 . . . . 0.0 115.661 -170.014 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -67.07 36.89 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.729 2.012 . . . . 0.0 113.736 171.726 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.17 -30.04 16.6 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 126.53 2.014 . . . . 0.0 113.877 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.1 -38.62 65.55 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.518 1.927 . . . . 0.0 114.189 172.45 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -97.68 -34.16 11.03 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.798 1.639 . . . . 0.0 111.798 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.3 t . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.486 1.514 . . . . 0.0 113.839 -177.385 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 119.348 -0.358 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 57.32 28.51 15.36 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.751 1.621 . . . . 0.0 115.145 168.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -83.83 111.7 19.44 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.073 -1.017 . . . . 0.0 113.072 -171.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.68 -51.14 22.3 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 124.259 1.024 . . . . 0.0 113.289 165.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.44 -38.25 0.78 Allowed 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 122.616 2.211 . . . . 0.0 114.267 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.403 0.0 OUTLIER 49.73 -42.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 130.843 3.657 . . . . 0.0 118.537 -169.526 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.7 t -159.66 160.57 34.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.685 1.994 . . . . 0.0 111.693 174.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -71.01 -29.25 65.14 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 173.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -161.64 -35.67 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.9 m -76.19 -21.19 56.78 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.8 m 58.49 11.87 1.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 119.012 2.967 . . . . 0.0 119.012 171.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -133.08 -3.25 3.15 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 -175.082 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -126.14 160.39 30.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.383 1.473 . . . . 0.0 111.857 -172.556 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.01 -19.23 69.7 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.03 92.57 3.18 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -57.38 179.21 0.06 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.891 2.077 . . . . 0.0 114.049 170.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -63.8 0.53 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.489 1.916 . . . . 0.0 114.475 -170.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -79.22 -11.46 59.96 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.57 1.548 . . . . 0.0 114.887 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -81.04 -37.82 28.45 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.175 0.99 . . . . 0.0 111.475 176.301 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.2 t -58.34 -37.4 54.5 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -69.49 -17.2 38.93 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.777 2.318 . . . . 0.0 114.754 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -96.15 150.31 20.66 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.485 1.514 . . . . 0.0 111.561 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm -86.19 59.35 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 123.099 1.428 . . . . 0.0 110.403 -177.055 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.3 mm -87.88 133.87 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 127.442 2.297 . . . . 0.0 108.546 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 m -61.81 142.41 57.33 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.989 -0.444 . . . . 0.0 110.812 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 73.5 m -51.1 -30.35 15.92 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 -159.477 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -142.26 11.79 1.95 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 174.657 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 44.3 m -64.59 -48.52 74.67 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.58 -1.325 . . . . 0.0 113.03 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . 0.473 ' HA2' ' H ' ' A' ' 43' ' ' ILE . . . -165.79 178.45 40.54 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -153.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.63 138.8 47.69 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.36 1.464 . . . . 0.0 109.915 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 t -56.37 -19.24 13.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.959 1.704 . . . . 0.0 114.361 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -65.65 -19.26 65.84 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 172.445 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -139.23 -34.87 0.57 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.376 1.47 . . . . 0.0 114.485 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -66.51 123.97 21.5 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.144 1.778 . . . . 0.0 112.053 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -155.22 169.37 24.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.42 1.488 . . . . 0.0 110.673 -174.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -63.12 -13.15 33.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.003 1.721 . . . . 0.0 115.509 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -109.35 2.55 20.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.295 1.838 . . . . 0.0 113.652 170.355 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -136.55 0.71 2.52 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -172.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.3 t -37.29 -51.88 2.37 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.194 2.198 . . . . 0.0 114.93 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.87 -8.45 19.06 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.436 2.758 . . . . 0.0 116.066 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -102.1 5.99 40.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.362 1.865 . . . . 0.0 113.653 -173.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -86.81 -152.64 0.19 Allowed 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.122 1.369 . . . . 0.0 113.355 -173.783 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ILE . . . . . 0.473 ' H ' ' HA2' ' A' ' 29' ' ' GLY . 95.3 mt -55.43 -40.37 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.621 1.569 . . . . 0.0 113.48 -169.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -118.74 154.33 32.96 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 24.6 p -83.29 -34.29 25.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.855 1.262 . . . . 0.0 114.031 -175.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.0 t -159.37 -155.77 0.48 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.097 1.359 . . . . 0.0 111.322 -170.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -62.79 -24.99 68.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 127.013 2.125 . . . . 0.0 112.692 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 24.4 p -89.82 155.08 19.41 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.045 1.338 . . . . 0.0 112.467 172.373 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -72.3 134.17 45.39 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -166.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 60.26 148.48 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 128.827 2.851 . . . . 0.0 117.006 176.331 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.6 m -71.8 -15.66 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 119.783 -1.823 . . . . 0.0 110.714 161.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.91 18.87 1.32 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 128.025 2.726 . . . . 0.0 116.457 -170.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.0 155.31 44.64 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.809 1.304 . . . . 0.0 112.171 174.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.9 t80 59.9 137.64 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 128.069 2.547 . . . . 0.0 115.722 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.99 148.58 20.98 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.483 1.113 . . . . 0.0 112.486 -175.251 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 m 57.32 32.68 22.15 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -168.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 54.96 45.88 25.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.625 1.97 . . . . 0.0 113.495 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.7 t 49.8 75.93 0.6 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 126.881 2.072 . . . . 0.0 113.585 -175.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -70.94 162.35 42.98 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.531 2.82 . . . . 0.0 112.664 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -66.81 139.89 57.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.385 0.674 . . . . 0.0 111.928 173.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -98.81 104.21 16.23 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.864 1.266 . . . . 0.0 111.539 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -69.95 161.84 29.22 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.867 0.867 . . . . 0.0 111.695 168.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -77.16 9.27 3.18 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt 61.94 170.1 0.12 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 127.831 2.453 . . . . 0.0 114.573 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.5 t -85.91 147.72 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.495 1.518 . . . . 0.0 110.985 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -69.98 -35.84 74.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.489 0.716 . . . . 0.0 112.019 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 22.2 m -76.55 156.74 32.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 123.688 1.709 . . . . 0.0 112.168 166.163 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 36.9 p -113.31 -15.26 12.71 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.673 2.389 . . . . 0.0 111.702 -161.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.19 -21.46 21.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.078 1.751 . . . . 0.0 111.861 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 76.0 m -99.5 -22.35 15.53 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.715 1.206 . . . . 0.0 114.222 -164.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.62 -55.48 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 129.617 3.167 . . . . 0.0 118.91 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 58.2 m -112.76 122.37 47.47 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -162.104 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt 56.54 -51.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.746 3.619 . . . . 0.0 119.24 168.18 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -80.33 151.03 29.69 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -160.158 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 54.84 177.68 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 119.241 3.052 . . . . 0.0 119.241 159.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 68.4 m -139.63 170.61 15.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 127.492 2.317 . . . . 0.0 111.39 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -56.87 -31.76 65.15 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -176.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -73.83 -19.31 60.78 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -102.01 -17.36 16.12 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.227 1.811 . . . . 0.0 112.97 174.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 43.8 t -114.75 88.96 17.47 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 125.851 1.66 . . . . 0.0 112.471 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -59.58 -18.64 48.43 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.299 3.333 . . . . 0.0 115.606 172.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.1 m -72.22 35.38 0.06 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 127.659 2.384 . . . . 0.0 115.916 -173.253 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.4 tt -137.73 136.96 45.64 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 126.843 2.057 . . . . 0.0 109.327 174.632 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -70.13 -7.06 38.53 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 -167.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 86.1 mtt85 -81.18 -16.04 54.02 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.007 1.323 . . . . 0.0 113.733 170.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -82.98 157.9 22.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.656 1.182 . . . . 0.0 112.53 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -76.55 146.21 38.52 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.797 0.839 . . . . 0.0 112.625 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.464 HD13 ' H ' ' A' ' 88' ' ' ILE . 0.2 OUTLIER -91.01 155.54 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.77 1.228 . . . . 0.0 112.338 176.419 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -95.75 27.16 3.62 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.376 1.47 . . . . 0.0 112.64 -177.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.9 m -137.53 159.12 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 126.311 1.844 . . . . 0.0 111.758 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.1 t70 57.16 23.6 8.79 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 126.151 1.781 . . . . 0.0 115.573 177.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -75.57 153.89 37.09 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.377 1.471 . . . . 0.0 112.432 171.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -68.09 134.13 50.09 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -172.527 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -150.68 161.75 42.0 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.776 1.63 . . . . 0.0 111.073 -175.372 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -59.51 156.47 13.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.006 1.322 . . . . 0.0 113.442 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -141.22 175.36 9.71 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 112.433 -176.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? 43.89 59.49 12.45 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 127.497 2.319 . . . . 0.0 115.835 174.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -76.8 70.8 6.37 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.272 3.314 . . . . 0.0 112.62 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -137.16 161.19 36.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.302 2.641 . . . . 0.0 111.104 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 26.9 m -65.1 148.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.141 0.976 . . . . 0.0 112.487 176.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.8 mt -84.92 156.6 60.81 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.281 1.032 . . . . 0.0 112.652 -177.597 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.25 159.6 30.17 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.798 2.999 . . . . 0.0 114.444 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -79.43 153.79 29.41 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.324 1.05 . . . . 0.0 112.931 176.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -86.32 152.89 22.37 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.431 1.092 . . . . 0.0 112.483 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 11.9 t -87.07 136.95 32.74 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 178.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.6 tt -146.5 13.22 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 124.655 1.182 . . . . 0.0 113.398 -169.211 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -94.31 50.82 1.4 Allowed 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 -153.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.6 p 41.72 31.73 0.22 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 129.751 3.22 . . . . 0.0 119.397 166.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.3 t80 60.94 6.46 1.22 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.619 2.367 . . . . 0.0 114.847 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -106.96 -25.02 11.81 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.716 1.607 . . . . 0.0 112.168 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.2 p -145.38 18.43 1.53 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.77 1.628 . . . . 0.0 113.963 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 162.62 -133.94 3.27 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.016 1.293 . . . . 0.0 113.292 175.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.31 -159.64 1.07 Allowed Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.908 1.718 . . . . 0.0 113.014 171.034 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -109.65 150.71 27.86 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.46 1.63 . . . . 0.0 112.941 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 154.57 -103.46 0.24 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 115.265 0.866 . . . . 0.0 115.265 -177.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -70.67 151.31 45.07 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 -153.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 45.89 28.14 0.56 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.409 2.283 . . . . 0.0 116.835 164.039 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.21 -16.47 34.29 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.725 1.155 . . . . 0.0 115.669 -170.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.43 -33.64 76.0 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.754 1.621 . . . . 0.0 113.958 173.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -138.6 -21.14 1.02 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.951 1.301 . . . . 0.0 114.367 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.6 t -79.54 55.91 2.07 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 125.524 1.53 . . . . 0.0 111.135 172.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -149.64 146.29 27.2 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 128.356 2.662 . . . . 0.0 110.518 -171.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -123.13 -39.56 2.47 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 176.366 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? . . . . . 0 C--O 1.252 1.209 0 C-N-CA 126.096 1.758 . . . . 0.0 112.785 -171.818 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 119.559 -0.258 . . . . 0.0 111.693 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -88.71 150.82 22.79 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.858 0.863 . . . . 0.0 112.147 175.373 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.92 61.54 6.01 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.38 1.072 . . . . 0.0 113.36 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.05 61.08 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 123.993 0.917 . . . . 0.0 112.061 164.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.42 -46.02 0.23 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.551 2.167 . . . . 0.0 113.196 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.252 1.8 pttm 41.98 -165.72 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.324 1.45 . . . . 0.0 112.45 -149.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 m -56.2 155.38 6.75 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.077 -1.64 . . . . 0.0 114.442 178.614 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -61.18 -44.33 97.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.439 1.496 . . . . 0.0 114.636 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -157.57 -34.61 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.335 2.654 . . . . 0.0 109.974 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.9 t -55.61 168.48 0.41 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.486 1.514 . . . . 0.0 111.309 153.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.2 m -134.54 76.51 1.64 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -175.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -132.92 161.01 35.38 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.268 1.427 . . . . 0.0 110.586 162.534 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -78.15 -32.82 50.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.933 1.293 . . . . 0.0 112.822 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -73.76 -177.64 35.85 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 124.666 1.127 . . . . 0.0 112.81 169.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.331 0.6 OUTLIER 21.62 64.92 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 128.006 2.523 . . . . 0.0 114.85 -176.181 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.596 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.47 -178.28 0.18 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.438 1.895 . . . . 0.0 114.103 -174.718 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -22.72 -69.98 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 127.782 2.433 . . . . 0.0 115.068 -174.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -77.06 -14.29 59.84 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.059 1.744 . . . . 0.0 115.645 -178.043 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.33 -26.34 16.61 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.567 1.947 . . . . 0.0 113.219 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -56.94 -46.7 99.84 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.057 1.343 . . . . 0.0 114.437 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -93.34 -4.74 3.01 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.892 2.395 . . . . 0.0 113.822 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -83.02 158.29 22.56 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.015 1.116 . . . . 0.0 114.015 -162.726 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.5 mt -122.46 133.5 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.908 1.683 . . . . 0.0 109.972 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.0 mt -118.98 58.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.426 1.49 . . . . 0.0 109.585 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.5 m 49.3 50.92 17.26 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.702 1.601 . . . . 0.0 113.541 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.1 m 56.51 46.52 20.44 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.709 1.204 . . . . 0.0 113.667 -173.509 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 12.1 t80 56.64 56.01 5.91 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.574 1.95 . . . . 0.0 113.558 -177.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 p -72.04 -30.09 64.83 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.052 -1.03 . . . . 0.0 112.48 173.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -177.69 -159.44 22.62 Favored Glycine 0 CA--C 1.53 0.986 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 -169.005 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.16 174.22 10.36 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.364 1.066 . . . . 0.0 111.613 173.009 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.2 t -110.12 -18.87 13.23 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -177.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -97.04 -39.2 9.45 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.862 -1.149 . . . . 0.0 113.829 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -85.86 11.73 10.66 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.766 1.227 . . . . 0.0 112.433 169.38 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -70.99 126.44 29.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.668 1.987 . . . . 0.0 112.681 -174.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -152.0 150.59 30.15 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.66 1.184 . . . . 0.0 111.031 171.786 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.1 m -61.35 -27.43 68.5 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.593 1.557 . . . . 0.0 114.616 -171.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -75.67 -29.96 59.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.797 1.239 . . . . 0.0 113.149 174.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.2 m170 -101.47 -28.39 12.59 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -170.281 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.3 m -5.03 -75.22 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 129.833 3.253 . . . . 0.0 117.7 -174.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -76.87 -12.76 17.87 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.12 2.546 . . . . 0.0 115.574 -172.705 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -92.52 33.03 1.14 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.478 1.911 . . . . 0.0 113.02 -172.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -110.51 -38.16 5.28 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -163.873 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 58.6 mt -128.19 126.73 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.87 0.868 . . . . 0.0 111.681 -167.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.89 158.09 43.95 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 127.135 2.174 . . . . 0.0 110.113 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.1 t -75.96 143.64 41.45 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.453 0.701 . . . . 0.0 110.96 173.311 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.1 p -61.13 -37.4 82.69 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.929 1.292 . . . . 0.0 114.034 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -122.14 -7.7 8.81 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.742 1.617 . . . . 0.0 114.619 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 39.7 m -117.03 8.04 13.27 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 61.65 0.6 0.5 Allowed 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 119.119 3.007 . . . . 0.0 119.119 166.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -141.64 148.5 39.26 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 120.78 1.627 . . . . 0.0 112.73 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.292 11.2 m 53.55 -9.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 1 N-CA-C 121.847 4.017 . . . . 0.0 121.847 164.229 . . . . . . . . 3 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 117.02 -177.22 16.59 Favored Glycine 0 N--CA 1.48 1.567 0 CA-C-N 121.136 1.789 . . . . 0.0 114.308 171.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -117.98 0.04 11.78 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 115.779 1.77 . . . . 0.0 115.779 -170.292 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -83.44 153.32 24.54 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.581 -1.324 . . . . 0.0 111.908 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -60.65 -24.85 65.89 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -167.531 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -80.48 -12.4 59.55 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -132.79 -19.02 2.35 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -172.832 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 13.4 t -69.6 137.26 88.22 Favored Pre-proline 0 CA--C 1.548 0.88 0 CA-C-N 119.992 1.269 . . . . 0.0 112.021 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -57.58 136.93 78.81 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.037 2.491 . . . . 0.0 113.229 177.18 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -95.19 147.13 23.79 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.982 1.313 . . . . 0.0 111.545 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.6 -2.95 9.86 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 116.207 1.928 . . . . 0.0 116.207 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.5 t90 -101.89 154.13 19.22 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.27 1.028 . . . . 0.0 111.317 174.212 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -98.75 -3.91 34.65 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 -158.238 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -119.06 153.05 35.37 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.709 1.604 . . . . 0.0 112.165 172.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -124.98 29.98 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 125.142 1.377 . . . . 0.0 113.582 -168.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 61.92 6.62 1.74 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 126.865 2.066 . . . . 0.0 115.753 177.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 71.0 m -88.37 0.8 55.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.594 1.158 . . . . 0.0 113.702 173.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.281 6.3 t 57.29 -42.94 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 129.452 3.101 . . . . 0.0 117.768 -169.073 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -101.35 7.9 42.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 178.224 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 71.9 m -112.26 147.4 36.34 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.186 0.994 . . . . 0.0 112.229 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -106.92 178.9 4.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.913 1.685 . . . . 0.0 110.371 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.1 p -66.29 -29.48 69.7 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -80.79 160.03 24.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.273 1.429 . . . . 0.0 112.77 171.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . 0.265 22.5 pttp 49.52 30.29 3.39 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.962 2.505 . . . . 0.0 116.202 174.173 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -109.16 120.17 41.74 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.076 0.95 . . . . 0.0 112.529 -174.248 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.3 m -144.05 139.85 29.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.229 1.412 . . . . 0.0 111.78 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.64 -38.93 89.5 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.121 0.968 . . . . 0.0 112.871 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -80.98 -10.03 59.77 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.365 1.066 . . . . 0.0 113.775 179.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -108.49 -24.58 11.34 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.429 1.491 . . . . 0.0 113.716 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.9 t -48.76 -48.99 69.0 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.139 1.376 . . . . 0.0 114.383 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -76.73 -29.02 5.93 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 121.999 1.799 . . . . 0.0 113.354 174.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.3 m -88.83 5.67 42.6 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.856 1.662 . . . . 0.0 114.966 -172.267 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.0 tt -71.6 -20.17 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 125.012 1.325 . . . . 0.0 114.086 -170.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -113.53 154.18 27.52 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.808 1.243 . . . . 0.0 113.465 -170.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -111.63 -10.22 14.11 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.804 1.641 . . . . 0.0 114.462 -167.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -108.29 161.99 14.49 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -174.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -146.42 159.19 43.71 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.828 2.051 . . . . 0.0 110.198 172.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 21.2 tt -129.47 136.9 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.913 1.285 . . . . 0.0 111.97 -175.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.54 160.6 14.31 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.311 1.444 . . . . 0.0 111.172 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -124.53 139.01 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.251 1.42 . . . . 0.0 111.214 176.478 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -149.81 128.56 12.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.243 1.417 . . . . 0.0 111.048 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -81.71 -12.97 58.41 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.232 1.013 . . . . 0.0 112.917 173.234 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.41 14.54 4.83 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 129.039 2.936 . . . . 0.0 115.494 176.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -137.61 152.42 49.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.096 1.758 . . . . 0.0 111.726 176.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -134.88 4.13 3.26 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.583 1.553 . . . . 0.0 114.75 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.21 154.44 23.37 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.028 1.331 . . . . 0.0 112.411 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -79.25 161.65 66.99 Favored Pre-proline 0 N--CA 1.476 0.836 0 C-N-CA 124.604 1.162 . . . . 0.0 112.665 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.46 162.98 19.0 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.312 2.675 . . . . 0.0 114.173 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -118.3 155.18 31.07 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.164 1.786 . . . . 0.0 111.172 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.2 t -128.17 138.03 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 125.145 1.378 . . . . 0.0 110.743 -176.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.598 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 60.5 tp -126.33 -49.26 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.743 1.617 . . . . 0.0 113.686 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.598 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 90.7 Cg_endo -73.15 162.36 40.89 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.064 1.842 . . . . 0.0 112.629 176.758 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -143.13 150.48 39.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.206 1.402 . . . . 0.0 111.721 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -136.55 12.26 3.21 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -172.74 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.2 m 54.06 58.31 5.15 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 125.468 1.507 . . . . 0.0 113.303 172.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.3 tt -136.35 137.28 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.088 1.355 . . . . 0.0 111.888 -176.393 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 35.6 p90 -156.01 160.52 40.1 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 127.029 2.132 . . . . 0.0 110.477 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 40.4 t -89.13 139.83 30.07 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.646 0.779 . . . . 0.0 110.526 170.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -69.85 -37.34 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -169.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -100.02 -33.77 10.36 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 68.4 m -95.05 -11.71 27.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -161.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 75.65 -20.64 2.19 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.056 1.312 . . . . 0.0 114.367 -169.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -76.15 177.56 50.37 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.2 1.381 . . . . 0.0 113.95 170.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -141.93 147.7 37.48 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.585 1.554 . . . . 0.0 111.609 -172.487 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.29 9.83 55.55 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 162.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.409 ' C ' ' H ' ' A' ' 118' ' ' GLY . 3.0 p80 -83.05 -154.35 0.14 Allowed 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.489 1.644 . . . . 0.0 112.103 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -65.05 25.96 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 126.572 1.949 . . . . 0.0 114.556 167.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 118' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -43.13 -29.43 0.94 Allowed Glycine 0 CA--C 1.538 1.482 0 C-N-CA 129.083 3.23 . . . . 0.0 115.044 168.792 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.83 -38.06 84.18 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.745 1.618 . . . . 0.0 114.08 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -102.85 -21.47 14.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.49 1.516 . . . . 0.0 112.36 176.449 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 24.9 t -76.88 51.53 0.79 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 126.721 2.008 . . . . 0.0 111.097 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -104.36 -30.85 9.84 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.479 1.912 . . . . 0.0 114.592 -159.547 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -136.59 157.65 46.28 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.607 1.163 . . . . 0.0 112.918 -170.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.4 tttm . . . . . 0 C--O 1.251 1.167 0 C-N-CA 126.077 1.751 . . . . 0.0 112.012 177.384 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 111.351 0.13 . . . . 0.0 111.351 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -123.67 151.39 43.15 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.775 1.63 . . . . 0.0 111.28 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.59 112.9 20.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -166.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -80.95 -54.35 0.74 Allowed Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 123.824 0.849 . . . . 0.0 112.076 155.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -76.7 -48.32 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.382 2.055 . . . . 0.0 114.313 -177.413 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.262 7.0 pttm 42.17 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.571 1.549 . . . . 0.0 112.587 -148.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.8 m -54.13 148.74 10.56 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 119.848 -1.782 . . . . 0.0 113.8 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.416 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 56.0 t30 -60.33 -39.69 87.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.558 0.743 . . . . 0.0 112.0 174.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -136.81 -48.31 0.62 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -169.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.5 p -97.95 16.78 19.92 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -167.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.0 m 52.23 59.1 4.76 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 118.054 2.612 . . . . 0.0 118.054 164.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -129.67 164.76 23.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.897 1.279 . . . . 0.0 111.899 165.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -94.31 155.59 16.93 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.256 1.822 . . . . 0.0 111.828 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.77 -19.37 29.62 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 125.087 1.327 . . . . 0.0 115.958 170.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.279 11.8 p-80 -126.73 55.95 1.51 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 123.756 1.741 . . . . 0.0 109.925 170.61 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.659 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.67 -179.4 0.18 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.528 2.331 . . . . 0.0 114.808 -173.878 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -14.81 -71.52 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 128.788 2.835 . . . . 0.0 115.74 -177.845 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -77.01 -20.56 55.87 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -94.34 -2.97 51.26 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.217 2.207 . . . . 0.0 113.243 175.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.9 t -61.76 -41.12 75.69 Favored Pre-proline 0 CA--C 1.557 1.223 0 C-N-CA 126.491 1.917 . . . . 0.0 114.329 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.61 163.41 39.03 Favored 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 122.542 2.161 . . . . 0.0 112.926 171.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -71.22 137.04 48.34 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.41 7.01 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 -170.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.4 pt -60.42 147.23 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 119.947 1.249 . . . . 0.0 112.876 177.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.0 m -73.08 -65.09 0.85 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 m -149.2 -61.54 0.22 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.274 1.03 . . . . 0.0 112.215 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -146.55 59.16 1.21 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.72 1.608 . . . . 0.0 110.267 -178.079 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.4 p -151.99 168.18 26.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.976 1.711 . . . . 0.0 111.112 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 52.09 -152.93 6.16 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.792 1.663 . . . . 0.0 113.454 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.89 146.41 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.202 1.401 . . . . 0.0 108.946 164.449 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.1 t -60.41 -23.77 64.63 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -92.85 -11.32 33.88 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.537 1.535 . . . . 0.0 113.991 175.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -156.26 100.03 1.97 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.268 1.427 . . . . 0.0 111.622 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -150.26 143.54 25.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.008 0.923 . . . . 0.0 112.857 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -165.57 170.9 13.77 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 128.668 2.787 . . . . 0.0 108.472 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.8 m -57.36 -32.41 66.73 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.343 -1.473 . . . . 0.0 114.545 177.947 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -96.5 3.83 52.47 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.86 1.264 . . . . 0.0 114.288 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -116.92 0.55 12.48 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.348 1.459 . . . . 0.0 113.354 173.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -37.28 -50.64 2.41 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.253 1.421 . . . . 0.0 112.445 155.399 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -82.1 23.57 0.77 Allowed 'Trans proline' 0 CA--C 1.552 1.376 0 C-N-CA 124.639 3.559 . . . . 0.0 116.437 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -75.19 -84.73 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.196 -1.565 . . . . 0.0 112.643 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.22 -12.22 30.75 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -167.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.0 mt -141.46 112.9 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.756 1.622 . . . . 0.0 107.09 -169.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.271 3.8 pm0 47.48 174.1 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.891 1.676 . . . . 0.0 115.072 -159.219 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 59.3 m -140.48 151.63 44.98 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 127.112 2.165 . . . . 0.0 109.483 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 p -71.76 -32.11 67.34 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.258 1.423 . . . . 0.0 113.192 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -99.81 -34.14 10.28 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.052 1.741 . . . . 0.0 113.004 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 3.1 m -103.67 -1.43 28.12 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.4 t0 58.45 -155.96 0.34 Allowed 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.402 1.481 . . . . 0.0 113.19 -171.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -42.51 8.27 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 C-N-CA 134.139 4.976 . . . . 0.0 121.123 -169.709 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -101.75 -36.01 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.527 1.531 . . . . 0.0 114.498 -161.064 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.44 164.83 6.45 Favored Glycine 0 CA--C 1.541 1.672 0 C-N-CA 124.351 0.977 . . . . 0.0 114.462 -174.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -87.12 28.61 0.91 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.899 1.28 . . . . 0.0 114.078 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -65.68 154.04 40.0 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.122 -0.986 . . . . 0.0 112.126 171.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -23.68 44.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.612 1.965 . . . . 0.0 114.946 -172.159 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.7 m -104.37 4.18 33.17 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -119.47 -37.92 3.09 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.992 1.717 . . . . 0.0 111.847 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 91.0 m -129.65 159.38 69.9 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 126.582 1.953 . . . . 0.0 110.97 169.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -60.51 143.92 99.48 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.064 2.509 . . . . 0.0 113.009 174.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.0 p80 -85.03 -36.79 21.03 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -143.58 158.54 43.58 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 127.179 2.192 . . . . 0.0 110.705 175.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.2 m-90 -123.83 3.21 8.81 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 -172.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -144.21 141.18 29.74 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.855 1.662 . . . . 0.0 111.244 -173.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -76.17 -39.75 54.13 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.537 1.135 . . . . 0.0 113.231 -178.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.8 p -146.05 133.08 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 126.952 2.101 . . . . 0.0 108.197 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -66.19 -30.58 71.07 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.729 0.412 . . . . 0.0 111.807 -175.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.3 m -74.32 170.24 16.01 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.764 1.745 . . . . 0.0 113.109 175.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.2 p -135.16 -23.29 1.51 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 127.796 2.438 . . . . 0.0 111.209 -162.618 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mp -78.39 -23.78 46.64 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.373 1.869 . . . . 0.0 111.441 165.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.2 m -104.28 155.51 18.69 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.708 1.203 . . . . 0.0 113.568 -163.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -81.86 164.77 21.37 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.736 1.215 . . . . 0.0 109.904 164.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 p -73.25 41.29 0.11 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.604 2.762 . . . . 0.0 114.501 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -98.08 163.13 12.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.424 2.29 . . . . 0.0 110.983 177.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -55.31 146.35 19.54 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.081 1.352 . . . . 0.0 112.643 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -133.77 160.73 36.72 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.079 1.752 . . . . 0.0 111.167 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.7 t -100.68 146.04 27.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.055 0.942 . . . . 0.0 112.565 164.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -62.2 -40.55 96.43 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.128 1.371 . . . . 0.0 113.499 -177.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.83 -19.81 19.31 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.985 1.105 . . . . 0.0 113.985 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -124.89 -2.34 7.77 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -167.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' CYS . . . . . 0.422 ' HB3' ' HD3' ' A' ' 81' ' ' PRO 0.417 21.7 t 49.02 -99.26 0.0 OUTLIER Pre-proline 0 CA--C 1.556 1.208 0 CA-C-O 115.165 -2.35 . . . . 0.0 114.745 175.782 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PRO . . . . . 0.422 ' HD3' ' HB3' ' A' ' 80' ' ' CYS . 32.0 Cg_exo -63.01 -31.48 76.61 Favored 'Trans proline' 0 C--N 1.36 1.153 0 CA-C-N 124.693 2.712 . . . . 0.0 114.218 176.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.3 m -87.46 151.72 22.82 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.604 1.162 . . . . 0.0 112.576 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.8 tt -149.8 157.22 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 124.859 1.263 . . . . 0.0 111.043 -171.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 29.2 t-105 -68.42 132.62 47.34 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.244 0.618 . . . . 0.0 112.281 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -137.36 3.66 2.6 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.742 1.617 . . . . 0.0 113.797 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.75 154.07 20.21 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -168.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -150.44 159.26 44.6 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.152 1.781 . . . . 0.0 111.302 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.19 149.63 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.791 1.636 . . . . 0.0 112.726 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.9 tp -74.92 -28.22 60.52 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -172.963 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.305 9.8 p 46.91 37.74 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.59 1.956 . . . . 0.0 114.715 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 55.08 22.22 4.37 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.746 2.019 . . . . 0.0 115.338 -177.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -84.9 155.73 21.56 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.307 1.443 . . . . 0.0 113.663 -176.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -131.82 132.78 44.02 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.07 1.748 . . . . 0.0 110.954 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -78.56 -30.32 46.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.998 1.319 . . . . 0.0 113.465 -178.055 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -108.87 157.38 18.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.409 1.483 . . . . 0.0 114.098 -171.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.28 160.61 41.78 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.952 1.701 . . . . 0.0 111.472 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -70.81 134.17 86.05 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 124.112 0.965 . . . . 0.0 111.171 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -66.76 -28.46 43.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.853 2.369 . . . . 0.0 114.748 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -150.27 161.94 41.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.449 1.9 . . . . 0.0 112.126 -173.291 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.2 m -89.03 -5.97 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.481 1.112 . . . . 0.0 113.588 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.07 149.07 40.88 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.451 1.101 . . . . 0.0 111.8 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -63.42 175.29 2.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.937 3.091 . . . . 0.0 114.616 172.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -108.66 -11.13 15.13 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.382 1.473 . . . . 0.0 113.935 173.499 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -92.87 17.47 10.51 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.406 1.482 . . . . 0.0 113.403 -176.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 p -70.23 -13.82 62.34 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.687 1.995 . . . . 0.0 115.272 -167.466 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 40.1 pt -106.51 6.56 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.306 1.443 . . . . 0.0 113.615 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -119.51 154.82 33.23 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.335 1.454 . . . . 0.0 113.492 -174.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t -82.38 157.81 23.58 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.835 2.454 . . . . 0.0 111.563 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -141.0 -23.27 0.77 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.932 1.693 . . . . 0.0 114.471 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -114.36 172.94 6.71 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.899 2.08 . . . . 0.0 111.827 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.326 14.5 p 51.65 12.36 0.17 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 128.809 2.844 . . . . 0.0 118.6 170.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 163.6 -165.79 36.99 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.45 1.5 . . . . 0.0 112.942 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -72.86 149.58 43.22 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 123.938 0.78 . . . . 0.0 112.823 172.544 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -62.43 -15.49 49.73 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -170.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -78.9 -22.0 67.1 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 118.563 -1.132 . . . . 0.0 115.83 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.9 p-80 -79.67 134.74 36.43 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.13 1.965 . . . . 0.0 114.761 -162.127 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 31.62 36.25 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 130.378 3.471 . . . . 0.0 117.388 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.76 -17.67 43.13 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.859 1.219 . . . . 0.0 115.153 -170.403 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -63.39 -35.24 79.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.247 1.819 . . . . 0.0 113.799 172.701 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -131.51 -12.38 3.47 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.822 1.649 . . . . 0.0 113.816 -170.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 26.8 t -60.32 132.78 54.98 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.474 1.11 . . . . 0.0 111.454 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -88.44 3.78 48.82 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -159.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -68.38 157.79 34.98 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 177.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.008 1.323 . . . . 0.0 114.483 -175.202 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 120.286 0.089 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -92.23 -16.58 25.98 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -177.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.18 141.96 23.7 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.057 1.343 . . . . 0.0 111.882 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.52 28.6 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 0.0 113.229 164.334 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.78 -39.34 0.99 Allowed 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 122.707 2.271 . . . . 0.0 114.988 -175.826 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? 58.37 -57.77 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 128.441 2.696 . . . . 0.0 116.283 -170.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -155.22 159.47 40.11 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.257 2.223 . . . . 0.0 111.525 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -72.99 -30.16 63.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -161.23 -42.2 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.208 1.403 . . . . 0.0 112.74 -172.206 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.4 -12.75 60.6 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -168.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m 54.31 26.34 6.78 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.956 1.836 . . . . 0.0 115.956 -173.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -98.12 161.32 13.77 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.041 1.336 . . . . 0.0 112.717 175.077 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -72.28 161.33 30.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.63 1.572 . . . . 0.0 113.882 -175.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.05 -71.4 2.62 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.177 1.37 . . . . 0.0 114.174 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.278 0.6 OUTLIER -83.51 77.46 9.82 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 123.15 1.452 . . . . 0.0 112.9 -172.371 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -60.6 -179.4 0.12 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.261 2.225 . . . . 0.0 113.498 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.7 -62.84 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 126.164 1.786 . . . . 0.0 114.062 -171.393 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -80.41 -2.75 46.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.62 1.968 . . . . 0.0 115.419 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.31 -17.9 13.89 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.746 1.618 . . . . 0.0 113.664 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.6 t -48.91 -48.66 71.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -172.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -83.64 -2.08 10.3 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 122.461 2.108 . . . . 0.0 114.545 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -94.47 155.5 16.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.361 1.464 . . . . 0.0 113.207 -174.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.7 pp -119.05 9.9 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.552 1.541 . . . . 0.0 114.26 -174.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.4 pt -81.56 152.03 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.556 1.143 . . . . 0.0 112.109 173.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.6 p -134.79 152.85 52.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.484 1.514 . . . . 0.0 111.109 174.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.71 20.82 1.2 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.584 1.554 . . . . 0.0 115.028 176.504 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.2 t80 47.87 34.31 3.89 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.863 2.065 . . . . 0.0 114.45 -169.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 p -93.56 2.38 56.41 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 115.143 1.535 . . . . 0.0 115.143 -172.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -157.63 167.31 34.09 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 123.833 0.73 . . . . 0.0 114.639 -177.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.09 135.15 34.52 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.807 0.843 . . . . 0.0 110.736 172.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -64.6 -14.63 58.71 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -85.76 -18.11 33.93 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.931 1.292 . . . . 0.0 114.275 176.46 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -140.76 -5.29 1.18 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 116.477 2.029 . . . . 0.0 116.477 -174.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -63.48 142.29 58.45 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.419 1.087 . . . . 0.0 112.288 174.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -136.08 111.77 9.38 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.289 1.435 . . . . 0.0 109.189 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 61.9 p -64.27 -20.59 66.16 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -168.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -69.14 -24.83 64.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.388 1.475 . . . . 0.0 112.973 173.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -132.83 -34.02 1.16 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 -167.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 m 60.78 166.51 0.09 OUTLIER Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 126.89 2.076 . . . . 0.0 114.059 -166.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -119.6 -170.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 122.495 2.13 . . . . 0.0 114.365 -155.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.96 66.64 0.91 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.817 2.047 . . . . 0.0 109.48 167.101 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.05 -36.64 2.33 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -163.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.3 mt -126.93 35.04 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 126.832 2.053 . . . . 0.0 108.453 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -145.57 154.76 42.52 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.287 3.035 . . . . 0.0 107.817 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 31.3 p -70.46 170.32 12.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 122.027 0.918 . . . . 0.0 112.237 167.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -70.21 134.65 48.28 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.724 -0.61 . . . . 0.0 111.04 165.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.318 19.4 ptpt 53.65 136.94 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 129.62 3.168 . . . . 0.0 115.463 -165.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . 0.298 0.5 OUTLIER 55.55 179.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 126.355 1.862 . . . . 0.0 114.874 -160.498 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -120.06 32.27 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.301 1.841 . . . . 0.0 114.854 -158.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -133.24 162.19 32.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.379 1.472 . . . . 0.0 112.136 -176.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.7 t -69.06 129.88 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.353 1.461 . . . . 0.0 112.42 -174.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.98 -169.13 7.61 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 124.703 1.144 . . . . 0.0 115.046 174.471 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.79 2.36 4.43 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 168.959 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -71.0 158.74 35.99 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.699 0.8 . . . . 0.0 111.802 173.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -64.26 149.96 46.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.664 0.786 . . . . 0.0 110.607 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 m 63.96 -18.61 0.07 Allowed 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 116.645 2.091 . . . . 0.0 116.645 -170.254 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -86.64 -47.13 9.44 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.476 1.11 . . . . 0.0 110.93 169.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 27.9 t -122.72 62.45 17.85 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 126.289 1.836 . . . . 0.0 110.86 176.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.94 -12.76 35.22 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 124.208 3.272 . . . . 0.0 115.063 -170.449 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -71.94 149.5 45.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.848 1.259 . . . . 0.0 112.722 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -124.48 -20.39 5.17 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -160.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -98.13 173.37 7.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.118 0.967 . . . . 0.0 112.9 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -64.57 158.36 24.45 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.629 1.571 . . . . 0.0 112.485 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.253 0.0 OUTLIER -85.89 30.64 0.65 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -168.487 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.4 t -65.1 114.07 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.776 0.83 . . . . 0.0 110.855 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -66.23 -25.21 66.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.491 1.117 . . . . 0.0 113.398 -169.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 60.6 m -76.49 -3.14 35.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.586 1.554 . . . . 0.0 114.906 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 10.8 t 58.64 -42.45 0.06 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.865 3.266 . . . . 0.0 118.072 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 pp -104.87 -9.41 18.02 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.994 1.717 . . . . 0.0 114.333 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.4 t -74.07 138.9 44.29 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.403 0.62 . . . . 0.0 112.468 -172.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -155.19 142.26 19.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.509 1.924 . . . . 0.0 109.356 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.3 m 58.16 34.85 24.56 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt 54.86 34.8 22.85 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.332 1.853 . . . . 0.0 114.53 174.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -69.44 152.11 45.29 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.973 0.909 . . . . 0.0 111.342 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 49.77 6.84 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.827 2.451 . . . . 0.0 117.359 -173.851 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.0 m -80.4 -22.4 41.29 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -155.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -57.79 117.5 4.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.86 0.864 . . . . 0.0 111.433 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 55.76 20.9 4.31 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.093 1.757 . . . . 0.0 115.138 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -115.33 -44.14 3.01 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.096 1.758 . . . . 0.0 112.541 171.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m -94.57 -16.47 0.21 Allowed Pre-proline 0 CA--C 1.553 1.093 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -176.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -53.85 -22.48 23.91 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 123.065 2.51 . . . . 0.0 116.819 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 21.9 m -62.4 -15.17 47.45 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 116.115 1.895 . . . . 0.0 116.115 -176.021 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 7.8 tp -110.51 3.02 8.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 C-N-CA 125.248 1.419 . . . . 0.0 113.21 175.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 35.8 m0 -101.15 153.27 19.73 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.246 1.418 . . . . 0.0 112.169 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -135.47 141.61 45.39 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.977 1.711 . . . . 0.0 110.983 173.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.24 -9.18 22.67 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -175.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -133.15 145.01 50.27 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.743 1.217 . . . . 0.0 113.257 -171.441 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 21.0 tt -146.39 134.26 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.554 1.542 . . . . 0.0 108.983 155.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -113.68 132.61 55.73 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.577 1.151 . . . . 0.0 110.592 -178.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.4 m -108.65 3.27 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.805 1.642 . . . . 0.0 112.83 174.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -79.75 136.8 36.84 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.92 1.288 . . . . 0.0 112.243 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -150.89 156.21 40.74 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.314 1.445 . . . . 0.0 111.846 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 61.72 164.73 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.115 2.566 . . . . 0.0 114.409 -174.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 55.0 32.18 17.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.765 2.026 . . . . 0.0 113.63 -175.323 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -111.94 -3.79 14.73 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.31 1.844 . . . . 0.0 114.816 -171.228 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.9 149.6 48.71 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -171.048 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -139.49 152.56 69.2 Favored Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 127.15 2.18 . . . . 0.0 110.668 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -68.68 -29.09 30.13 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 122.983 2.456 . . . . 0.0 113.073 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.274 60.8 pttt 52.52 174.9 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.773 3.229 . . . . 0.0 117.459 173.733 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -151.51 158.22 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 127.204 2.201 . . . . 0.0 109.556 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.38 109.19 62.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 124.734 1.214 . . . . 0.0 109.926 174.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -71.09 -12.42 30.31 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.5 2.8 . . . . 0.0 114.83 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -65.66 162.48 18.34 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.414 1.486 . . . . 0.0 113.591 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 20.7 m80 -69.13 -21.28 64.03 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.273 1.429 . . . . 0.0 114.193 -177.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 6.3 m 55.38 45.45 25.36 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 126.217 1.807 . . . . 0.0 112.845 -178.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 45.9 pt -92.64 24.11 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.97 1.708 . . . . 0.0 112.401 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -109.52 164.22 12.71 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.314 1.846 . . . . 0.0 111.062 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 13.6 t -137.45 135.09 36.54 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -76.11 145.08 40.27 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.287 171.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.3 t30 63.21 -53.32 0.19 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.863 2.465 . . . . 0.0 115.341 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 93.7 m -69.85 134.56 48.61 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.222 1.809 . . . . 0.0 112.874 -174.012 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -72.16 -14.54 76.53 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 123.849 0.738 . . . . 0.0 114.279 172.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.07 -11.69 79.12 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 125.132 1.349 . . . . 0.0 116.068 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt 43.67 -85.22 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.795 2.838 . . . . 0.0 116.166 169.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -73.57 7.03 14.28 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 126.203 1.858 . . . . 0.0 116.546 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -158.07 0.08 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 119.072 1.436 . . . . 0.0 112.442 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -61.42 20.48 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.824 2.049 . . . . 0.0 115.056 169.911 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.14 -16.5 26.66 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 127.635 2.541 . . . . 0.0 116.378 -170.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.37 -35.79 71.22 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.195 1.398 . . . . 0.0 113.373 172.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -117.94 -16.97 9.84 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.936 2.094 . . . . 0.0 113.193 -167.721 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 21.2 p -58.91 145.41 41.44 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -169.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -76.89 156.71 31.91 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.682 1.193 . . . . 0.0 111.519 175.064 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -79.1 -9.52 59.57 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 87.1 tttt . . . . . 0 C--O 1.253 1.246 0 C-N-CA 126.228 1.811 . . . . 0.0 111.388 179.819 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.3 ttmm . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.77 -22.25 64.3 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -174.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.99 136.95 34.28 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.734 1.214 . . . . 0.0 112.202 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.66 21.31 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 123.966 0.906 . . . . 0.0 112.98 165.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -79.55 -35.23 0.84 Allowed 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 122.304 2.003 . . . . 0.0 113.942 -178.326 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt 48.04 -166.19 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.211 1.005 . . . . 0.0 111.431 -151.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.9 m -57.93 158.09 7.0 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 120.513 -1.367 . . . . 0.0 111.926 163.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.405 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 42.7 t30 -66.38 97.0 0.39 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.185 -0.947 . . . . 0.0 110.032 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 61.28 -33.86 0.09 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.529 2.732 . . . . 0.0 117.543 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.8 p -81.54 -2.6 50.5 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -172.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.4 p 49.34 0.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 120.003 3.334 . . . . 0.0 120.003 170.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -118.84 125.75 50.25 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.643 1.565 . . . . 0.0 113.695 -169.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.263 39.6 ptt180 50.22 122.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 130.983 3.713 . . . . 0.0 118.744 167.72 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 66.85 -143.82 44.16 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 124.148 0.88 . . . . 0.0 114.107 173.66 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -6.3 97.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 129.318 3.047 . . . . 0.0 117.609 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -62.33 -176.64 0.11 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.23 1.412 . . . . 0.0 114.187 170.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -39.3 -67.47 0.22 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.404 1.882 . . . . 0.0 114.377 -174.154 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -74.55 -1.13 20.08 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.807 1.643 . . . . 0.0 115.111 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -98.69 -33.21 11.03 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.665 1.586 . . . . 0.0 111.886 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.6 m -46.63 -39.98 18.03 Favored Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -73.13 -5.01 16.43 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 CA-C-N 122.372 1.883 . . . . 0.0 115.37 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -65.79 153.0 43.06 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 120.046 1.293 . . . . 0.0 112.72 173.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.0 pp -111.44 164.94 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.406 1.482 . . . . 0.0 113.018 -175.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.2 pt -83.53 122.77 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.578 1.151 . . . . 0.0 111.434 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 p -84.5 143.52 29.3 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.309 0.644 . . . . 0.0 111.054 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.7 p 44.35 23.25 0.06 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 127.306 2.242 . . . . 0.0 116.752 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 50.18 32.82 6.39 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 126.135 1.774 . . . . 0.0 114.724 -171.666 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 p -79.32 -25.9 42.28 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.425 -1.422 . . . . 0.0 113.766 -173.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.32 172.35 18.71 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.854 1.692 . . . . 0.0 111.879 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.52 148.28 29.26 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.531 0.732 . . . . 0.0 110.99 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 t -66.02 -17.8 64.92 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.006 -1.059 . . . . 0.0 113.723 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.21 -4.53 29.29 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.202 1.401 . . . . 0.0 113.882 172.135 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -153.62 89.84 1.36 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 0.0 111.291 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -155.33 126.23 7.04 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.467 1.507 . . . . 0.0 109.426 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -149.7 152.9 36.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.473 0.709 . . . . 0.0 112.818 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.6 m -63.88 -26.35 68.57 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -168.802 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -103.21 145.81 29.36 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.816 0.847 . . . . 0.0 110.507 156.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.5 m170 67.46 -12.93 0.25 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.328 2.251 . . . . 0.0 116.48 -173.456 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.491 ' HB3' ' HD3' ' A' ' 40' ' ' PRO 0.313 2.8 t 21.56 -75.6 0.0 OUTLIER Pre-proline 0 CA--C 1.56 1.351 0 C-N-CA 129.841 3.256 . . . . 0.0 118.409 152.809 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 68.1 Cg_endo -79.47 -9.07 14.96 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.872 3.048 . . . . 0.0 116.555 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -86.04 22.63 1.68 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.499 1.52 . . . . 0.0 114.921 -166.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.62 0.14 9.82 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 38.4 mm -101.33 39.87 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 125.009 1.324 . . . . 0.0 109.559 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -151.46 160.33 43.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.237 1.415 . . . . 0.0 112.176 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 38.6 t -102.82 166.99 10.15 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.797 1.639 . . . . 0.0 110.602 170.28 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.7 m -50.97 135.01 25.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.328 1.051 . . . . 0.0 112.413 170.282 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.302 22.2 ptmt 47.74 22.36 0.34 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.127 2.171 . . . . 0.0 116.13 -170.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 58.0 m -118.61 154.82 32.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.226 1.811 . . . . 0.0 110.54 172.577 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -102.61 -6.05 23.19 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.762 1.225 . . . . 0.0 113.774 171.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -138.58 178.83 6.85 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.346 2.258 . . . . 0.0 109.187 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.8 m -75.54 58.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 120.423 -1.423 . . . . 0.0 110.686 165.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.76 -5.9 88.98 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 118.534 2.174 . . . . 0.0 118.534 -147.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -147.67 160.48 42.64 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.851 1.825 . . . . 0.0 112.4 177.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 38.1 t80 57.02 116.37 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.658 2.383 . . . . 0.0 115.459 -176.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 48.65 22.84 0.56 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 126.632 1.973 . . . . 0.0 114.329 -175.152 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.1 m 51.6 30.28 6.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 114.962 -170.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -143.17 -17.36 0.65 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.039 1.335 . . . . 0.0 113.887 -170.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 60.7 m 58.18 -174.3 0.02 OUTLIER Pre-proline 0 CA--C 1.557 1.231 0 C-N-CA 124.43 1.092 . . . . 0.0 110.622 -161.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -66.76 17.08 0.11 Allowed 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 122.985 2.456 . . . . 0.0 116.339 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -76.2 152.01 36.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.795 1.238 . . . . 0.0 112.761 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -67.57 169.39 9.37 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.814 2.046 . . . . 0.0 113.81 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -121.0 167.78 12.22 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.174 1.79 . . . . 0.0 112.77 -175.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -86.81 162.57 17.72 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.423 1.489 . . . . 0.0 114.012 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -149.45 153.84 37.92 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.701 2.4 . . . . 0.0 109.779 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.304 7.5 p 56.7 154.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 129.382 3.073 . . . . 0.0 116.189 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -69.66 -4.51 19.78 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.485 -1.384 . . . . 0.0 114.728 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.1 m -146.72 131.52 18.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.728 1.611 . . . . 0.0 111.974 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.6 t -52.22 -34.53 46.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.996 0.918 . . . . 0.0 112.924 163.325 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.91 -18.41 65.37 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.275 1.43 . . . . 0.0 114.66 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 55.8 m -88.48 6.73 36.32 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -50.97 109.28 0.31 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.902 1.281 . . . . 0.0 110.284 163.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.6 m 55.44 21.96 4.68 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -152.28 142.99 22.87 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.137 1.775 . . . . 0.0 110.667 -178.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.1 ttmm -128.01 134.88 49.28 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.585 1.154 . . . . 0.0 112.138 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -138.12 15.18 2.83 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.683 1.593 . . . . 0.0 113.548 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.9 m -66.75 -32.78 74.3 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -151.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -65.14 -23.68 67.19 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.152 0.981 . . . . 0.0 113.339 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -100.06 -17.53 17.43 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.044 1.338 . . . . 0.0 113.964 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -133.87 -36.28 0.94 Allowed 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -167.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m -85.65 137.15 36.32 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 119.716 1.143 . . . . 0.0 112.342 -169.406 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -62.24 -31.65 82.31 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 122.919 2.412 . . . . 0.0 114.331 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 38.8 m -113.41 131.29 56.06 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.271 1.428 . . . . 0.0 111.191 173.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 8.1 tp -79.3 165.05 3.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 125.261 1.424 . . . . 0.0 112.59 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 39.9 t-105 -69.12 166.08 18.98 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -175.639 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -77.94 -11.21 59.88 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.893 2.077 . . . . 0.0 115.462 -168.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -131.12 152.79 50.05 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -168.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -146.31 161.23 40.77 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.634 2.374 . . . . 0.0 111.213 -176.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 12.2 tt -121.0 -1.39 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -68.72 138.93 55.3 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.809 -1.182 . . . . 0.0 111.7 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.93 8.53 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 124.952 1.301 . . . . 0.0 113.586 -171.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -81.51 42.64 0.69 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.244 1.418 . . . . 0.0 113.667 -174.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -79.53 144.87 33.54 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.586 1.554 . . . . 0.0 112.444 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -116.83 7.69 13.41 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.885 1.274 . . . . 0.0 114.317 -171.39 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -136.21 148.26 48.02 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.101 1.36 . . . . 0.0 111.524 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -135.67 143.99 45.76 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.742 2.017 . . . . 0.0 112.224 -172.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -92.47 161.01 14.8 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.511 1.124 . . . . 0.0 111.71 169.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -132.96 59.27 41.53 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 125.009 1.324 . . . . 0.0 112.905 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -71.31 144.82 46.89 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.09 2.527 . . . . 0.0 112.483 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -153.06 150.12 28.82 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.214 1.806 . . . . 0.0 111.163 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 44.4 t -131.86 136.35 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.472 1.509 . . . . 0.0 110.374 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.5 mt -132.81 94.64 20.9 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 125.994 1.717 . . . . 0.0 109.855 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -65.62 140.38 62.18 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 123.476 2.784 . . . . 0.0 114.563 -174.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -155.51 160.69 40.75 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.826 1.65 . . . . 0.0 111.436 174.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 35.0 p80 -149.69 171.25 16.99 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.423 1.089 . . . . 0.0 113.687 -172.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.4 m 59.91 61.67 1.84 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 126.22 1.808 . . . . 0.0 113.035 177.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 pp -122.84 16.23 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 125.16 1.384 . . . . 0.0 114.593 -173.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -143.37 156.83 44.78 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 174.164 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 34.7 t -158.72 156.64 30.24 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.827 2.051 . . . . 0.0 109.612 172.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -154.85 -16.96 0.12 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.6 m-20 -67.69 -18.4 64.91 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -172.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 19.1 p -134.12 32.32 3.46 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.843 1.257 . . . . 0.0 114.383 -173.813 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 81.55 16.06 74.39 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.699 1.44 . . . . 0.0 116.699 164.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -154.87 151.31 22.96 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.96 1.267 . . . . 0.0 112.026 176.44 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.18 -35.61 5.84 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 -168.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.58 11.96 50.48 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -171.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.267 1.2 p80 -99.89 -137.05 0.31 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.911 1.356 . . . . 0.0 114.078 -168.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -74.34 35.7 0.1 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 127.669 2.388 . . . . 0.0 113.139 -169.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.0 -18.35 8.79 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 128.05 2.738 . . . . 0.0 115.79 -172.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.21 -40.51 94.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.529 1.532 . . . . 0.0 113.304 170.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -130.51 -22.73 2.69 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -165.711 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 16.2 p -78.14 19.33 0.44 Allowed 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -165.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -71.77 153.96 41.62 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.841 1.656 . . . . 0.0 112.455 -175.484 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.39 0.98 57.05 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -178.023 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.932 1.693 . . . . 0.0 111.326 171.988 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 pttm . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 121.48 0.657 . . . . 0.0 111.346 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -152.89 155.35 36.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.05 1.34 . . . . 0.0 111.6 -177.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.62 54.16 11.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.521 2.328 . . . . 0.0 114.805 171.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.64 -46.54 60.79 Favored Pre-proline 0 CA--C 1.554 1.117 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 168.099 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -79.25 -42.37 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.931 0 C-N-CA 122.262 1.975 . . . . 0.0 114.093 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? 57.69 -56.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.923 2.889 . . . . 0.0 116.285 -171.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.8 t -156.96 160.02 38.65 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.58 2.352 . . . . 0.0 110.925 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -72.64 -24.57 61.07 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.026 -1.047 . . . . 0.0 113.703 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -159.28 -37.65 0.06 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.256 1.423 . . . . 0.0 112.978 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.9 m -77.3 -163.88 0.42 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.59 1.156 . . . . 0.0 111.489 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 78.2 p -136.73 19.31 3.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -115.56 143.57 45.13 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.318 1.047 . . . . 0.0 112.47 172.016 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ptt85 -78.69 -3.18 42.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.43 -20.82 71.98 Favored Glycine 0 CA--C 1.537 1.463 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -176.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.43 89.72 1.52 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.846 1.258 . . . . 0.0 112.14 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -60.96 -179.55 0.14 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.884 1.674 . . . . 0.0 113.445 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.31 -65.08 0.37 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 126.354 1.862 . . . . 0.0 114.675 -171.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ptmm? -76.21 -9.7 58.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 126.329 1.852 . . . . 0.0 115.303 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.17 -20.48 17.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.263 1.425 . . . . 0.0 112.723 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -66.0 -51.06 49.01 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 124.644 1.178 . . . . 0.0 113.835 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -78.21 158.85 30.01 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.282 1.988 . . . . 0.0 112.481 174.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -75.42 126.11 30.35 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.782 0.801 . . . . 0.0 109.93 164.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.9 tp -74.45 150.2 7.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 125.855 1.662 . . . . 0.0 114.788 -163.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.5 pt -73.14 161.66 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 126.631 1.972 . . . . 0.0 112.908 172.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 59.5 m -77.77 7.05 6.3 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m 64.24 130.64 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.453 2.301 . . . . 0.0 114.57 -164.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 52.18 25.76 3.5 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.707 1.603 . . . . 0.0 114.261 -172.288 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.2 t -153.93 113.01 3.71 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.444 1.897 . . . . 0.0 108.6 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.55 174.19 45.89 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.917 1.246 . . . . 0.0 115.441 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.67 139.11 47.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.342 1.457 . . . . 0.0 109.55 166.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.5 t -64.01 -22.93 67.14 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -89.07 -14.19 36.93 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -151.01 95.07 2.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.386 1.475 . . . . 0.0 111.707 -172.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -155.47 134.67 12.28 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.261 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -158.12 160.96 37.87 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.342 1.457 . . . . 0.0 110.6 172.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -58.47 -28.63 65.52 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.063 1.745 . . . . 0.0 115.055 -175.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -72.6 -24.89 61.15 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.794 1.238 . . . . 0.0 113.367 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -122.05 -0.58 9.45 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.524 1.529 . . . . 0.0 114.414 -171.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -25.03 -60.06 0.14 Allowed Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 129.034 2.934 . . . . 0.0 117.665 -177.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -80.49 54.51 5.26 Favored 'Trans proline' 0 CA--C 1.55 1.291 0 C-N-CA 123.571 2.847 . . . . 0.0 114.298 -168.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.41 171.53 8.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.608 1.963 . . . . 0.0 113.533 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.67 -60.89 0.17 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 128.565 2.746 . . . . 0.0 116.622 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.2 mt -106.93 49.2 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 123.245 1.498 . . . . 0.0 110.261 -164.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.0 mm-40 -148.19 165.15 31.77 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.939 2.496 . . . . 0.0 109.725 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 10.6 p -126.0 124.38 40.58 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.529 1.132 . . . . 0.0 111.405 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.4 p -71.32 -16.12 62.43 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -165.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -93.05 -13.02 29.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.578 1.151 . . . . 0.0 113.269 176.663 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.3 t -143.3 -20.79 0.62 Allowed 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -157.365 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 60.58 141.5 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 128.114 2.566 . . . . 0.0 114.666 -162.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.284 10.5 pt-20 46.54 126.23 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 131.298 3.839 . . . . 0.0 119.225 -175.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.47 -12.15 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 119.08 -2.262 . . . . 0.0 112.04 163.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.43 4.94 3.37 Favored Glycine 0 CA--C 1.541 1.715 0 C-N-CA 126.43 1.967 . . . . 0.0 116.986 -177.23 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.26 169.87 14.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.732 1.613 . . . . 0.0 112.075 173.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 53.42 88.21 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.055 1.742 . . . . 0.0 112.926 -172.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 53.64 26.05 5.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 126.349 1.86 . . . . 0.0 114.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.6 m 55.12 23.04 4.96 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.645 1.578 . . . . 0.0 114.733 -172.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -141.35 -17.05 0.81 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.288 1.435 . . . . 0.0 114.022 -169.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 35.4 m 57.41 168.11 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 125.827 1.651 . . . . 0.0 114.09 -154.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -65.44 -177.27 0.64 Allowed 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.623 2.882 . . . . 0.0 115.116 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 58.0 t60 -58.89 164.08 3.08 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.112 1.365 . . . . 0.0 113.725 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -53.52 144.63 16.71 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.434 1.894 . . . . 0.0 114.428 -166.743 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.6 m-90 -72.88 168.93 17.9 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.908 1.683 . . . . 0.0 114.117 -177.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -113.33 159.79 19.03 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 126.247 1.819 . . . . 0.0 112.8 179.267 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -77.79 168.25 20.23 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.142 1.777 . . . . 0.0 115.169 -171.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.4 m -69.45 148.36 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.803 1.641 . . . . 0.0 112.495 171.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 pp0? -68.17 -19.65 64.81 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -168.097 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.8 m -76.13 -20.23 57.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 172.727 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 61.47 -28.47 0.06 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.105 2.162 . . . . 0.0 115.155 -156.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 44.7 mt -89.72 -15.82 31.69 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.397 1.879 . . . . 0.0 114.533 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -176.25 2.47 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -174.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.7 tptt 66.7 -24.59 0.11 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 128.217 2.607 . . . . 0.0 115.177 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.8 t -73.59 150.9 41.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.815 1.246 . . . . 0.0 113.312 168.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -70.23 -22.44 62.9 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.612 1.965 . . . . 0.0 114.178 177.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -75.95 -44.1 41.62 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.345 1.058 . . . . 0.0 113.136 -175.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -77.05 -42.95 36.32 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -165.531 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.1 m -76.42 -11.59 59.91 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.184 1.92 . . . . 0.0 116.184 -158.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -51.52 124.7 12.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.292 1.437 . . . . 0.0 112.029 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . 0.285 10.0 pt-20 49.97 4.6 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 128.909 2.884 . . . . 0.0 118.486 -178.065 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -124.58 -24.23 4.24 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.198 1.399 . . . . 0.0 114.605 -177.005 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 86.5 m -128.81 68.77 79.57 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.921 1.288 . . . . 0.0 112.007 168.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -64.09 170.34 9.21 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.076 2.518 . . . . 0.0 113.967 172.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.0 m -95.17 2.03 54.91 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.8 pt -75.46 155.43 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 122.443 1.116 . . . . 0.0 112.861 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 4.1 m-90 -72.69 -11.36 60.6 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -157.791 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 36.5 ttt-85 -129.92 16.84 5.71 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.472 1.509 . . . . 0.0 113.891 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -74.12 -33.7 63.66 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.625 -0.672 . . . . 0.0 112.772 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -96.82 160.72 14.21 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 111.322 168.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 46.4 pt -65.63 147.79 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 123.672 0.789 . . . . 0.0 113.128 -177.394 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 pp -99.84 16.43 23.77 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.928 1.691 . . . . 0.0 113.424 175.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.253 33.2 m 47.53 30.28 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 127.425 2.29 . . . . 0.0 114.83 176.559 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . 0.307 3.9 p30 48.14 24.38 0.65 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.353 2.261 . . . . 0.0 116.283 -173.289 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -142.61 -29.22 0.57 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.045 1.338 . . . . 0.0 114.33 -175.176 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -79.98 151.36 30.07 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.553 1.141 . . . . 0.0 112.251 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -138.5 139.82 38.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.409 1.484 . . . . 0.0 111.716 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -108.58 150.12 27.94 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.817 1.647 . . . . 0.0 110.85 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -101.5 -16.18 16.89 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -82.34 137.64 45.38 Favored Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 124.023 0.929 . . . . 0.0 111.204 176.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.32 160.35 50.19 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.871 2.381 . . . . 0.0 113.081 173.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -85.02 -26.53 27.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.179 1.791 . . . . 0.0 112.949 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.7 t -124.46 145.53 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.997 1.719 . . . . 0.0 110.543 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -120.05 164.76 20.58 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 126.053 1.741 . . . . 0.0 111.739 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -58.28 156.48 30.12 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.821 3.014 . . . . 0.0 115.787 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -101.08 165.29 11.38 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.768 1.627 . . . . 0.0 112.799 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 19.6 m80 60.36 22.86 12.37 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.552 1.941 . . . . 0.0 116.143 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 32.4 p -85.65 -12.23 51.86 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.887 1.675 . . . . 0.0 113.631 176.625 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 96.1 mt -91.8 142.73 12.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.891 1.676 . . . . 0.0 110.295 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 37.9 p90 -142.41 157.5 44.71 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.715 1.206 . . . . 0.0 113.448 -174.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 4.5 t -145.3 39.81 1.2 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.921 1.288 . . . . 0.0 112.511 173.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -61.49 -9.3 5.45 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -176.206 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -64.96 -22.06 66.94 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.398 1.079 . . . . 0.0 113.119 170.196 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 95.6 m -105.95 176.03 5.3 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.972 2.109 . . . . 0.0 112.354 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.05 -7.76 38.98 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 124.937 1.256 . . . . 0.0 115.712 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -159.54 154.13 25.18 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.427 1.489 . . . . 0.0 112.47 172.735 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -86.16 -22.08 27.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -77.99 33.16 1.71 Allowed Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.825 1.679 . . . . 0.0 117.149 -163.722 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.99 151.17 31.7 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.827 1.314 . . . . 0.0 113.108 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 44.39 28.74 0.32 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.359 2.264 . . . . 0.0 116.905 154.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.93 -18.45 59.88 Favored Glycine 0 CA--C 1.536 1.348 0 O-C-N 121.017 -1.052 . . . . 0.0 114.898 -167.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.32 -46.42 41.09 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.37 1.468 . . . . 0.0 113.483 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -111.44 -20.85 12.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.764 1.626 . . . . 0.0 114.463 -162.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 5.1 t -77.85 -5.61 51.48 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -170.721 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -81.77 45.09 0.87 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.648 1.979 . . . . 0.0 111.757 171.14 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -77.84 -13.39 59.9 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -164.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.6 tptp . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.791 1.637 . . . . 0.0 111.91 -179.325 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 120.603 0.239 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -65.67 145.93 55.43 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.174 0.99 . . . . 0.0 112.097 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.6 82.43 6.89 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.382 1.473 . . . . 0.0 112.221 -171.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.97 -51.64 79.17 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 171.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.75 -35.44 0.53 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.482 2.122 . . . . 0.0 113.993 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.401 0.0 OUTLIER 51.87 -53.64 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 130.138 3.375 . . . . 0.0 117.482 -168.608 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 16' ' ' LEU . 4.5 m -163.56 165.82 23.17 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 131.564 3.946 . . . . 0.0 109.623 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -72.84 -94.8 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.901 -1.125 . . . . 0.0 112.502 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -90.22 -22.3 21.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.527 1.131 . . . . 0.0 111.476 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -67.17 166.77 13.39 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.713 1.605 . . . . 0.0 110.792 165.032 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.5 p -134.52 15.56 3.71 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -165.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -84.14 164.28 19.27 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.693 0.797 . . . . 0.0 112.312 174.336 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.6 mtt-85 -91.67 111.82 23.49 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 170.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.25 152.33 16.34 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.522 1.534 . . . . 0.0 112.586 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.363 13.3 p-80 51.53 62.87 2.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-O 123.438 1.589 . . . . 0.0 111.644 -161.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.531 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.13 -170.42 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.387 1.875 . . . . 0.0 114.391 -175.407 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -34.94 -64.75 0.25 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.504 1.922 . . . . 0.0 114.522 -169.689 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -74.68 -11.17 60.11 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.151 1.78 . . . . 0.0 115.437 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -99.98 -13.63 19.01 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.376 1.87 . . . . 0.0 113.635 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.9 m -65.1 167.32 10.05 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.74 1.216 . . . . 0.0 112.274 159.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.82 162.71 12.58 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 124.147 3.231 . . . . 0.0 114.759 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -65.84 149.74 49.7 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.342 1.057 . . . . 0.0 113.404 -178.29 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.8 pp -89.86 171.81 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.251 1.42 . . . . 0.0 113.76 -175.662 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.1 mt -68.76 127.23 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.121 1.369 . . . . 0.0 110.331 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.0 p -62.43 128.37 35.7 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 121.897 0.856 . . . . 0.0 112.204 -175.119 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.9 m 51.32 14.56 0.24 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.3 t80 45.65 35.89 2.37 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.777 1.631 . . . . 0.0 113.359 -166.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 p -86.5 -14.44 43.07 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.96 -173.0 18.55 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 114.977 0.751 . . . . 0.0 114.977 -174.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.0 -176.89 1.2 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.956 0.902 . . . . 0.0 111.731 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -119.69 -40.86 2.72 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 173.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -79.61 -24.84 41.69 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.3 p30 -133.39 32.96 3.6 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.304 1.842 . . . . 0.0 112.652 174.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 23.1 t-160 -46.42 -55.14 7.84 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.48 2.712 . . . . 0.0 115.427 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.23 -43.58 56.5 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 m -70.12 -16.71 63.15 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -167.136 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -77.72 22.78 0.25 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.682 1.593 . . . . 0.0 113.289 172.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.8 m80 50.99 58.2 5.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.83 1.252 . . . . 0.0 111.258 -163.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.348 32.2 t 34.38 -90.75 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 129.379 3.072 . . . . 0.0 115.93 176.74 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 97.0 Cg_endo -73.13 -5.72 17.67 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 123.327 2.685 . . . . 0.0 115.768 -175.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -90.5 36.05 0.88 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.471 1.508 . . . . 0.0 113.536 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -131.14 -13.71 3.49 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 117.188 2.292 . . . . 0.0 117.188 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.1 mm -120.18 45.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-N 120.49 1.496 . . . . 0.0 110.473 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.76 158.29 43.96 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 120.65 -1.281 . . . . 0.0 112.888 166.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 43.4 t -55.02 155.77 4.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.143 2.177 . . . . 0.0 112.064 169.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -62.22 -28.47 69.71 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.621 -1.3 . . . . 0.0 114.423 -174.633 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -131.74 4.11 4.19 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.74 1.616 . . . . 0.0 113.987 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 m -135.3 158.82 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.094 1.358 . . . . 0.0 111.333 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -88.56 0.19 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -160.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -122.49 153.08 39.63 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.954 -1.091 . . . . 0.0 113.375 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.6 t -6.32 -60.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.241 1 C-N-CA 132.581 4.352 . . . . 0.0 119.021 -167.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.03 165.26 32.61 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 124.872 1.225 . . . . 0.0 112.238 -169.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -79.62 9.48 4.96 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 116.717 2.118 . . . . 0.0 116.717 -159.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -61.27 151.34 32.08 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.503 -1.373 . . . . 0.0 112.301 174.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -0.02 1.48 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -175.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.8 p -127.47 3.63 6.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.368 1.867 . . . . 0.0 113.289 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -119.4 -27.23 5.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.266 1.826 . . . . 0.0 112.733 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 19.8 t -139.98 58.21 10.75 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.932 1.693 . . . . 0.0 111.569 169.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.33 156.99 54.25 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.024 2.483 . . . . 0.0 112.149 175.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -90.28 -8.78 50.07 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -111.96 137.48 49.91 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.439 1.896 . . . . 0.0 109.414 165.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -92.2 -53.46 4.23 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -164.264 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt 48.87 32.22 3.62 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.947 1.699 . . . . 0.0 113.955 -174.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -106.83 123.12 47.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.593 1.557 . . . . 0.0 111.289 -172.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.293 2.2 p 48.48 18.03 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 127.946 2.499 . . . . 0.0 115.359 -179.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 54.36 0.85 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.54 2.336 . . . . 0.0 116.264 -170.543 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.3 m -145.02 144.8 31.2 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.61 1.096 . . . . 0.0 112.662 -169.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.0 t -77.65 -24.62 49.38 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.674 0.79 . . . . 0.0 113.124 161.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.9 mt -74.55 -15.74 60.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.906 1.283 . . . . 0.0 113.966 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 87.4 m -112.51 159.39 18.83 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.671 1.189 . . . . 0.0 112.866 -169.171 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -126.27 154.09 43.87 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.086 1.754 . . . . 0.0 110.368 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 p -51.93 137.01 27.58 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.379 1.071 . . . . 0.0 112.483 176.584 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.304 8.8 ptpp? 48.23 20.23 0.26 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 127.978 2.511 . . . . 0.0 116.775 -171.717 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -133.59 30.95 3.75 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.894 2.078 . . . . 0.0 112.698 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -73.22 171.94 12.05 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.876 0.87 . . . . 0.0 112.809 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.2 m 66.59 -7.04 0.46 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 127.989 2.516 . . . . 0.0 117.532 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -53.66 151.21 6.29 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.587 1.555 . . . . 0.0 112.25 171.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 51.85 37.83 21.73 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.301 1.44 . . . . 0.0 113.135 -174.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? 53.44 62.59 2.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.761 2.025 . . . . 0.0 112.256 -177.238 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t -116.72 39.23 0.26 Allowed Pre-proline 0 CA--C 1.561 1.377 0 C-N-CA 125.762 1.625 . . . . 0.0 114.322 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -74.92 -25.15 12.31 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 122.03 1.82 . . . . 0.0 113.574 -177.562 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.5 m -67.26 154.9 40.19 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.268 1.827 . . . . 0.0 114.683 -172.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 2.0 pp -87.85 170.01 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.077 1.351 . . . . 0.0 114.524 -174.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -62.88 -25.83 68.49 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 127.211 2.204 . . . . 0.0 114.68 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 62.82 -179.55 0.14 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.205 2.202 . . . . 0.0 113.738 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . 63.77 -5.89 0.26 Allowed 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 118.461 2.763 . . . . 0.0 118.461 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -84.76 150.61 24.96 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.995 1.27 . . . . 0.0 112.0 169.648 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 47.7 pt -68.76 142.78 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.475 0.71 . . . . 0.0 112.413 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.0 tp -138.54 -10.12 1.41 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.57 1.148 . . . . 0.0 113.979 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.04 -17.27 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.491 1.116 . . . . 0.0 113.748 -177.321 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -82.11 -9.22 59.6 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.74 1.216 . . . . 0.0 114.155 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -120.48 127.9 52.65 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.555 1.542 . . . . 0.0 112.417 -176.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 51.9 30.41 7.14 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.372 1.869 . . . . 0.0 114.726 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -144.27 152.11 40.34 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.068 1.747 . . . . 0.0 111.146 -175.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -143.68 153.5 42.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.439 1.896 . . . . 0.0 112.915 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.38 -15.04 56.46 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.88 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -106.92 126.58 29.88 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 124.924 1.289 . . . . 0.0 112.215 -174.634 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -80.41 166.71 19.91 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.646 2.897 . . . . 0.0 112.583 173.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -138.69 125.23 20.64 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.653 1.581 . . . . 0.0 109.863 167.411 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.0 t -104.01 -35.74 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -162.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.1 tp -143.68 127.57 9.21 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.782 1.233 . . . . 0.0 110.757 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -91.2 -13.92 1.87 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.118 2.546 . . . . 0.0 114.415 -177.362 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -115.76 151.36 35.3 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.028 1.331 . . . . 0.0 112.855 -171.741 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -76.38 146.01 39.02 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.785 0.834 . . . . 0.0 113.152 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.2 t -154.16 159.81 41.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.154 1.382 . . . . 0.0 111.987 177.105 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.8 mm 52.93 54.83 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 126.769 2.028 . . . . 0.0 111.002 -176.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -121.79 157.21 31.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.131 1.773 . . . . 0.0 112.738 -171.251 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.9 m -81.08 155.72 26.16 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 152.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -77.35 -10.21 59.31 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 120.847 -1.158 . . . . 0.0 113.803 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -110.32 -20.63 12.56 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.0 p -154.79 164.89 38.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.239 1.016 . . . . 0.0 113.087 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -67.92 123.3 18.22 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.013 0.815 . . . . 0.0 113.994 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.78 142.26 1.08 Allowed Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.746 1.641 . . . . 0.0 114.514 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -80.28 56.38 2.47 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.935 1.694 . . . . 0.0 112.614 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -76.11 -12.38 84.13 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.177 1.37 . . . . 0.0 116.434 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 34.8 p-80 -144.6 -161.29 1.26 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.028 1.414 . . . . 0.0 112.452 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -70.24 44.37 0.07 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.427 2.291 . . . . 0.0 113.023 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -43.84 -19.67 0.12 Allowed Glycine 0 CA--C 1.532 1.094 1 C-N-CA 131.359 4.314 . . . . 0.0 118.452 -170.161 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.78 -38.81 89.45 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.401 1.601 . . . . 0.0 112.352 169.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -112.44 -14.14 13.29 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.648 1.979 . . . . 0.0 113.007 171.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 62.57 48.23 4.54 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.357 2.263 . . . . 0.0 114.78 166.145 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -126.9 168.09 14.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.211 1.805 . . . . 0.0 111.342 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -87.92 -14.67 38.68 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -174.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 C--O 1.252 1.228 0 C-N-CA 126.426 1.89 . . . . 0.0 111.496 -175.598 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 62.2 pttt . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 111.455 0.168 . . . . 0.0 111.455 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -79.02 -33.14 45.12 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.879 0.872 . . . . 0.0 112.585 -178.057 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.96 140.55 22.53 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.161 1.384 . . . . 0.0 111.731 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.96 -52.18 1.61 Allowed Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.328 1.051 . . . . 0.0 112.947 165.202 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.14 -36.49 1.88 Allowed 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.763 2.308 . . . . 0.0 114.556 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 60.92 -64.84 0.06 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 127.91 2.484 . . . . 0.0 114.368 -169.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.5 t -159.55 161.29 35.21 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 128.416 2.686 . . . . 0.0 110.368 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -68.26 -35.45 77.91 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.063 -1.023 . . . . 0.0 112.933 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -145.4 -62.83 0.34 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 p -87.76 95.94 10.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.601 1.161 . . . . 0.0 111.934 -176.351 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.0 p -71.66 63.53 0.43 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 128.373 2.669 . . . . 0.0 115.887 -168.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 pp0? -121.09 148.16 44.55 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 127.376 2.27 . . . . 0.0 110.545 165.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.8 mtm180 -73.07 136.26 44.94 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.639 0.776 . . . . 0.0 111.727 -172.786 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 147.07 -37.67 1.15 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.798 1.19 . . . . 0.0 113.79 176.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -139.72 101.06 4.11 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.179 0.991 . . . . 0.0 112.992 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.86 -178.69 0.33 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.557 1.143 . . . . 0.0 112.938 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.83 -66.21 0.35 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.945 1.698 . . . . 0.0 113.802 -171.706 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -74.34 -11.1 60.16 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.865 1.431 . . . . 0.0 114.865 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -85.64 -26.76 25.83 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.347 1.059 . . . . 0.0 112.263 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.2 t -59.1 -42.34 93.06 Favored Pre-proline 0 CA--C 1.557 1.235 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -77.03 162.7 31.65 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.442 2.095 . . . . 0.0 114.389 -173.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -87.2 6.16 34.45 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.015 1.726 . . . . 0.0 115.629 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.4 pp -83.48 28.46 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 -165.02 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 mt -113.86 145.36 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.163 1.385 . . . . 0.0 111.595 -170.614 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.7 t -43.22 117.47 1.11 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.853 2.061 . . . . 0.0 114.136 -174.22 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.7 m 51.58 20.34 1.04 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.661 1.984 . . . . 0.0 116.245 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.9 t80 52.15 26.38 3.85 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 125.298 1.439 . . . . 0.0 113.789 -167.709 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.4 p -115.48 -25.86 7.76 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.945 1.698 . . . . 0.0 113.627 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -96.99 155.5 20.74 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.688 1.613 . . . . 0.0 113.779 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -109.92 142.54 41.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.437 1.095 . . . . 0.0 110.849 166.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -59.62 -26.18 65.26 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.413 1.485 . . . . 0.0 114.875 -168.587 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.16 1.27 28.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -140.91 -13.59 0.94 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 115.931 1.826 . . . . 0.0 115.931 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -64.24 138.57 58.5 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.868 -1.145 . . . . 0.0 113.409 -176.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.46 133.75 46.56 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.799 1.639 . . . . 0.0 110.227 171.375 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.9 t -58.67 -29.68 66.77 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 171.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -62.93 -25.19 68.22 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.627 1.571 . . . . 0.0 114.087 174.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -131.64 -16.29 3.01 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -165.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.53 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.346 2.1 m 41.22 -98.18 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 128.057 2.543 . . . . 0.0 115.927 178.59 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.53 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 19.9 Cg_exo -77.33 -3.38 13.61 Favored 'Trans proline' 0 C--N 1.36 1.146 0 CA-C-N 123.544 2.301 . . . . 0.0 117.626 -155.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.75 -3.96 2.75 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -171.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.3 -23.38 17.23 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.031 1.332 . . . . 0.0 114.148 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.5 mt -128.51 -15.75 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.266 1.427 . . . . 0.0 112.623 -176.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -128.81 173.28 10.5 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.725 -1.234 . . . . 0.0 111.625 155.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 28.0 p -117.3 -176.67 3.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.51 1.524 . . . . 0.0 110.392 167.439 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.1 p -75.99 -17.93 59.5 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -176.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -96.1 -31.81 12.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.571 1.148 . . . . 0.0 113.768 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -156.09 167.56 30.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.795 1.238 . . . . 0.0 112.263 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.96 18.38 0.18 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.378 1.871 . . . . 0.0 114.853 -169.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -132.09 158.12 42.42 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.86 1.664 . . . . 0.0 112.359 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.99 121.75 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 125.032 1.333 . . . . 0.0 113.465 -165.972 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 54.44 -150.77 15.58 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 124.786 1.184 . . . . 0.0 115.776 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.3 m80 -139.46 10.37 2.5 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.096 1.358 . . . . 0.0 113.705 170.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -72.09 148.98 45.22 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.129 -0.982 . . . . 0.0 112.146 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.0 tpt85 -60.68 -23.21 64.65 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.715 1.606 . . . . 0.0 114.266 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -90.92 -8.09 50.32 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.287 1.835 . . . . 0.0 114.45 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -119.61 -42.14 2.65 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.966 1.306 . . . . 0.0 113.944 -171.716 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.3 t -109.7 112.69 58.32 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 123.891 0.876 . . . . 0.0 112.211 -171.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -69.0 164.48 33.61 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.076 2.518 . . . . 0.0 113.973 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -128.06 144.6 51.12 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.204 1.402 . . . . 0.0 110.617 167.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -78.3 -18.41 55.28 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.6 1.16 . . . . 0.0 113.75 -176.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -67.27 122.46 17.92 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.137 0.575 . . . . 0.0 112.454 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -141.42 148.97 40.42 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 127.722 2.409 . . . . 0.0 109.048 169.795 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -125.32 145.69 49.91 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.028 1.331 . . . . 0.0 111.988 -177.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.6 m -113.48 152.03 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 125.614 1.565 . . . . 0.0 111.943 -177.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 1.1 pp0? -92.08 -12.27 33.5 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.4 m -87.15 99.91 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.428 0.691 . . . . 0.0 112.451 -172.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.4 p 33.23 -79.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 117.483 2.401 . . . . 0.0 117.483 136.151 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 pp -109.65 -10.03 14.84 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.63 2.772 . . . . 0.0 114.729 -170.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.26 161.39 26.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.423 1.089 . . . . 0.0 113.1 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -125.73 148.31 49.1 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.157 1.783 . . . . 0.0 109.662 171.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.8 p -58.33 137.22 57.35 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.476 1.511 . . . . 0.0 112.197 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.4 tttt 53.45 23.55 3.47 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.294 1.837 . . . . 0.0 114.798 -174.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -132.14 12.07 4.65 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.19 1.396 . . . . 0.0 114.386 -175.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -147.83 171.1 16.25 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.904 0.882 . . . . 0.0 111.966 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.9 t -129.26 153.6 47.63 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 79' ' ' ARG . 56.7 mtmt -66.33 -4.23 7.56 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.851 2.06 . . . . 0.0 114.046 165.237 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -66.99 43.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 126.54 1.936 . . . . 0.0 111.676 155.552 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' ARG . . . . . 0.438 ' H ' ' C ' ' A' ' 77' ' ' LYS . 62.9 mmt-85 48.94 50.4 17.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 129.829 3.252 . . . . 0.0 115.423 175.575 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m 64.61 174.67 0.06 OUTLIER Pre-proline 0 CA--C 1.556 1.193 0 C-N-CA 126.118 1.767 . . . . 0.0 115.602 166.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -62.59 -18.26 62.73 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 123.475 2.783 . . . . 0.0 116.35 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.2 p -72.31 -0.78 13.16 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 -171.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 7.6 tp -86.54 119.62 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.703 1.138 . . . . 0.0 110.768 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -140.64 -20.61 0.82 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.531 1.308 . . . . 0.0 114.531 -176.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.44 -22.55 63.65 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -171.233 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -148.04 155.96 42.08 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.368 1.067 . . . . 0.0 112.949 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -103.73 154.3 19.71 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.518 1.527 . . . . 0.0 111.825 171.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.5 mp -95.9 84.66 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 163.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.3 tp -99.77 1.88 43.61 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.062 1.345 . . . . 0.0 113.877 -162.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.9 m -62.31 146.98 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.322 1.049 . . . . 0.0 113.236 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -121.43 151.18 40.5 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.987 1.715 . . . . 0.0 113.613 -171.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -79.81 160.08 26.27 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.633 1.573 . . . . 0.0 113.795 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -123.04 157.43 32.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.142 1.377 . . . . 0.0 112.944 -173.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 60.96 161.47 0.06 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.776 2.431 . . . . 0.0 116.305 -177.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -129.19 161.3 30.45 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.597 2.359 . . . . 0.0 110.574 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -136.01 152.91 51.41 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.316 1.046 . . . . 0.0 113.182 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.49 158.6 60.12 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.594 2.358 . . . . 0.0 110.435 170.247 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.45 154.58 58.11 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.129 2.553 . . . . 0.0 114.103 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -87.44 22.49 2.16 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.804 1.642 . . . . 0.0 113.105 174.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -149.85 150.61 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 127.218 2.207 . . . . 0.0 110.008 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -130.16 146.31 61.0 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.252 1.421 . . . . 0.0 111.214 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.03 -13.72 19.24 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.81 3.007 . . . . 0.0 114.127 -176.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -69.32 -12.19 61.45 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -172.913 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 12.2 t-160 -85.54 3.87 38.56 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.032 1.333 . . . . 0.0 114.568 -173.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 96.9 m -105.85 141.56 37.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 125.151 1.38 . . . . 0.0 111.986 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.1 pt -114.6 158.65 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.797 1.639 . . . . 0.0 111.926 173.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.02 160.17 39.18 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.02 1.328 . . . . 0.0 112.239 -172.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 8.6 t -83.2 142.72 30.96 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.225 1.01 . . . . 0.0 111.972 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -137.46 11.54 2.98 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.898 1.279 . . . . 0.0 112.925 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -142.88 158.18 43.87 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.415 1.886 . . . . 0.0 110.157 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 p 52.64 -5.4 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 119.684 3.216 . . . . 0.0 119.684 173.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.68 -167.94 39.66 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.29 1.424 . . . . 0.0 114.002 -178.001 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.77 161.78 48.79 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.648 1.118 . . . . 0.0 113.954 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -65.28 -19.0 65.76 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -166.409 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.27 -37.22 15.45 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 116.293 1.277 . . . . 0.0 116.293 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.28 141.77 30.71 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.382 1.591 . . . . 0.0 115.016 -164.747 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 37.71 31.78 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 129.486 3.114 . . . . 0.0 117.17 164.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.54 -11.41 41.51 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.302 1.43 . . . . 0.0 115.441 -165.132 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.16 -35.27 73.88 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.671 1.588 . . . . 0.0 113.747 173.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -143.99 -27.54 0.53 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -159.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.0 p -70.27 -11.43 60.9 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -175.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -80.07 51.88 1.44 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.462 1.905 . . . . 0.0 112.653 -176.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -76.2 -7.67 55.36 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.254 1.422 . . . . 0.0 114.8 -176.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm . . . . . 0 C--O 1.252 1.19 0 C-N-CA 126.965 2.106 . . . . 0.0 111.16 178.619 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -158.13 174.26 15.47 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.452 1.501 . . . . 0.0 112.423 -168.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 53.61 56.23 7.53 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.288 1.835 . . . . 0.0 114.659 177.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -45.64 -47.44 38.15 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 173.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 -40.36 0.33 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 122.056 1.838 . . . . 0.0 114.067 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm 40.63 -158.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.693 1.197 . . . . 0.0 111.773 -146.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.1 t -59.77 157.7 11.69 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.408 -1.433 . . . . 0.0 112.834 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -63.58 -35.8 81.68 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.272 -0.892 . . . . 0.0 111.763 168.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -150.15 -48.08 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -166.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 55.6 m -70.25 -40.24 74.52 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.743 1.156 . . . . 0.0 113.924 -170.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.8 m 56.8 21.71 6.28 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 117.446 2.387 . . . . 0.0 117.446 176.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -129.26 8.55 5.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.313 1.445 . . . . 0.0 112.9 175.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -143.49 150.68 39.32 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.629 1.572 . . . . 0.0 111.707 -172.114 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -68.31 -10.83 60.65 Favored Glycine 0 CA--C 1.533 1.215 0 N-CA-C 116.19 1.236 . . . . 0.0 116.19 -170.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.58 92.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.124 1.462 . . . . 0.0 112.432 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -59.02 175.57 0.27 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.089 1.356 . . . . 0.0 113.169 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -32.79 -68.98 0.09 Allowed 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 126.751 2.02 . . . . 0.0 114.45 -173.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -78.49 -8.03 58.1 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -27.32 26.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.046 1.339 . . . . 0.0 111.821 171.658 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.09 139.49 95.99 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.257 1.423 . . . . 0.0 112.013 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.94 -19.45 46.12 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.574 2.849 . . . . 0.0 114.995 178.107 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 23.8 t-160 -117.76 108.27 15.18 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.556 1.142 . . . . 0.0 110.94 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.0 pt -140.56 165.46 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 125.878 1.671 . . . . 0.0 112.062 -178.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.9 mt 54.69 22.97 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 126.678 1.991 . . . . 0.0 113.585 175.554 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.1 m 46.82 27.58 0.71 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.136 1.774 . . . . 0.0 114.616 -174.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . 0.299 5.7 p 42.07 79.58 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.588 1.955 . . . . 0.0 113.315 -162.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 68.54 17.09 9.08 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.454 2.702 . . . . 0.0 116.984 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -109.09 66.1 0.63 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 108.434 164.492 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 164.29 -162.6 35.45 Favored Glycine 0 CA--C 1.524 0.631 0 O-C-N 121.195 -0.94 . . . . 0.0 114.0 173.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -136.41 158.03 45.39 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.617 1.567 . . . . 0.0 108.597 163.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.5 t -67.41 -24.76 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -175.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -119.63 -39.09 2.9 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -107.82 61.95 0.61 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.153 0.981 . . . . 0.0 112.959 -171.305 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -153.76 134.95 14.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.241 1.416 . . . . 0.0 111.031 -176.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -156.12 171.22 20.53 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.227 1.011 . . . . 0.0 112.648 -172.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -53.69 -32.08 50.38 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.083 1.753 . . . . 0.0 114.564 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -84.9 -8.96 58.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.015 1.726 . . . . 0.0 113.649 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -131.78 -0.55 3.85 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.839 1.656 . . . . 0.0 114.699 -170.42 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 t -27.96 -52.84 0.24 Allowed Pre-proline 0 CA--C 1.557 1.222 0 C-N-CA 127.969 2.508 . . . . 0.0 117.25 -175.355 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -65.41 -18.49 60.17 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 122.701 2.267 . . . . 0.0 116.167 -178.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -73.16 128.08 34.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.782 1.233 . . . . 0.0 110.692 174.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.73 138.96 21.3 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -172.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 35.9 mm 58.38 139.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 130.51 3.524 . . . . 0.0 116.709 165.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -162.24 158.94 25.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.345 1.858 . . . . 0.0 112.858 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.6 t -99.49 162.34 13.09 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.079 1.352 . . . . 0.0 110.14 159.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.5 p -56.2 140.46 44.39 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 120.938 -1.101 . . . . 0.0 111.692 177.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt 56.94 6.71 0.34 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.639 1.976 . . . . 0.0 115.687 -174.307 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.5 m -93.85 -36.44 12.24 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.225 1.01 . . . . 0.0 112.523 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 60.01 -20.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 128.087 2.555 . . . . 0.0 116.769 -176.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -136.58 127.58 27.72 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.959 2.103 . . . . 0.0 110.021 162.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.274 13.5 m 40.78 -62.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.026 1 C-N-CA 132.575 4.35 . . . . 0.0 118.949 178.943 . . . . . . . . 3 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 166.26 155.37 8.8 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.981 1.276 . . . . 0.0 114.051 -172.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -77.26 113.64 15.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.287 1.435 . . . . 0.0 112.602 175.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.6 t80 66.02 154.53 0.08 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.794 2.038 . . . . 0.0 115.662 -173.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 48.84 16.49 0.12 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 128.383 2.673 . . . . 0.0 114.982 -167.339 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.0 m 50.13 28.23 2.94 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.119 1.768 . . . . 0.0 114.515 -170.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -157.94 -14.79 0.08 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 115.861 1.8 . . . . 0.0 115.861 -174.621 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 31.5 p 36.63 89.1 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.192 0 C-N-CA 127.793 2.437 . . . . 0.0 115.998 -172.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -63.98 10.69 0.11 Allowed 'Trans proline' 0 CA--C 1.551 1.349 0 C-N-CA 124.683 3.588 . . . . 0.0 117.728 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 64.22 -28.83 0.1 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 129.366 3.066 . . . . 0.0 117.986 173.715 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -71.37 -3.51 21.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.746 1.619 . . . . 0.0 114.407 174.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -68.08 -20.93 64.99 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.66 1.584 . . . . 0.0 114.178 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.0 tttp -71.55 123.32 22.19 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.856 1.262 . . . . 0.0 112.92 -175.189 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt 57.07 -33.72 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 130.519 3.528 . . . . 0.0 119.505 173.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -67.65 145.01 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-N 120.264 1.393 . . . . 0.0 113.225 -171.708 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -81.02 -19.07 44.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.481 1.112 . . . . 0.0 113.076 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.0 m -97.89 148.35 23.52 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.042 0.937 . . . . 0.0 111.943 178.498 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.2 t -74.72 -35.21 62.67 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 69' ' ' LEU . 1.7 pt? -95.23 -25.2 16.46 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.72 147.06 39.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.92 0.888 . . . . 0.0 112.853 -169.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -103.85 -31.4 9.8 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.608 1.163 . . . . 0.0 112.676 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.4 m -79.57 160.67 26.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.291 1.036 . . . . 0.0 113.542 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.49 163.7 22.1 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.857 1.663 . . . . 0.0 112.712 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.4 tppt? 56.53 31.25 18.67 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.467 1.907 . . . . 0.0 113.385 -173.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -89.72 158.84 17.37 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.724 1.609 . . . . 0.0 113.265 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.4 p -162.37 -65.27 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 176.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -56.04 147.64 19.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.7 2.0 . . . . 0.0 113.718 -161.49 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 55.93 27.31 10.92 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.851 1.66 . . . . 0.0 113.72 -171.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.5 mmt85 50.38 50.65 18.33 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 126.526 1.93 . . . . 0.0 111.917 -169.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m 61.23 130.59 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 129.096 2.958 . . . . 0.0 113.681 -162.075 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.47 157.32 61.38 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.83 2.353 . . . . 0.0 112.951 -173.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.3 m 58.98 13.01 2.61 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.81 1.781 . . . . 0.0 115.81 174.326 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.6 mt 48.58 31.84 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 125.681 1.592 . . . . 0.0 112.463 -170.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 56.74 17.58 3.25 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 126.66 1.984 . . . . 0.0 115.355 -174.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -66.33 -15.05 62.94 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.288 1.835 . . . . 0.0 114.44 -176.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.55 -16.57 61.26 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 174.302 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -95.18 166.52 11.87 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.607 1.563 . . . . 0.0 112.179 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.6 tp -139.9 150.19 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.092 1.357 . . . . 0.0 112.226 -176.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.4 tp -133.82 144.49 49.01 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.109 1.763 . . . . 0.0 110.699 178.319 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.8 t -74.74 -45.64 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.844 0.858 . . . . 0.0 111.805 -177.517 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.6 t70 53.27 30.19 9.68 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.215 1.806 . . . . 0.0 115.387 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -109.03 2.19 21.07 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.035 1.334 . . . . 0.0 113.811 -173.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.85 107.3 13.54 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.26 -0.9 . . . . 0.0 110.988 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.71 -11.54 59.61 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -173.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -121.27 119.44 32.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.435 1.494 . . . . 0.0 111.343 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -138.81 19.87 2.67 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.838 1.655 . . . . 0.0 112.136 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -91.77 153.33 43.74 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 126.203 1.801 . . . . 0.0 113.172 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.94 164.61 35.1 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.26 2.64 . . . . 0.0 112.943 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -123.76 168.31 12.88 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.604 1.962 . . . . 0.0 111.373 174.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.31 -2.3 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -168.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.47 HD23 ' H ' ' A' ' 101' ' ' LEU . 1.6 pt? -104.16 144.82 29.47 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.882 1.273 . . . . 0.0 113.738 -176.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -82.59 169.42 13.72 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.093 3.196 . . . . 0.0 113.94 -176.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -90.73 152.34 20.85 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.902 1.681 . . . . 0.0 112.385 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 26.0 m170 47.32 62.7 2.29 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.929 1.692 . . . . 0.0 114.947 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.8 p -79.28 49.79 1.01 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 127.765 2.426 . . . . 0.0 112.577 174.825 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.7 pt -82.77 159.91 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 C-N-CA 125.372 1.469 . . . . 0.0 113.831 -171.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -136.24 170.49 15.94 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.286 2.235 . . . . 0.0 110.553 178.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 66.5 m -64.24 155.67 31.21 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.62 -0.675 . . . . 0.0 110.503 158.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -72.18 172.7 9.72 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.873 -0.517 . . . . 0.0 111.068 159.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 56.0 t30 65.52 -61.71 0.24 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.555 2.342 . . . . 0.0 115.991 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.94 -21.79 26.04 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -170.171 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.51 -5.59 28.39 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 124.758 1.17 . . . . 0.0 115.457 -173.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -78.8 -171.81 40.56 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.866 1.222 . . . . 0.0 112.789 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -144.34 146.08 32.35 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.881 1.672 . . . . 0.0 110.697 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.47 17.71 48.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 162.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 47.5 p-80 -140.01 132.64 28.83 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.547 1.673 . . . . 0.0 113.23 168.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 40.16 30.55 0.07 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 128.225 2.61 . . . . 0.0 117.141 168.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.7 -31.38 37.67 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.794 1.188 . . . . 0.0 115.514 -164.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.13 -38.34 86.01 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.022 1.729 . . . . 0.0 114.284 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -106.74 -19.98 13.49 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.728 2.011 . . . . 0.0 112.894 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 48.2 t -72.63 -22.67 60.91 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.684 1.994 . . . . 0.0 112.425 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -58.82 149.69 25.95 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.476 1.51 . . . . 0.0 111.493 168.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -70.48 -21.65 62.75 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -169.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 65.2 mttp . . . . . 0 C--O 1.252 1.191 0 C-N-CA 126.282 1.833 . . . . 0.0 111.806 179.274 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.9 tptt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 110.297 -0.261 . . . . 0.0 110.297 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 53.26 38.96 28.96 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.688 1.595 . . . . 0.0 114.457 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -126.0 134.51 51.44 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.664 1.186 . . . . 0.0 112.689 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.05 -51.91 25.5 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.371 1.068 . . . . 0.0 113.223 167.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.86 -39.73 1.68 Allowed 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.447 2.098 . . . . 0.0 113.763 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER 61.1 -55.05 0.1 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 128.251 2.62 . . . . 0.0 115.956 -176.377 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -158.92 158.72 33.89 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.3 2.24 . . . . 0.0 110.809 174.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -67.79 -39.06 84.06 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 112.923 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -160.03 -34.71 0.06 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.934 1.694 . . . . 0.0 113.391 -177.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.5 m -68.44 -30.17 68.98 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -171.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 m 53.2 22.63 2.72 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 170.717 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -134.82 6.06 3.4 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.298 1.039 . . . . 0.0 113.45 177.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 -141.02 154.93 46.23 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.971 1.708 . . . . 0.0 112.091 -164.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -72.07 -18.01 77.56 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 116.374 1.31 . . . . 0.0 116.374 -169.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.22 95.82 0.79 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 118.448 1.124 . . . . 0.0 111.921 172.073 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.32 178.15 0.57 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.138 1.375 . . . . 0.0 112.688 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.83 -64.56 0.48 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.149 1.779 . . . . 0.0 114.323 -170.784 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -74.67 -15.46 60.8 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.897 1.679 . . . . 0.0 115.075 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.26 -20.02 30.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.704 1.202 . . . . 0.0 111.773 178.367 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.98 154.09 90.86 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 124.18 0.992 . . . . 0.0 112.243 157.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -75.47 142.99 27.1 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.317 2.678 . . . . 0.0 111.585 177.188 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.9 t60 -153.58 167.84 28.19 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.07 1.348 . . . . 0.0 111.124 176.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.8 mt 55.42 52.06 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.048 1.739 . . . . 0.0 111.407 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.0 mt -101.1 120.03 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.72 1.608 . . . . 0.0 108.728 -174.078 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 p -62.66 126.82 28.64 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.449 1.022 . . . . 0.0 110.298 -176.784 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.0 m 46.87 29.02 0.93 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -175.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 t80 55.03 30.89 15.04 Favored 'General case' 0 CA--C 1.552 1.058 0 C-N-CA 126.704 2.002 . . . . 0.0 115.195 -172.882 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 91.4 m -73.87 106.63 5.68 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.545 1.538 . . . . 0.0 112.783 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.44 -151.28 50.55 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.538 -0.726 . . . . 0.0 113.951 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -105.12 139.62 39.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.669 1.188 . . . . 0.0 110.202 170.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.3 t -55.17 -27.34 45.03 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -172.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.89 -35.3 22.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -99.53 -13.02 19.64 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -63.9 130.27 43.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.849 1.66 . . . . 0.0 111.745 174.64 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -147.24 149.42 32.86 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.841 1.256 . . . . 0.0 109.804 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.4 p -64.97 -21.11 66.79 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -163.504 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.9 ptt180 -73.78 -19.41 60.78 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -108.5 -35.66 6.42 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.921 1.688 . . . . 0.0 112.323 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.502 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.449 1.6 t 47.72 -114.45 0.0 OUTLIER Pre-proline 0 CA--C 1.563 1.454 0 C-N-CA 128.063 2.545 . . . . 0.0 113.973 174.898 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.502 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 56.0 Cg_endo -79.99 -11.52 13.64 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 CA-C-N 124.491 2.64 . . . . 0.0 116.276 -167.177 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -83.48 54.87 2.98 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.212 1.405 . . . . 0.0 114.321 -165.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.07 -11.46 0.75 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 177.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 mm -119.12 11.55 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 125.565 1.546 . . . . 0.0 112.56 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.442 ' HA ' ' HA ' ' A' ' 50' ' ' GLU . 8.3 pt20 -133.06 160.06 38.27 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -173.934 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -65.57 165.34 12.46 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.638 1.175 . . . . 0.0 111.61 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 m -71.48 -31.29 66.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -134.61 19.74 3.59 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.06 1.744 . . . . 0.0 113.012 -176.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.0 t -153.13 169.13 23.73 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 126.632 1.973 . . . . 0.0 109.881 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -70.04 -174.43 0.78 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 125.335 1.454 . . . . 0.0 113.822 178.018 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 44' ' ' GLN . 1.5 mp0 -40.59 128.29 2.49 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.406 2.282 . . . . 0.0 114.967 -172.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m -66.85 -7.88 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 O-C-N 120.953 -1.092 . . . . 0.0 112.374 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 -15.51 31.18 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.928 1.251 . . . . 0.0 114.848 167.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.91 -178.12 6.5 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.289 1.544 . . . . 0.0 114.333 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.6 173.31 2.82 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 118.237 2.68 . . . . 0.0 118.237 -158.296 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 44.19 95.74 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.834 3.254 . . . . 0.0 115.114 161.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.5 m 61.46 22.06 12.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 52.72 72.52 0.41 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.916 1.286 . . . . 0.0 111.024 -167.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 2.0 t 74.18 133.89 0.04 OUTLIER Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 128.186 2.594 . . . . 0.0 112.237 -162.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 58' ' ' CYS . 80.1 Cg_exo -55.63 144.03 76.77 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 123.166 2.577 . . . . 0.0 115.923 -167.926 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -69.62 129.93 41.0 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.816 1.247 . . . . 0.0 112.951 -178.588 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -101.68 30.56 4.26 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.166 1.786 . . . . 0.0 113.642 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 25.7 t-105 -101.29 11.65 38.91 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.047 1.739 . . . . 0.0 113.984 -167.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 93.7 mttt 54.65 32.93 18.21 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.843 1.657 . . . . 0.0 113.108 -174.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tptp -71.93 156.7 38.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 126.232 1.813 . . . . 0.0 111.742 -177.163 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p -58.55 128.95 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.236 0.614 . . . . 0.0 111.593 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -87.1 -12.03 48.34 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 46.2 m -84.18 150.62 25.37 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.29 1.036 . . . . 0.0 112.169 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.5 t -78.97 -36.04 42.06 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.828 1.251 . . . . 0.0 113.601 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -93.9 -9.36 37.45 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -172.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 72.2 m -89.28 148.93 23.3 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.022 0.929 . . . . 0.0 112.325 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -79.48 169.35 18.18 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.542 1.137 . . . . 0.0 111.081 166.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.0 m -82.48 26.92 0.53 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.369 1.068 . . . . 0.0 113.528 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.8 tppt? -150.1 162.06 41.15 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.119 2.168 . . . . 0.0 109.805 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 55.84 39.22 30.69 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.471 1.509 . . . . 0.0 113.113 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -119.6 160.49 22.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.646 1.578 . . . . 0.0 111.924 -174.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 p -152.5 158.86 43.16 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.403 1.081 . . . . 0.0 113.067 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -69.28 171.03 9.13 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.968 1.307 . . . . 0.0 112.912 -176.612 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 57.87 37.65 26.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.993 1.317 . . . . 0.0 112.826 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? 59.18 60.39 2.4 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.134 2.174 . . . . 0.0 112.851 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.6 p 40.8 56.11 7.91 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 127.768 2.427 . . . . 0.0 116.895 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -81.13 -26.01 3.69 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.789 2.993 . . . . 0.0 113.71 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.8 t -138.43 154.89 48.88 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.073 1.349 . . . . 0.0 113.282 -167.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 16.2 tt -74.73 -20.8 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 125.928 1.691 . . . . 0.0 113.43 175.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -61.42 148.29 42.19 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.465 1.106 . . . . 0.0 113.291 -175.483 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -98.98 -0.33 42.34 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.474 1.51 . . . . 0.0 113.492 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.38 9.92 38.18 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.433 1.493 . . . . 0.0 114.986 -167.709 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -61.02 150.83 32.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.097 0.959 . . . . 0.0 113.075 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.8 pt -69.19 148.47 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.945 0.898 . . . . 0.0 113.342 -171.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.3 mt -104.78 12.95 32.11 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.455 1.502 . . . . 0.0 113.413 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.4 m -104.55 158.21 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 125.739 1.616 . . . . 0.0 111.441 175.112 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -79.37 146.14 33.02 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.885 0.874 . . . . 0.0 113.157 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -111.93 13.18 20.83 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.378 1.871 . . . . 0.0 113.647 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.311 0.5 OUTLIER 55.83 19.31 3.42 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 170.781 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -89.84 147.65 23.66 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.216 0.916 . . . . 0.0 111.595 166.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -135.95 -178.87 5.33 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.78 1.632 . . . . 0.0 113.233 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 68.67 134.43 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 129.004 2.922 . . . . 0.0 115.131 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -147.38 97.68 4.04 Favored Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 127.415 2.286 . . . . 0.0 108.941 -178.647 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.63 -14.86 7.62 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.951 2.434 . . . . 0.0 113.952 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -76.72 152.14 35.81 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.529 1.132 . . . . 0.0 113.419 -175.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -139.01 160.82 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.691 1.597 . . . . 0.0 111.415 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.2 mt -111.39 86.24 6.43 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 125.921 1.689 . . . . 0.0 109.097 173.629 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -83.57 170.07 11.84 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.613 2.875 . . . . 0.0 113.905 -167.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 59.17 33.85 22.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.021 1.728 . . . . 0.0 115.254 170.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -126.61 150.55 48.83 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.462 1.505 . . . . 0.0 111.54 177.691 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 54.3 m -128.71 -49.09 1.25 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -174.036 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.3 pp -137.42 154.5 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.511 1.124 . . . . 0.0 113.27 -173.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -142.25 97.98 3.23 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.297 1.439 . . . . 0.0 110.41 -178.253 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 12.7 t -152.77 154.29 34.89 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.957 0.903 . . . . 0.0 111.59 173.851 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -144.2 -43.17 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -80.1 -30.9 39.25 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -164.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 24.2 p -149.6 139.71 22.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.886 1.274 . . . . 0.0 110.782 -176.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 67.14 20.83 71.42 Favored Glycine 0 CA--C 1.541 1.665 0 O-C-N 121.415 -0.803 . . . . 0.0 114.459 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 61.07 -134.08 48.98 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-N 118.088 0.944 . . . . 0.0 112.168 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -92.26 -1.41 57.12 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.866 1.266 . . . . 0.0 114.084 169.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.25 -156.35 27.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.626 1.584 . . . . 0.0 115.355 -173.452 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.7 p80 45.53 -157.14 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.593 2.757 . . . . 0.0 115.516 -178.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -71.61 28.76 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.951 1.701 . . . . 0.0 113.097 168.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' GLY . . . . . 0.444 ' HA2' ' SG ' ' A' ' 121' ' ' CYS . . . -52.36 -24.52 16.82 Favored Glycine 0 CA--C 1.541 1.69 0 C-N-CA 127.962 2.696 . . . . 0.0 115.58 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -67.04 -40.25 87.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.267 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -98.09 -17.57 19.02 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.318 1.847 . . . . 0.0 113.176 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' CYS . . . . . 0.444 ' SG ' ' HA2' ' A' ' 118' ' ' GLY . 1.8 p -71.8 6.5 1.97 Allowed 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 115.033 1.494 . . . . 0.0 115.033 -174.831 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.3 mttm -74.94 158.59 33.05 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.79 1.636 . . . . 0.0 112.99 -170.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -136.89 147.0 46.19 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.113 1.365 . . . . 0.0 111.759 -172.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.838 1.655 . . . . 0.0 112.174 -179.583 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -156.14 165.56 36.05 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.085 1.754 . . . . 0.0 111.607 -172.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.34 132.88 34.23 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.145 0.978 . . . . 0.0 113.082 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.72 37.86 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.747 1.219 . . . . 0.0 113.58 165.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -46.16 0.36 Allowed 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.044 1.829 . . . . 0.0 114.029 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt 41.71 -163.31 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.95 1.3 . . . . 0.0 112.816 -149.183 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 m -58.52 150.13 23.58 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.08 -1.637 . . . . 0.0 113.129 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 38.4 t30 -64.43 -44.95 89.6 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.691 0.797 . . . . 0.0 112.277 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -121.72 -58.25 1.76 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.63 1.172 . . . . 0.0 112.249 -167.234 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.5 p -79.48 -166.37 0.95 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.684 0.793 . . . . 0.0 110.931 167.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 62.3 p -134.61 23.47 3.68 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -69.19 171.66 8.06 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.774 -0.579 . . . . 0.0 111.631 168.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.58 149.32 39.85 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.787 1.235 . . . . 0.0 111.964 168.238 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 122.03 -93.28 0.5 Allowed Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.093 1.33 . . . . 0.0 110.716 -169.087 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.08 74.8 2.95 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 121.956 0.884 . . . . 0.0 113.047 176.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.426 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.03 173.86 1.0 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.865 1.266 . . . . 0.0 113.008 173.583 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.1 OUTLIER -16.03 -73.63 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.776 2.83 . . . . 0.0 115.44 -171.589 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -67.46 -26.26 66.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.309 1.843 . . . . 0.0 115.65 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.94 -20.52 24.39 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.201 1.8 . . . . 0.0 112.828 176.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -56.92 -40.93 88.64 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.243 1.817 . . . . 0.0 114.56 -173.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -65.1 131.55 29.01 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.865 2.377 . . . . 0.0 112.474 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -74.77 139.87 43.64 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.5 mt -127.32 90.6 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.808 1.643 . . . . 0.0 108.919 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.16 155.65 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 126.8 2.04 . . . . 0.0 110.553 -176.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 73.9 m -87.05 1.05 54.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.093 1.357 . . . . 0.0 113.853 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.0 m 63.66 126.13 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.343 2.257 . . . . 0.0 114.065 -163.685 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 40.2 t80 57.83 -21.09 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 127.412 2.285 . . . . 0.0 116.012 -164.803 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.0 t -110.82 138.15 47.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.378 2.271 . . . . 0.0 111.036 178.396 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.55 -178.14 51.47 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.047 1.308 . . . . 0.0 114.864 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -140.03 144.66 37.01 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.51 1.524 . . . . 0.0 110.229 171.877 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.0 t -69.98 -16.04 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -172.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.2 -21.69 15.42 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.663 1.585 . . . . 0.0 114.006 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.83 108.61 4.03 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.533 1.133 . . . . 0.0 111.841 -175.687 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -148.4 143.19 26.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.871 1.269 . . . . 0.0 110.799 -178.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -135.99 105.47 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 -167.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.2 m 54.76 -160.01 0.17 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.533 1.533 . . . . 0.0 114.527 167.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.6 2.07 23.75 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 166.093 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -80.13 -40.54 27.23 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.71 1.204 . . . . 0.0 111.733 177.576 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.9 m 63.85 166.04 0.11 Allowed Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 128.121 2.568 . . . . 0.0 114.83 -178.783 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -118.42 -153.78 0.0 OUTLIER 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.481 2.788 . . . . 0.0 112.814 -160.512 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -66.95 -15.58 63.79 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.064 1.746 . . . . 0.0 115.446 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 58.35 -166.39 0.16 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.008 1.723 . . . . 0.0 115.148 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.3 mt -83.43 52.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.123 1.769 . . . . 0.0 112.095 -163.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -150.32 148.83 29.31 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.579 1.552 . . . . 0.0 113.661 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.3 t -81.13 133.22 35.43 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.88 2.072 . . . . 0.0 109.503 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.7 p -67.16 -21.6 65.8 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -77.09 -26.22 53.14 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.917 1.287 . . . . 0.0 113.059 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.7 p -153.56 -92.91 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -136.67 -164.55 1.59 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.52 1.928 . . . . 0.0 111.772 -166.118 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -45.71 139.47 4.01 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.702 1.601 . . . . 0.0 113.946 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.0 m -64.83 -8.61 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 121.176 -0.952 . . . . 0.0 112.585 173.05 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.88 -8.14 2.02 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 127.159 2.314 . . . . 0.0 115.754 171.392 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -147.41 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.921 1.688 . . . . 0.0 112.445 163.818 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -52.64 126.16 18.87 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.814 -1.179 . . . . 0.0 112.732 176.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.4 mmt-85 -66.41 160.24 25.25 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.897 2.079 . . . . 0.0 112.852 -171.343 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m 55.71 36.66 27.67 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.441 1.096 . . . . 0.0 113.076 -166.501 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.271 10.6 pt20 42.12 90.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.941 2.896 . . . . 0.0 115.843 -178.04 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.7 t 61.85 55.05 2.76 Favored Pre-proline 0 CA--C 1.556 1.201 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 164.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -68.49 179.02 3.28 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.761 2.974 . . . . 0.0 112.723 170.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -56.68 -16.76 6.9 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.213 1.805 . . . . 0.0 115.527 -174.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -69.16 -16.55 63.66 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.655 1.182 . . . . 0.0 114.133 172.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -66.05 131.92 47.33 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.929 0.891 . . . . 0.0 111.152 167.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 33.0 mmmt -139.21 160.09 40.63 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.935 1.694 . . . . 0.0 111.873 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -140.84 166.09 25.74 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.864 2.066 . . . . 0.0 111.199 173.883 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.509 HG12 ' H ' ' A' ' 67' ' ' CYS . 21.6 t -67.73 131.12 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 164.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -77.81 -0.39 26.99 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.509 ' H ' HG12 ' A' ' 65' ' ' VAL . 80.8 m -124.63 165.58 17.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.965 1.706 . . . . 0.0 111.443 170.432 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.2 p -127.73 -28.48 2.71 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.061 2.144 . . . . 0.0 110.852 -159.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.4 -37.79 87.16 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.114 1.766 . . . . 0.0 110.501 161.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.9 m -82.79 129.55 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.01 1.324 . . . . 0.0 111.677 -173.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -114.59 14.57 17.69 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.488 1.515 . . . . 0.0 113.49 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.3 t -140.95 161.79 37.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.421 1.888 . . . . 0.0 112.401 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.6 -18.66 59.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.0 1.32 . . . . 0.0 114.262 173.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -79.18 147.05 32.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.085 0.954 . . . . 0.0 111.074 168.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -142.65 146.3 34.33 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.506 1.122 . . . . 0.0 111.878 -175.268 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.8 m -133.85 105.25 6.67 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -168.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -66.03 -17.35 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.144 1.377 . . . . 0.0 114.242 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -85.74 -9.77 56.61 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.077 0.951 . . . . 0.0 113.389 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -119.81 -43.6 2.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.533 1.533 . . . . 0.0 113.792 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 t -80.44 -57.58 0.62 Allowed Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -171.038 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -76.07 154.89 37.9 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.255 1.97 . . . . 0.0 113.067 -176.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 26.0 m 58.91 -172.17 0.11 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 116.224 1.935 . . . . 0.0 116.224 167.794 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 9.5 tp -139.74 138.37 38.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 125.527 1.531 . . . . 0.0 110.462 174.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -92.92 116.71 29.29 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.664 0.786 . . . . 0.0 111.231 177.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -134.94 13.35 3.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.685 1.594 . . . . 0.0 113.46 178.91 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -110.27 169.1 8.96 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.077 1.351 . . . . 0.0 113.326 -172.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -142.47 153.81 43.99 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.996 1.319 . . . . 0.0 111.408 172.094 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 78.9 mt -78.56 131.95 33.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.239 1.016 . . . . 0.0 111.213 -173.763 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -129.58 150.9 50.71 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.377 1.871 . . . . 0.0 109.801 169.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 49.3 t -130.66 138.67 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.968 1.307 . . . . 0.0 110.434 -174.191 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -135.34 160.93 36.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.128 1.771 . . . . 0.0 111.456 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -124.65 150.77 45.7 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.513 1.525 . . . . 0.0 111.928 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -110.97 144.2 40.44 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.574 1.549 . . . . 0.0 112.461 -175.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -134.45 138.94 45.16 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.241 1.416 . . . . 0.0 111.481 176.186 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -154.07 159.65 41.63 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.1 1.76 . . . . 0.0 112.416 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -114.14 167.11 10.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.628 1.571 . . . . 0.0 112.758 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -132.6 134.9 25.29 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.785 1.634 . . . . 0.0 112.089 -176.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -80.85 -177.54 3.81 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.371 3.381 . . . . 0.0 113.124 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -64.55 160.86 18.6 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 113.304 175.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.07 143.15 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 126.42 1.888 . . . . 0.0 108.778 166.379 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 146.34 99.02 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -173.453 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.41 140.65 9.7 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.336 2.69 . . . . 0.0 112.788 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -141.93 -6.73 0.97 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 172.244 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -110.6 8.68 22.9 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -164.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 34.3 p -93.13 7.95 42.12 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.736 2.015 . . . . 0.0 114.031 -175.787 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.1 tt -44.47 -38.63 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 127.25 2.22 . . . . 0.0 116.06 -164.664 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -75.39 -11.7 60.1 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' CYS . . . . . 0.426 ' HB2' ' H ' ' A' ' 115' ' ' GLY . 2.9 t -156.81 46.38 0.42 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.265 1.026 . . . . 0.0 112.011 168.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -58.93 -18.21 31.53 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -168.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -62.63 -29.63 70.77 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.492 1.517 . . . . 0.0 114.802 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 22.8 p -150.68 -2.07 0.37 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.63 -169.09 46.59 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.809 1.195 . . . . 0.0 113.279 -171.641 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.58 0.64 87.81 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.289 0.947 . . . . 0.0 115.088 -174.307 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt 28.87 99.06 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 129.849 3.26 . . . . 0.0 116.256 170.337 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.426 ' H ' ' HB2' ' A' ' 108' ' ' CYS . . . 98.06 3.9 57.79 Favored Glycine 0 CA--C 1.534 1.255 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 36.1 p-80 -91.51 121.4 33.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.991 . . . . 0.0 112.008 169.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 38.73 35.63 0.12 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.656 2.382 . . . . 0.0 115.274 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.32 -33.17 52.46 Favored Glycine 0 N--CA 1.476 1.307 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 -150.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.35 -48.64 49.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.242 1.417 . . . . 0.0 113.282 177.182 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -77.28 -26.82 52.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.142 1.377 . . . . 0.0 112.269 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 8.1 t -74.29 -2.99 27.47 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.271 1.828 . . . . 0.0 113.382 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.37 -22.84 65.55 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.603 1.561 . . . . 0.0 113.752 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -124.72 158.57 32.91 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.958 1.303 . . . . 0.0 112.794 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--O 1.252 1.226 0 C-N-CA 126.619 1.968 . . . . 0.0 111.671 179.1 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 47.6 tttp . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.499 0.19 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -74.09 -19.77 60.48 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -172.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.22 124.94 33.17 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -167.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -86.66 -51.03 0.46 Allowed Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.344 1.457 . . . . 0.0 113.404 158.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.15 -31.52 7.67 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 123.032 2.488 . . . . 0.0 115.314 -173.212 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.264 1.4 tmmt? 62.25 -60.93 0.12 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 128.115 2.566 . . . . 0.0 117.011 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -164.54 152.58 12.23 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.738 2.815 . . . . 0.0 109.54 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -68.53 -34.39 75.78 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -144.92 -39.98 0.25 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.254 1.421 . . . . 0.0 113.223 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.6 p -88.0 -156.4 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.731 1.612 . . . . 0.0 111.364 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -146.25 143.78 29.42 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -172.967 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 58.71 46.21 14.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.752 2.021 . . . . 0.0 115.004 160.509 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -126.54 14.25 7.6 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.979 1.711 . . . . 0.0 113.858 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.62 -41.73 1.92 Allowed Glycine 0 N--CA 1.477 1.39 0 C-N-CA 125.543 1.544 . . . . 0.0 115.704 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.54 84.4 0.43 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.265 1.426 . . . . 0.0 111.935 172.112 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.501 ' H ' HD13 ' A' ' 16' ' ' LEU . 0.0 OUTLIER -63.44 -179.66 0.36 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.678 1.591 . . . . 0.0 113.529 176.518 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.03 -68.08 0.06 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 127.171 2.189 . . . . 0.0 114.97 -171.182 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -73.96 -22.57 59.59 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.339 1.856 . . . . 0.0 115.386 -179.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.15 -26.92 26.53 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.58 1.552 . . . . 0.0 112.339 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.44 -50.85 83.81 Favored Pre-proline 0 CA--C 1.546 0.798 0 C-N-CA 125.789 1.636 . . . . 0.0 114.86 -173.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.36 119.09 5.62 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 121.86 1.706 . . . . 0.0 112.014 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -89.49 167.7 12.78 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.989 0.915 . . . . 0.0 111.241 167.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.1 mt -80.05 71.57 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.759 1.224 . . . . 0.0 110.787 -176.691 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.2 mt -135.25 146.4 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.22 2.208 . . . . 0.0 109.285 172.696 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.1 t -71.16 125.55 27.23 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.344 0.658 . . . . 0.0 111.091 173.769 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 10.0 t -65.63 127.25 31.14 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -164.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 50.51 31.74 5.9 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.146 1.778 . . . . 0.0 114.329 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.8 t -135.39 -21.48 1.56 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.625 1.17 . . . . 0.0 113.868 -167.475 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.96 170.7 37.7 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.593 1.092 . . . . 0.0 113.13 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -100.96 158.6 15.87 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.557 1.543 . . . . 0.0 110.763 170.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.8 t -59.95 -31.28 69.72 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -100.13 -7.69 24.55 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.901 1.28 . . . . 0.0 113.705 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -149.21 87.57 1.54 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.496 1.119 . . . . 0.0 112.27 -173.307 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' HIS . . . . . 0.404 ' CD2' ' H ' ' A' ' 35' ' ' TYR . 46.9 t-80 -153.34 174.6 14.12 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.03 2.132 . . . . 0.0 110.009 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.404 ' H ' ' CD2' ' A' ' 34' ' ' HIS 0.297 1.7 p90 59.06 -30.24 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 131.157 3.783 . . . . 0.0 117.994 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 86.6 p -60.83 163.56 5.59 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.487 1.039 . . . . 0.0 111.423 162.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.9 ttt-85 54.98 24.72 6.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.587 1.155 . . . . 0.0 112.508 -164.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 46.24 96.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.043 2.537 . . . . 0.0 114.263 -167.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.433 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.431 6.4 t 73.18 -105.02 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.236 0 C-N-CA 127.984 2.514 . . . . 0.0 115.602 177.636 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.433 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 61.2 Cg_endo -66.75 138.96 50.79 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.695 2.264 . . . . 0.0 113.773 -166.26 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -143.62 -29.19 0.52 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -171.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.46 174.67 13.6 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -173.167 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.276 2.7 mt 64.15 63.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 127.48 2.312 . . . . 0.0 114.174 169.269 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -128.83 168.74 15.47 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.478 1.511 . . . . 0.0 113.095 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 83.9 m -70.91 163.48 27.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.792 0.806 . . . . 0.0 112.237 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m -74.32 -24.02 59.14 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -120.64 -5.65 9.72 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.528 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.6 p -148.53 158.72 44.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.579 1.151 . . . . 0.0 111.995 178.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -74.37 137.92 43.08 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.562 1.145 . . . . 0.0 113.202 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.05 155.41 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 128.538 2.735 . . . . 0.0 115.203 -172.343 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m -88.4 -10.52 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 O-C-N 120.571 -1.33 . . . . 0.0 111.164 157.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.06 40.26 0.7 Allowed Glycine 0 CA--C 1.537 1.449 0 C-N-CA 128.593 2.996 . . . . 0.0 117.174 -164.278 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.06 -138.03 0.22 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.533 2.333 . . . . 0.0 111.33 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -51.92 121.91 7.46 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 124.957 1.303 . . . . 0.0 113.194 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 47.75 23.28 0.42 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.062 2.545 . . . . 0.0 114.562 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.28 77.3 p 44.63 27.99 0.29 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.807 2.443 . . . . 0.0 114.906 -166.635 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -145.67 -13.33 0.5 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -171.27 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.315 1.7 t 97.29 -64.45 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.222 0 N-CA-C 118.987 2.958 . . . . 0.0 118.987 173.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.95 159.63 37.71 Favored 'Trans proline' 0 C--N 1.353 0.786 0 CA-C-N 122.983 2.101 . . . . 0.0 114.532 -162.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -61.66 144.9 53.8 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.369 1.468 . . . . 0.0 113.588 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -140.5 151.67 44.99 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 126.69 1.996 . . . . 0.0 110.602 169.342 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 28.7 p90 -64.7 151.8 44.08 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -124.66 23.85 7.94 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.163 1.785 . . . . 0.0 113.164 -174.803 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -71.8 -19.11 62.04 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.376 1.47 . . . . 0.0 114.873 -171.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.452 HG22 ' H ' ' A' ' 67' ' ' CYS . 1.9 p -144.23 133.72 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 126.277 1.831 . . . . 0.0 109.674 177.767 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -94.77 -4.29 47.56 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.986 0.915 . . . . 0.0 113.36 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.452 ' H ' HG22 ' A' ' 65' ' ' VAL . 78.0 m -112.58 1.15 15.69 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.663 1.585 . . . . 0.0 114.879 -166.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.263 11.0 t 55.7 -46.72 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 129.292 3.037 . . . . 0.0 118.266 -171.462 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 pp -90.92 -18.04 25.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.958 1.703 . . . . 0.0 114.23 -176.124 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.05 166.63 23.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.153 0.981 . . . . 0.0 112.265 177.423 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.18 150.34 43.85 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.487 -0.758 . . . . 0.0 111.921 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.2 p -74.92 28.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 128.461 2.705 . . . . 0.0 116.064 -176.784 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -122.09 156.35 33.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.508 1.923 . . . . 0.0 110.48 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -65.26 116.42 6.58 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.728 0.811 . . . . 0.0 110.87 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 49.6 p-80 -137.71 2.82 2.45 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.131 1.772 . . . . 0.0 112.861 -174.472 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.7 m -81.28 34.61 0.37 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.029 1.731 . . . . 0.0 115.568 -156.719 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -54.15 139.16 36.31 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.274 1.43 . . . . 0.0 112.224 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 45.92 45.98 12.09 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.905 1.282 . . . . 0.0 113.522 -170.119 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.7 mtm180 58.26 38.75 26.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.374 1.87 . . . . 0.0 113.45 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.7 t 60.57 123.11 0.02 OUTLIER Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 129.085 2.954 . . . . 0.0 113.394 -165.176 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -76.34 -25.01 10.26 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.222 1.948 . . . . 0.0 113.249 -176.249 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.3 m -85.28 -5.58 59.31 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.362 1.616 . . . . 0.0 115.362 -167.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.2 tt -71.59 149.38 9.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 123.658 0.783 . . . . 0.0 112.35 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 42.8 p90 -78.86 169.53 18.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.431 1.493 . . . . 0.0 114.568 -173.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 32.3 ttm-85 -58.61 145.36 39.89 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.911 2.085 . . . . 0.0 113.063 -175.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.31 169.97 8.43 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.351 1.461 . . . . 0.0 113.193 -178.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -61.38 -26.93 68.16 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -174.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ILE . . . . . 0.52 HD13 ' H ' ' A' ' 88' ' ' ILE . 0.1 OUTLIER -72.22 -7.38 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 173.959 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 97.0 mt -123.43 5.13 9.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.548 1.939 . . . . 0.0 113.579 -178.3 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.8 p -73.99 -29.21 25.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 119.476 1.035 . . . . 0.0 113.777 -172.398 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 25.9 t0 49.07 55.16 9.73 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 126.203 1.801 . . . . 0.0 114.676 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -133.0 144.12 49.89 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.01 1.324 . . . . 0.0 112.247 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -78.65 136.19 37.4 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.519 1.128 . . . . 0.0 111.88 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -103.42 157.72 16.84 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.634 1.173 . . . . 0.0 113.229 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -78.3 128.56 33.88 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.27 1.028 . . . . 0.0 111.024 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -133.82 -0.93 3.09 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -176.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -88.07 147.91 41.78 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.522 1.129 . . . . 0.0 112.15 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.88 155.03 51.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.399 2.733 . . . . 0.0 114.204 175.545 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -149.65 -172.8 4.24 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.251 1.82 . . . . 0.0 111.07 177.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.5 p -53.05 144.32 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.068 1.347 . . . . 0.0 112.886 177.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.63 159.73 82.56 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.352 1.061 . . . . 0.0 112.51 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -59.42 -23.01 68.6 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.575 2.85 . . . . 0.0 115.064 177.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -123.53 126.74 47.24 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.531 1.532 . . . . 0.0 110.244 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 34.4 p80 -148.2 27.89 0.93 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.53 1.132 . . . . 0.0 113.268 -174.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.6 t -122.48 170.32 10.1 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.704 1.201 . . . . 0.0 113.752 -173.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 81.3 mt -125.34 136.46 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 127.556 2.343 . . . . 0.0 110.161 -171.85 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -96.44 -48.39 5.59 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.219 1.008 . . . . 0.0 112.844 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 43.5 t -89.02 109.9 20.68 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.967 0.907 . . . . 0.0 111.174 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -70.63 -22.69 62.5 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.103 0.961 . . . . 0.0 113.538 -178.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -83.0 -19.62 36.65 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -171.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 31.5 p -150.08 10.12 0.69 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.07 3.71 85.21 Favored Glycine 0 CA--C 1.537 1.443 0 O-C-N 121.033 -1.042 . . . . 0.0 115.199 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -81.4 -159.76 23.95 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.758 1.171 . . . . 0.0 113.874 176.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.36 169.07 25.56 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 112.272 176.259 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 70.31 22.3 77.53 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 117.055 1.582 . . . . 0.0 117.055 158.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' HIS . . . . . 0.414 ' C ' ' H ' ' A' ' 118' ' ' GLY . 1.7 p80 -138.81 -165.45 1.83 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.845 1.323 . . . . 0.0 112.145 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -66.04 30.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.259 1.823 . . . . 0.0 113.998 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -53.42 -25.75 28.04 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 128.232 2.825 . . . . 0.0 114.869 -178.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.9 -40.24 94.75 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.298 1.839 . . . . 0.0 113.533 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -111.61 -15.35 13.49 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.056 1.742 . . . . 0.0 113.027 -172.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 1.6 p -62.7 155.36 26.64 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.809 0.814 . . . . 0.0 112.698 178.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -70.26 155.41 40.7 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.01 0.924 . . . . 0.0 112.894 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -74.93 129.09 37.05 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 122.126 -0.359 . . . . 0.0 110.452 168.602 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 49.4 tttp . . . . . 0 C--O 1.253 1.237 0 C-N-CA 126.883 2.073 . . . . 0.0 113.296 -178.654 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.2 mtmt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 110.737 -0.097 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -89.24 156.8 18.53 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.201 1.0 . . . . 0.0 113.531 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.57 136.36 36.06 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.628 1.171 . . . . 0.0 110.982 172.033 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.73 -48.31 93.82 Favored Pre-proline 0 CA--C 1.551 1.017 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 170.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -41.47 0.54 Allowed 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.63 2.22 . . . . 0.0 113.988 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? 59.01 -54.03 0.05 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 128.778 2.831 . . . . 0.0 116.122 -171.115 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 167.95 28.94 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.828 2.451 . . . . 0.0 111.703 175.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -74.48 -34.03 63.0 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -153.89 -47.32 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.966 1.306 . . . . 0.0 112.879 -175.508 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.9 p -79.06 -164.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.284 1.034 . . . . 0.0 111.96 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 t -139.15 29.26 2.25 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -162.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -94.83 156.33 16.41 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.966 1.306 . . . . 0.0 111.512 175.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -76.29 161.25 28.9 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.17 1.788 . . . . 0.0 112.49 178.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.22 -11.73 41.96 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.652 1.821 . . . . 0.0 117.652 162.156 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.253 0.6 OUTLIER -134.82 72.6 1.46 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.591 1.696 . . . . 0.0 111.744 173.95 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.75 177.9 0.1 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.129 2.172 . . . . 0.0 113.858 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.24 -68.84 0.06 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 127.184 2.194 . . . . 0.0 115.271 -173.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -75.5 -18.54 59.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -92.09 -21.97 20.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.837 1.655 . . . . 0.0 113.114 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.1 t -56.97 -43.66 99.49 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.58 1.552 . . . . 0.0 114.934 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -66.83 -11.29 31.48 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 122.519 2.146 . . . . 0.0 117.044 -168.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -60.86 -19.16 59.55 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -176.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.6 tt -70.0 -19.37 22.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 126.223 1.809 . . . . 0.0 113.829 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mt -104.85 129.62 57.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.421 1.888 . . . . 0.0 109.414 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 p -75.95 133.44 40.47 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.416 -0.803 . . . . 0.0 110.375 168.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 p -57.71 120.61 8.67 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.658 1.583 . . . . 0.0 113.774 -164.798 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 55.3 -13.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.358 2.663 . . . . 0.0 116.984 -171.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -87.63 46.34 1.37 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 110.941 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.23 159.73 10.24 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 120.594 -1.316 . . . . 0.0 114.864 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.58 134.14 53.05 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.034 1.333 . . . . 0.0 109.524 163.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.7 t -66.77 -9.54 37.94 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -162.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -104.08 -10.27 18.14 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.278 1.431 . . . . 0.0 114.519 172.602 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.94 -17.91 8.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.043 1.737 . . . . 0.0 113.682 -174.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -87.47 145.07 26.42 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.833 1.653 . . . . 0.0 112.922 -173.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -150.66 155.43 39.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.504 1.522 . . . . 0.0 109.855 174.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.1 p -61.43 -30.26 70.46 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -173.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.6 mtp-105 -82.79 -28.65 30.15 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.145 1.378 . . . . 0.0 112.915 171.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -85.94 -9.35 57.03 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.314 1.446 . . . . 0.0 113.448 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.5 t -17.51 -61.87 0.04 OUTLIER Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 130.558 3.543 . . . . 0.0 117.3 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -63.57 -21.76 70.54 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.757 2.305 . . . . 0.0 115.982 -174.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -83.93 112.1 19.85 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.803 1.183 . . . . 0.0 110.165 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.77 -155.8 0.66 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.838 1.255 . . . . 0.0 112.331 -159.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.5 87.29 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 124.709 1.204 . . . . 0.0 109.511 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -128.38 160.37 32.45 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.181 1.792 . . . . 0.0 113.154 -171.66 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.62 -4.11 35.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.379 2.271 . . . . 0.0 113.63 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 48.2 m 64.66 -28.75 0.1 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 128.102 2.561 . . . . 0.0 117.471 -171.782 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -124.45 3.84 8.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.155 1.782 . . . . 0.0 113.71 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.3 t -154.44 47.3 0.58 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.896 1.278 . . . . 0.0 111.031 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 49.39 -159.11 0.06 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.864 1.266 . . . . 0.0 114.203 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' H ' ' A' ' 52' ' ' GLY . 21.0 tt0 -48.17 140.17 7.59 Favored 'General case' 0 CA--C 1.552 1.054 0 O-C-N 120.018 -1.677 . . . . 0.0 113.193 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.4 m -63.73 -23.21 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 119.742 -1.849 . . . . 0.0 111.507 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLY . . . . . 0.463 ' H ' ' HG2' ' A' ' 50' ' ' GLU . . . -81.13 -13.94 80.02 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.962 1.744 . . . . 0.0 116.294 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -79.86 -17.7 52.55 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.098 1.949 . . . . 0.0 115.152 -168.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -131.74 144.16 50.77 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.904 1.282 . . . . 0.0 110.922 169.263 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -58.84 152.8 18.43 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.392 1.477 . . . . 0.0 112.395 -173.128 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.7 m 58.91 40.81 22.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 113.175 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.275 18.7 pt20 48.14 49.16 17.82 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.809 2.044 . . . . 0.0 114.454 -175.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 73.7 m 63.18 148.75 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 128.362 2.665 . . . . 0.0 115.762 -170.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -70.66 162.42 42.58 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.376 2.717 . . . . 0.0 112.659 174.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -141.99 143.06 33.01 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.012 1.325 . . . . 0.0 111.934 176.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -147.46 142.39 26.93 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.416 1.886 . . . . 0.0 110.841 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 58.1 p-90 -134.76 -4.34 2.52 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.3 tttp -127.03 147.49 50.14 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.423 1.489 . . . . 0.0 111.939 -171.678 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -69.49 -35.55 75.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.864 1.266 . . . . 0.0 113.163 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.2 p -106.75 145.32 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.976 1.71 . . . . 0.0 110.688 174.422 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 8.5 tm0? -84.03 24.62 0.9 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.039 1.336 . . . . 0.0 113.298 -173.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.8 m -137.05 154.36 50.38 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.783 1.633 . . . . 0.0 110.701 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -70.5 -177.37 1.47 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 122.098 -0.376 . . . . 0.0 110.588 149.643 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.305 2.9 pp 55.25 9.92 0.39 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.865 2.466 . . . . 0.0 116.805 173.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 46.7 m -116.43 164.21 14.89 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.577 1.551 . . . . 0.0 114.022 -171.401 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 59.78 1.55 0.31 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.989 2.916 . . . . 0.0 118.353 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.0 p -72.67 -32.71 66.02 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.124 0.969 . . . . 0.0 112.137 156.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -139.25 -179.03 5.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.011 2.925 . . . . 0.0 110.23 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -54.97 148.44 13.51 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.424 1.49 . . . . 0.0 113.107 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -85.11 114.83 22.53 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.96 0.904 . . . . 0.0 111.882 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.9 m -77.25 78.04 3.78 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.443 1.497 . . . . 0.0 112.759 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -57.15 -28.27 62.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.336 1.455 . . . . 0.0 114.1 -174.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.06 -9.91 59.76 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -131.72 -31.28 1.56 Allowed 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -169.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 49.8 t -79.14 -46.17 1.69 Allowed Pre-proline 0 CA--C 1.55 0.952 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -65.46 -34.01 44.72 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 122.287 1.991 . . . . 0.0 114.649 -175.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.1 p -148.78 138.83 22.24 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.002 1.321 . . . . 0.0 111.024 -176.707 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.2 tt -140.5 131.28 29.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.622 1.569 . . . . 0.0 111.141 -176.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 17.9 m0 49.78 31.46 4.5 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.661 1.984 . . . . 0.0 115.148 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -82.99 125.69 31.7 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.784 1.634 . . . . 0.0 110.495 177.933 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.96 146.95 24.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.665 0.786 . . . . 0.0 112.884 -177.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -119.33 32.99 5.82 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.974 1.71 . . . . 0.0 111.814 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 pp -69.56 162.13 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.884 1.274 . . . . 0.0 113.434 -176.095 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.6 mt -108.29 151.66 25.67 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.279 1.432 . . . . 0.0 111.738 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.6 p -137.97 39.4 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 127.423 2.289 . . . . 0.0 109.231 171.129 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -121.66 103.47 8.92 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.797 1.639 . . . . 0.0 109.722 -162.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -132.15 163.79 27.74 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.427 1.491 . . . . 0.0 113.603 -164.603 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -102.23 14.23 32.53 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -170.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -67.53 122.41 17.94 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.421 -1.424 . . . . 0.0 111.243 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -83.02 -26.92 30.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 57.64 -19.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 128.68 2.792 . . . . 0.0 118.295 -179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 46.4 71.69 1.49 Allowed Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 128.256 2.623 . . . . 0.0 113.587 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -63.6 150.4 88.58 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.284 1.99 . . . . 0.0 110.929 168.436 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -131.16 154.29 48.51 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.38 1.472 . . . . 0.0 111.735 -176.08 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.5 m -110.86 13.35 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.889 1.676 . . . . 0.0 112.906 176.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.5 tp -66.96 -30.95 3.5 Favored Pre-proline 0 CA--C 1.553 1.058 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 172.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -58.94 162.1 14.15 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 122.862 2.375 . . . . 0.0 113.779 171.268 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -63.54 153.55 35.33 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 27.4 m80 -75.46 1.19 14.69 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 116.435 2.013 . . . . 0.0 116.435 -158.486 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.5 p -98.92 -7.36 27.23 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.755 1.622 . . . . 0.0 114.776 -173.623 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 36.1 pt -110.99 137.94 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 124.952 1.301 . . . . 0.0 112.206 178.36 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -159.12 129.65 5.91 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.765 1.226 . . . . 0.0 112.418 -176.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 p -92.03 159.69 15.59 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.35 1.06 . . . . 0.0 113.799 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -130.14 -41.42 1.27 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.621 1.168 . . . . 0.0 113.317 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -79.74 4.19 17.05 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.736 1.214 . . . . 0.0 113.524 175.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 36.0 t -139.01 145.54 39.79 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.091 2.157 . . . . 0.0 108.785 168.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.25 164.64 40.47 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.559 1.076 . . . . 0.0 115.191 -175.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.5 -13.29 23.09 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.35 1.452 . . . . 0.0 116.269 174.565 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . 0.278 64.4 pttt 45.92 31.41 1.08 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 127.804 2.442 . . . . 0.0 116.411 172.863 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.26 -17.07 19.02 Favored Glycine 0 CA--C 1.537 1.443 0 N-CA-C 117.095 1.598 . . . . 0.0 117.095 -168.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 56.0 p-80 -151.53 156.19 40.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.211 1.505 . . . . 0.0 114.508 -166.159 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 19.3 t80 46.71 33.67 2.2 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.269 2.227 . . . . 0.0 115.33 166.803 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.74 -14.54 30.03 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.653 1.597 . . . . 0.0 116.73 -166.7 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.95 -34.49 78.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.575 1.15 . . . . 0.0 113.523 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -141.79 -11.21 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -172.208 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 46.5 t -61.98 116.57 5.01 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.017 -1.052 . . . . 0.0 113.374 -174.445 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -147.51 144.82 28.83 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 128.637 2.775 . . . . 0.0 109.352 178.823 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -102.14 142.6 33.14 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.62 0.768 . . . . 0.0 111.455 166.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 89.1 mttt . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.245 1.818 . . . . 0.0 112.858 179.427 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -85.29 50.09 1.88 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.401 1.48 . . . . 0.0 113.791 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.28 116.24 7.11 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.113 0.965 . . . . 0.0 112.597 -175.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -72.92 -54.63 4.48 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.134 0.974 . . . . 0.0 112.798 172.088 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -80.42 -27.71 3.3 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.0 2.466 . . . . 0.0 114.132 178.119 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 tptt 57.61 -67.92 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.31 2.644 . . . . 0.0 115.524 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 36.0 t -166.17 154.88 11.08 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 129.145 2.978 . . . . 0.0 108.675 177.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -67.32 -55.28 14.51 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.85 -1.156 . . . . 0.0 112.747 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -121.13 -58.59 1.79 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.835 0.854 . . . . 0.0 113.056 -168.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.5 p -86.81 -159.05 0.47 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.896 1.279 . . . . 0.0 111.194 172.502 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 61.4 m -149.9 169.37 21.29 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.606 1.162 . . . . 0.0 113.646 -174.952 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 61.55 27.11 16.68 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.184 1.793 . . . . 0.0 115.418 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.8 mtp85 -120.3 6.02 10.7 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.343 1.457 . . . . 0.0 114.837 -177.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.51 -33.69 0.98 Allowed Glycine 0 CA--C 1.536 1.377 0 C-N-CA 125.44 1.495 . . . . 0.0 115.71 175.227 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -71.13 96.29 1.34 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.387 1.094 . . . . 0.0 112.263 175.063 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.03 179.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 127.186 2.195 . . . . 0.0 113.404 169.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.2 -64.37 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.506 1.522 . . . . 0.0 114.077 -169.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.95 -1.8 41.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.81 1.644 . . . . 0.0 115.29 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -94.53 -26.89 16.23 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.101 1.361 . . . . 0.0 111.166 172.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.5 t -62.81 149.73 88.95 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 125.555 1.542 . . . . 0.0 110.958 173.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -68.21 149.23 75.97 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.748 2.299 . . . . 0.0 115.888 -161.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -111.91 0.36 16.08 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.439 1.496 . . . . 0.0 114.457 -178.196 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm -82.76 -6.97 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 124.637 1.175 . . . . 0.0 112.135 -175.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.5 mm -62.53 136.14 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 125.776 1.631 . . . . 0.0 110.334 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.4 p -69.06 -43.38 74.73 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.178 -0.951 . . . . 0.0 113.562 -173.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.7 p -159.72 171.15 20.05 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 128.808 2.843 . . . . 0.0 108.851 162.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -76.34 37.74 0.17 Allowed 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -173.586 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.5 p -99.15 -31.54 11.7 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.144 2.177 . . . . 0.0 112.706 167.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 174.41 170.84 38.09 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 115.392 0.917 . . . . 0.0 115.392 -177.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.52 106.92 3.62 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 67.3 -150.09 0.18 Allowed 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 114.577 -1.192 . . . . 0.0 113.496 135.565 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -92.57 1.49 57.23 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.419 -1.426 . . . . 0.0 113.182 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -86.64 -31.31 21.18 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -173.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.86 157.13 24.5 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.814 0.846 . . . . 0.0 112.351 171.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -115.83 179.21 4.04 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.167 1.387 . . . . 0.0 111.409 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.7 m -69.44 16.67 0.05 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.283 2.233 . . . . 0.0 116.111 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -125.75 -3.47 7.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.962 2.105 . . . . 0.0 113.156 166.713 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.01 4.7 3.81 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.491 2.316 . . . . 0.0 113.324 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.0 t -47.75 -48.32 60.51 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 125.06 1.344 . . . . 0.0 113.012 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -85.02 80.35 2.14 Favored 'Trans proline' 0 CA--C 1.55 1.317 0 C-N-CA 123.296 2.664 . . . . 0.0 112.512 167.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -151.99 153.39 33.96 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.04 1.336 . . . . 0.0 112.401 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.24 -31.64 0.1 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.159 2.584 . . . . 0.0 117.202 -175.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 16.2 mm -112.78 55.52 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 126.143 1.777 . . . . 0.0 109.527 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . 0.432 ' HA ' ' C ' ' A' ' 50' ' ' GLU . 5.5 pm0 -140.91 148.29 40.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.525 1.13 . . . . 0.0 112.246 174.143 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 29.7 p -86.98 167.39 14.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.092 0.957 . . . . 0.0 111.718 170.299 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.9 t -58.66 133.7 56.13 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt 55.47 19.15 3.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.819 2.048 . . . . 0.0 114.441 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.4 m -130.14 178.51 6.51 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.473 1.909 . . . . 0.0 112.522 -175.655 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -111.65 -15.91 13.35 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -166.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.432 ' C ' ' HA ' ' A' ' 44' ' ' GLN . 47.4 mt-10 -134.19 167.32 20.89 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.766 2.027 . . . . 0.0 108.996 173.019 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.6 -11.3 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.408 -1.432 . . . . 0.0 113.99 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.93 140.18 3.04 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 127.153 2.311 . . . . 0.0 109.936 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -125.73 -3.96 7.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.763 1.625 . . . . 0.0 112.525 -176.485 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -134.53 141.9 46.84 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 126.546 1.938 . . . . 0.0 108.884 163.9 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.68 47.52 2.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.037 1.735 . . . . 0.0 112.855 178.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 m 64.16 -30.52 0.11 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -139.12 -4.26 1.53 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.826 1.651 . . . . 0.0 114.071 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.292 18.1 p 36.74 49.52 1.31 Allowed Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 128.789 2.836 . . . . 0.0 116.914 -172.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -70.37 145.88 54.86 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.649 2.233 . . . . 0.0 112.192 -178.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -81.23 -13.6 58.37 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 166.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -72.82 160.73 31.7 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.504 1.122 . . . . 0.0 111.194 170.205 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 20.9 t-105 -71.77 150.62 44.23 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.334 0.587 . . . . 0.0 112.433 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -108.08 3.85 24.36 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.401 1.481 . . . . 0.0 114.235 -159.278 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -144.77 159.75 42.36 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.076 2.15 . . . . 0.0 110.095 173.275 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.9 p -93.84 133.11 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.938 0.895 . . . . 0.0 111.164 174.778 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -72.4 -17.82 61.77 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' CYS . . . . . 0.405 ' C ' ' H ' ' A' ' 69' ' ' LEU . 77.0 m -87.11 -28.95 22.2 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 58.1 -36.28 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 127.482 2.313 . . . . 0.0 116.081 -151.19 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 67' ' ' CYS . 29.3 tp -70.55 -15.68 62.8 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 129.907 3.283 . . . . 0.0 114.12 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.7 t -107.03 156.77 18.39 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.625 1.17 . . . . 0.0 112.587 -170.529 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -115.52 1.03 13.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.681 1.592 . . . . 0.0 114.418 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.7 t -87.34 147.97 25.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -111.17 2.07 17.6 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.532 2.333 . . . . 0.0 115.115 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -112.75 -8.33 13.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.543 1.937 . . . . 0.0 113.599 -172.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -78.09 165.3 24.16 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -165.284 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.3 t -69.59 145.66 52.36 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.9 -22.71 65.95 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 127.265 2.226 . . . . 0.0 114.965 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -77.25 33.76 0.16 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 125.117 1.367 . . . . 0.0 112.519 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 46.19 47.47 13.26 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.485 2.314 . . . . 0.0 112.815 -165.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 27.6 p 33.75 66.45 1.29 Allowed Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 127.707 2.403 . . . . 0.0 116.204 168.262 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -70.15 -29.21 22.34 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.82 2.346 . . . . 0.0 114.181 -172.256 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 57.8 p -113.12 -0.85 14.56 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.454 1.902 . . . . 0.0 114.714 -170.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.9 tp -61.05 -28.04 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 O-C-N 121.189 -0.944 . . . . 0.0 112.124 -177.243 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 13.3 t90 -78.1 13.96 1.3 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.439 1.496 . . . . 0.0 114.034 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 89.3 mmt-85 -125.34 1.79 7.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.852 2.061 . . . . 0.0 113.214 165.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.53 -9.26 59.27 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.1 p90 -67.73 -16.49 64.16 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 -176.029 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.8 tt -80.17 -11.52 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.865 0 C-N-CA 124.663 1.185 . . . . 0.0 114.104 -176.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -86.24 9.28 18.13 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.67 1.188 . . . . 0.0 114.096 -177.439 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.3 p -106.69 -8.33 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 -167.495 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -131.83 157.28 44.31 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.167 1.387 . . . . 0.0 113.771 -176.316 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -124.2 -22.88 4.65 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 -163.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -143.8 159.54 42.33 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.452 1.501 . . . . 0.0 112.004 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.36 -5.88 6.53 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -174.002 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -138.56 159.67 41.51 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.824 1.25 . . . . 0.0 113.591 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.75 165.08 30.72 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.946 1.699 . . . . 0.0 111.529 175.393 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.58 146.59 42.4 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.243 1.417 . . . . 0.0 112.273 172.614 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -64.5 160.59 38.85 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.262 2.642 . . . . 0.0 114.023 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -134.78 157.16 47.45 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.186 1.794 . . . . 0.0 111.477 173.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.6 m -90.28 -10.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 124.918 1.287 . . . . 0.0 114.301 -177.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.9 tp -73.33 -35.15 2.56 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -61.8 148.69 92.53 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.031 2.487 . . . . 0.0 114.578 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 24.7 p90 -82.04 -20.82 37.53 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 46.9 56.64 6.46 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.444 1.897 . . . . 0.0 115.37 164.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 13.8 t -138.97 43.63 2.06 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 123.913 1.816 . . . . 0.0 112.606 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.9 pt -100.63 -2.92 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 115.052 1.501 . . . . 0.0 115.052 -165.737 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -153.48 151.99 30.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.969 0.908 . . . . 0.0 112.969 -172.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 57.3 m -82.99 8.59 12.29 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.455 1.502 . . . . 0.0 114.822 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 63.42 -26.91 0.07 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 118.132 2.642 . . . . 0.0 118.132 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -133.16 -12.04 2.85 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -176.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 28.4 p -151.26 172.27 16.12 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.348 0.976 . . . . 0.0 112.915 -173.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -62.31 161.29 30.38 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 124.203 0.906 . . . . 0.0 113.695 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.29 172.07 39.58 Favored Glycine 0 CA--C 1.537 1.425 0 CA-C-O 121.677 0.598 . . . . 0.0 112.797 -165.085 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -125.58 -20.84 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -165.831 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -171.43 22.18 0.08 OUTLIER Glycine 0 CA--C 1.535 1.337 0 N-CA-C 117.538 1.775 . . . . 0.0 117.538 -175.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -66.97 -51.0 60.53 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 120.183 1.991 . . . . 0.0 112.459 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -135.29 30.52 3.25 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.395 2.278 . . . . 0.0 108.716 161.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -16.25 22.99 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 127.18 2.324 . . . . 0.0 115.258 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -63.26 -37.27 86.6 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.459 1.504 . . . . 0.0 113.542 171.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -141.97 -4.16 1.07 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -166.354 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.7 p -72.95 31.68 0.07 Allowed 'General case' 0 CA--C 1.555 1.15 0 O-C-N 120.329 -1.482 . . . . 0.0 114.922 176.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 37.8 tttm -60.65 156.3 17.0 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.313 2.645 . . . . 0.0 111.588 169.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.62 160.73 24.8 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 169.932 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.56 1.544 . . . . 0.0 114.532 -179.332 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.7 tppt? . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 119.473 -0.298 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 56.19 31.19 17.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 126.451 1.901 . . . . 0.0 115.579 172.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -81.16 100.56 9.15 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.144 -0.973 . . . . 0.0 111.525 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.66 -50.54 71.47 Favored Pre-proline 0 CA--C 1.552 1.027 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 175.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.43 -44.35 0.12 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.023 1.815 . . . . 0.0 113.773 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? 61.48 -55.09 0.11 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 128.047 2.539 . . . . 0.0 114.612 -167.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -153.8 159.83 42.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.656 2.782 . . . . 0.0 111.359 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -76.3 -53.17 8.6 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.614 -0.679 . . . . 0.0 109.945 157.682 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -134.84 161.54 34.91 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.632 1.973 . . . . 0.0 110.207 176.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . 0.318 14.6 p 47.02 -159.39 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 126.397 1.879 . . . . 0.0 112.967 -161.461 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -145.43 28.96 1.17 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -163.219 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -91.29 145.62 24.5 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.287 1.035 . . . . 0.0 112.357 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.19 -28.79 66.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -165.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -81.81 -13.65 79.26 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 116.169 1.227 . . . . 0.0 116.169 -164.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -142.65 81.85 1.75 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.642 1.221 . . . . 0.0 113.437 -169.771 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.12 -178.33 0.16 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.224 1.41 . . . . 0.0 113.211 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.63 -68.81 0.11 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 126.495 1.918 . . . . 0.0 114.81 -166.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -68.9 -20.63 64.25 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -91.7 -24.53 19.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.746 1.618 . . . . 0.0 113.103 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.7 t -57.06 -43.99 99.58 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.657 1.583 . . . . 0.0 114.83 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -92.55 -5.79 3.24 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.554 2.169 . . . . 0.0 115.454 -174.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -131.8 155.72 47.27 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.608 1.095 . . . . 0.0 113.821 -168.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.2 pp -92.04 -14.68 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.37 1.068 . . . . 0.0 113.406 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 12.4 pt -83.98 142.34 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.041 1.336 . . . . 0.0 112.774 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.37 101.99 12.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.215 1.006 . . . . 0.0 110.2 171.716 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m 44.39 49.72 8.07 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.232 1.813 . . . . 0.0 115.681 170.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.9 t80 57.85 32.72 22.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.976 1.71 . . . . 0.0 115.255 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 52.8 t -66.61 -19.73 65.84 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.191 1.396 . . . . 0.0 112.791 170.236 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -166.58 -171.09 32.3 Favored Glycine 0 CA--C 1.531 1.09 0 O-C-N 120.695 -1.253 . . . . 0.0 114.688 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -88.41 127.92 35.51 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.419 1.087 . . . . 0.0 111.98 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -58.15 -22.54 51.62 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -83.78 -11.47 57.04 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -141.18 -1.32 1.37 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -169.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -83.97 142.8 30.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.82 -1.175 . . . . 0.0 113.345 -175.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -156.45 159.48 38.7 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.074 1.349 . . . . 0.0 111.116 175.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.1 m -60.47 -29.96 69.38 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -169.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.93 4.47 34.76 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 173.2 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -108.44 -19.05 13.59 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.886 1.674 . . . . 0.0 112.941 176.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 m -14.35 -65.55 0.03 OUTLIER Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 130.198 3.399 . . . . 0.0 117.191 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -67.63 -17.44 48.05 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.927 2.418 . . . . 0.0 115.802 -171.516 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -100.53 53.43 0.87 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.468 1.507 . . . . 0.0 112.143 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -134.42 -107.67 0.23 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.954 1.302 . . . . 0.0 112.253 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.262 33.4 mt -96.54 22.5 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 125.37 1.468 . . . . 0.0 110.736 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -133.5 153.79 51.35 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.318 -1.489 . . . . 0.0 112.031 165.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 19.7 p -102.17 169.32 8.8 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 112.125 174.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.3 m -59.63 143.33 50.79 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt 58.63 11.02 1.6 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.351 1.86 . . . . 0.0 114.716 -173.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 73.0 m -138.79 174.72 10.23 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.915 1.686 . . . . 0.0 112.843 -170.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -114.5 5.04 15.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.413 1.485 . . . . 0.0 114.088 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -153.2 150.51 29.09 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.472 1.509 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.8 m -77.75 13.64 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.666 -1.271 . . . . 0.0 111.858 168.539 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.72 -136.29 0.13 Allowed Glycine 0 CA--C 1.531 1.062 0 C-N-CA 127.833 2.635 . . . . 0.0 114.359 -172.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 57.0 -147.38 0.53 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.095 0.958 . . . . 0.0 111.532 -173.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.9 p90 -93.37 176.49 6.37 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.805 1.242 . . . . 0.0 113.764 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -23.36 134.13 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 130.618 3.567 . . . . 0.0 116.133 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.1 m 55.59 47.52 20.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.657 1.583 . . . . 0.0 113.918 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.255 14.4 pt20 50.39 43.86 26.79 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.725 2.01 . . . . 0.0 114.593 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 59.32 170.19 0.07 OUTLIER Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 127.527 2.331 . . . . 0.0 115.267 -171.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -58.5 123.91 14.65 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.048 2.499 . . . . 0.0 113.865 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -101.52 24.07 10.22 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.206 1.802 . . . . 0.0 111.781 171.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.8 mtpt -136.1 160.33 38.98 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 128.117 2.567 . . . . 0.0 110.842 -176.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.5 m-90 -67.81 142.71 56.09 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.083 0.953 . . . . 0.0 112.168 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.7 tptt -83.85 131.9 34.84 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.764 0.826 . . . . 0.0 112.983 -171.631 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -123.75 142.93 50.63 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 127.142 2.177 . . . . 0.0 109.431 163.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 p -83.23 138.01 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.521 0.728 . . . . 0.0 112.67 -172.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.1 pm0 -108.83 -2.41 18.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.476 1.91 . . . . 0.0 114.372 -173.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 57.1 m -77.31 -5.17 48.51 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -163.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.284 10.9 t 59.34 -39.47 0.07 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 129.034 2.934 . . . . 0.0 118.211 -174.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -81.35 -1.96 47.39 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.575 -1.328 . . . . 0.0 113.558 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.3 m -107.84 177.84 4.7 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.719 1.608 . . . . 0.0 111.994 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.9 tptt 68.5 138.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.867 2.067 . . . . 0.0 111.32 -156.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 t 54.95 -171.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.34 -143.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 62.7 mttm 60.91 -8.94 0.07 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 129.047 2.939 . . . . 0.0 116.301 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 83.0 tttt 57.81 111.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 128.302 2.641 . . . . 0.0 112.508 -161.736 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -76.45 148.73 37.05 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.6 p -133.59 113.95 12.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.916 1.686 . . . . 0.0 110.891 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -66.9 140.05 57.76 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.116 -0.99 . . . . 0.0 111.419 -175.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 60.22 10.18 2.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 126.903 2.081 . . . . 0.0 116.115 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtm180 -130.43 -50.18 1.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.289 1.436 . . . . 0.0 113.14 -175.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 85.0 m 60.29 144.15 0.06 OUTLIER Pre-proline 0 CA--C 1.554 1.125 0 C-N-CA 128.538 2.735 . . . . 0.0 114.468 -170.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.41 -26.46 17.09 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.923 2.415 . . . . 0.0 114.055 -174.055 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.4 m -85.9 -0.5 55.56 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 115.52 1.674 . . . . 0.0 115.52 -168.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.9 pt -133.05 165.63 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 125.564 1.546 . . . . 0.0 112.005 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 9.1 m-90 -121.39 157.62 30.09 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.971 1.308 . . . . 0.0 112.933 -170.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 86.2 mtt-85 -135.6 159.02 42.92 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.473 1.909 . . . . 0.0 112.479 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . 58.47 6.03 0.52 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 118.972 2.953 . . . . 0.0 118.972 160.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 54.0 p90 -71.88 134.28 45.95 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.806 1.185 . . . . 0.0 112.429 -178.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.8 pt -132.13 -1.6 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 125.496 1.519 . . . . 0.0 113.45 177.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 tt -87.07 111.02 20.49 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.804 1.242 . . . . 0.0 108.979 176.048 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.7 m -124.31 5.91 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -170.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -70.35 -21.34 62.9 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 121.283 -0.885 . . . . 0.0 113.315 176.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -117.5 143.77 45.73 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.907 1.683 . . . . 0.0 111.038 171.023 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -142.9 154.79 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.276 1.43 . . . . 0.0 111.642 -177.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -136.92 143.69 43.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.258 1.823 . . . . 0.0 111.164 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -132.85 157.9 43.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.881 1.672 . . . . 0.0 112.327 176.302 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.76 -177.75 2.9 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.196 0.999 . . . . 0.0 112.145 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -57.29 150.83 40.48 Favored Pre-proline 0 N--CA 1.478 0.936 0 C-N-CA 124.011 0.924 . . . . 0.0 111.192 171.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 149.37 88.21 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.355 2.703 . . . . 0.0 113.348 -173.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -69.79 160.62 31.39 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -170.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.2 t -121.72 151.88 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.023 2.129 . . . . 0.0 108.506 169.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 99.1 mt -57.28 142.1 76.27 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 123.803 0.841 . . . . 0.0 112.607 -174.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -77.27 -15.16 16.16 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.302 2.668 . . . . 0.0 113.606 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -109.31 150.66 27.66 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.22 1.408 . . . . 0.0 112.019 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -86.53 155.65 20.4 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.219 1.008 . . . . 0.0 113.548 -173.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 97.2 m -90.88 143.61 26.55 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.813 1.245 . . . . 0.0 111.791 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 89.9 mt -76.28 137.85 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 125.203 1.401 . . . . 0.0 110.737 178.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 46.8 p90 -110.87 146.94 35.61 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.409 1.484 . . . . 0.0 112.635 -178.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.8 t -128.77 11.45 6.15 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.263 1.425 . . . . 0.0 114.056 -173.459 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -63.56 -16.11 59.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 -166.259 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -63.91 -20.12 65.62 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.181 1.392 . . . . 0.0 114.545 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.1 p -107.63 8.13 28.95 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.638 1.575 . . . . 0.0 113.819 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.51 131.83 1.94 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 126.017 1.77 . . . . 0.0 112.284 -166.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.85 112.99 0.26 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.25 1.405 . . . . 0.0 113.232 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -69.84 -9.3 54.26 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -174.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 179.96 124.08 0.87 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.801 1.191 . . . . 0.0 111.638 170.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -144.16 -46.15 0.26 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.614 0.766 . . . . 0.0 113.045 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -130.3 37.31 3.89 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.23 1.812 . . . . 0.0 109.266 165.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.44 -17.9 27.55 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 126.815 2.15 . . . . 0.0 115.077 -170.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.62 -34.56 67.38 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.497 1.519 . . . . 0.0 113.455 171.096 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -129.07 -25.26 2.78 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.722 1.609 . . . . 0.0 113.675 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 7.8 t -75.45 -11.15 59.98 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.619 1.168 . . . . 0.0 113.699 -177.404 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -65.25 148.24 52.03 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.798 1.239 . . . . 0.0 112.874 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.1 mp0 -63.75 155.48 30.06 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.914 1.286 . . . . 0.0 113.107 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 C--O 1.254 1.326 0 C-N-CA 126.05 1.74 . . . . 0.0 111.715 176.904 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 86.0 tttt . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 119.548 -0.263 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -115.3 151.12 35.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.391 1.476 . . . . 0.0 111.16 174.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.61 107.74 19.07 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -168.411 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.36 -51.5 13.13 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 123.957 0.903 . . . . 0.0 112.783 165.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.64 -29.95 2.65 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.811 2.34 . . . . 0.0 114.328 178.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 58.76 -63.78 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.438 2.695 . . . . 0.0 115.962 -175.335 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -158.11 164.34 36.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 128.07 2.548 . . . . 0.0 110.302 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -68.28 -31.42 70.86 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.997 -1.064 . . . . 0.0 113.171 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.79 -51.02 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.653 1.581 . . . . 0.0 112.466 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 p -91.11 63.07 4.99 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.64 1.576 . . . . 0.0 113.387 -172.16 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.6 m -35.92 89.46 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.665 3.586 . . . . 0.0 117.387 -172.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -137.67 143.09 41.17 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.998 2.119 . . . . 0.0 108.68 164.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -74.39 158.25 34.24 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -169.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.25 -23.54 23.87 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 125.567 1.556 . . . . 0.0 115.145 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.264 13.9 p-80 -123.9 78.16 1.6 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 123.235 1.493 . . . . 0.0 111.756 173.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.63 -179.54 0.38 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.613 1.965 . . . . 0.0 113.472 174.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.47 -66.55 0.19 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.967 2.107 . . . . 0.0 114.512 -174.073 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -74.76 -16.49 60.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -94.78 -14.14 24.97 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.374 1.47 . . . . 0.0 113.203 -177.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -64.0 143.54 98.21 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 124.409 1.084 . . . . 0.0 111.607 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -75.28 173.77 13.94 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.862 2.375 . . . . 0.0 115.591 -164.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -63.89 152.66 39.17 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.082 0.953 . . . . 0.0 113.092 175.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.7 tt -71.36 -36.98 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.025 1.33 . . . . 0.0 114.208 -174.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.6 mt 56.04 -74.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 127.642 2.377 . . . . 0.0 112.708 -172.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 38.9 t -156.03 78.71 0.97 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.28 2.632 . . . . 0.0 106.955 172.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m 49.75 51.51 16.38 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 8.8 t80 61.51 42.94 10.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.065 2.146 . . . . 0.0 113.908 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -102.54 172.63 6.75 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.122 1.369 . . . . 0.0 112.374 169.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.93 -171.64 38.33 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.829 1.491 . . . . 0.0 116.829 158.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -123.86 5.82 8.72 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.585 1.554 . . . . 0.0 112.684 174.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.303 5.0 t 53.88 154.71 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.716 2.006 . . . . 0.0 115.133 -150.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.1 t70 59.21 -52.58 0.06 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 129.984 3.314 . . . . 0.0 115.085 -168.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -94.98 67.1 3.08 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.231 2.212 . . . . 0.0 111.021 176.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -147.85 138.66 23.25 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.739 1.615 . . . . 0.0 110.646 177.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -150.75 157.42 42.92 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.928 1.291 . . . . 0.0 110.394 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' SER . . . . . 0.442 ' HA ' ' SG ' ' A' ' 39' ' ' CYS . 72.2 p -60.18 -22.04 62.45 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.455 1.902 . . . . 0.0 115.031 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -72.6 -25.93 61.51 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.932 1.293 . . . . 0.0 112.724 173.299 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -112.95 -34.15 5.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.959 1.303 . . . . 0.0 114.435 -169.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 36' ' ' SER 0.335 64.6 m 36.07 -101.69 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.163 0 C-N-CA 128.354 2.662 . . . . 0.0 116.485 172.856 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -76.48 -17.33 16.47 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.14 1.893 . . . . 0.0 115.124 -165.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.44 -1.83 14.54 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -162.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -20.81 53.55 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.421 1.488 . . . . 0.0 114.659 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.67 64.01 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.476 1.51 . . . . 0.0 109.199 -169.656 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -170.11 163.72 9.19 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.867 2.067 . . . . 0.0 111.041 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 81.3 m -131.5 173.41 11.13 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.644 1.577 . . . . 0.0 110.282 168.359 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -78.95 -42.52 26.66 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.009 1.724 . . . . 0.0 114.054 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.44 -27.78 22.51 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.876 1.27 . . . . 0.0 112.493 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 6.6 p -129.59 124.4 33.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.166 1.386 . . . . 0.0 110.995 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -84.39 149.69 25.84 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.226 1.41 . . . . 0.0 114.107 -168.264 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 62.32 9.8 3.5 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.4 m -134.82 137.29 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.851 1.26 . . . . 0.0 113.437 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.71 160.64 26.63 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.82 1.2 . . . . 0.0 112.474 170.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -75.08 81.05 2.25 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -174.444 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -136.31 160.3 39.14 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 127.48 2.312 . . . . 0.0 110.872 170.392 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 146.21 36.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.118 0.485 . . . . 0.0 110.256 169.129 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 21.2 m 61.67 -2.5 0.26 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -171.233 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -102.25 -53.51 2.9 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.383 1.073 . . . . 0.0 111.184 170.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.4 m -105.97 10.0 0.07 OUTLIER Pre-proline 0 CA--C 1.558 1.278 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -52.92 -22.56 18.6 Favored 'Trans proline' 0 CA--C 1.545 1.072 0 CA-C-N 124.66 2.7 . . . . 0.0 116.673 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -79.45 -3.99 49.1 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -46.73 -42.93 17.51 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 126.718 2.007 . . . . 0.0 114.448 -172.349 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -74.92 -11.43 60.12 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 116.58 2.067 . . . . 0.0 116.58 -162.091 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -87.53 -11.26 49.33 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 -173.451 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -110.5 112.13 23.83 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.363 1.465 . . . . 0.0 110.842 -178.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.9 t -104.41 128.48 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.501 1.52 . . . . 0.0 109.821 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -96.36 4.88 51.94 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.016 1.726 . . . . 0.0 113.13 -171.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 85.3 m -85.18 -16.21 41.1 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.256 7.1 t 56.8 -46.66 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 129.35 3.06 . . . . 0.0 117.809 -168.339 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -85.07 -22.62 28.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.455 1.502 . . . . 0.0 113.186 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 58.1 m -82.97 131.09 35.2 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.801 0.841 . . . . 0.0 110.799 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -115.19 2.01 13.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 83.8 p -78.94 169.68 17.84 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.441 1.496 . . . . 0.0 113.43 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -95.71 8.96 41.98 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.497 1.519 . . . . 0.0 114.425 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.05 -148.32 0.38 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.077 2.151 . . . . 0.0 109.783 177.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 44.8 t60 58.01 -123.39 1.49 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.025 1.33 . . . . 0.0 113.292 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t 59.32 -47.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.95 2.5 . . . . 0.0 115.936 -159.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.4 tptp 51.65 40.33 27.05 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.978 2.511 . . . . 0.0 113.86 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 57.08 61.31 2.62 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.958 1.303 . . . . 0.0 113.222 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 61.0 56.08 2.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.192 2.197 . . . . 0.0 114.593 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t 51.9 54.65 14.56 Favored Pre-proline 0 CA--C 1.556 1.193 0 C-N-CA 126.529 1.932 . . . . 0.0 115.816 164.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -71.07 167.31 26.47 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.604 2.869 . . . . 0.0 112.377 176.681 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.7 m -84.22 119.33 24.91 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.8 0.84 . . . . 0.0 111.26 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.6 tt -141.91 139.48 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 128.091 2.556 . . . . 0.0 109.944 -6.226 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -89.92 137.54 32.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.636 0.774 . . . . 0.0 111.936 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -148.76 140.94 23.99 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.851 1.66 . . . . 0.0 111.018 178.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -135.24 158.25 44.83 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.723 1.609 . . . . 0.0 110.401 170.441 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -138.0 147.89 44.64 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.227 1.011 . . . . 0.0 112.798 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 38.3 pt -136.2 144.6 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 126.034 1.733 . . . . 0.0 111.45 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.7 tp -152.67 141.4 20.97 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.583 1.553 . . . . 0.0 110.321 176.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 26.0 t -134.43 141.65 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.362 1.465 . . . . 0.0 110.159 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -70.26 143.13 52.22 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.157 0.983 . . . . 0.0 112.761 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -75.82 -43.78 44.3 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.345 1.058 . . . . 0.0 113.819 -175.285 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.7 t30 61.09 6.66 1.32 Allowed 'General case' 0 CA--C 1.56 1.356 0 N-CA-C 118.008 2.596 . . . . 0.0 118.008 175.436 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -131.44 -23.22 2.39 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -176.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 85.7 mttt 66.12 149.53 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 130.041 3.336 . . . . 0.0 115.634 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -88.82 156.65 18.82 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.413 1.085 . . . . 0.0 113.11 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -150.98 152.67 31.98 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.487 1.915 . . . . 0.0 111.83 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.87 -15.06 12.14 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.35 2.7 . . . . 0.0 114.358 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt 60.53 -5.52 0.1 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.093 2.557 . . . . 0.0 116.688 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 20.2 m -133.72 145.63 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 127.045 2.138 . . . . 0.0 109.86 166.422 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -147.6 99.78 3.81 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 123.815 0.846 . . . . 0.0 112.233 -173.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -65.74 148.06 86.34 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.495 2.797 . . . . 0.0 112.295 167.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -136.59 -15.12 1.63 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -129.88 139.87 51.08 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.768 1.627 . . . . 0.0 109.39 168.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 p -126.33 -5.17 6.63 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.378 1.471 . . . . 0.0 114.285 -165.557 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.407 HG23 ' H ' ' A' ' 118' ' ' GLY . 19.5 tt -140.14 142.79 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.648 1.579 . . . . 0.0 110.783 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -123.51 115.58 21.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.161 1.384 . . . . 0.0 110.831 -166.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 25.1 p -96.44 67.41 2.47 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -166.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -40.26 -37.16 0.61 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 127.984 2.514 . . . . 0.0 116.31 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -92.81 -12.5 31.01 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -166.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 12.1 p -131.28 179.33 6.09 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.331 1.052 . . . . 0.0 113.245 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -58.84 154.22 28.21 Favored Glycine 0 CA--C 1.538 1.523 0 C-N-CA 124.155 0.883 . . . . 0.0 114.054 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.57 -36.15 1.82 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 125.096 1.332 . . . . 0.0 114.701 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt 45.88 48.56 12.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.571 2.348 . . . . 0.0 113.69 171.396 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 174.0 17.5 0.02 OUTLIER Glycine 0 CA--C 1.536 1.385 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 -174.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -141.13 144.31 34.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.54 1.67 . . . . 0.0 113.106 -176.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 35.08 40.55 0.06 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 128.202 2.601 . . . . 0.0 116.571 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 118' ' ' GLY . . . . . 0.407 ' H ' HG23 ' A' ' 106' ' ' ILE . . . -58.23 -19.9 41.23 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 116.225 1.25 . . . . 0.0 116.225 -165.04 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -78.63 -44.18 24.5 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.097 1.359 . . . . 0.0 113.438 173.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -103.43 -20.75 13.95 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.898 1.679 . . . . 0.0 113.883 -165.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 15.9 p -74.38 -1.12 19.56 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.742 1.217 . . . . 0.0 114.243 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -68.45 155.07 40.6 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.451 1.5 . . . . 0.0 111.79 174.704 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -107.16 151.06 25.9 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.354 1.062 . . . . 0.0 112.4 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.389 1.476 . . . . 0.0 112.362 176.166 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 N--CA 1.486 1.336 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -103.04 -23.58 13.68 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.025 0.93 . . . . 0.0 113.466 -170.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.01 45.22 0.99 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.98 1.312 . . . . 0.0 112.993 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.8 -47.24 62.76 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.436 1.094 . . . . 0.0 113.553 164.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -77.88 -31.44 3.13 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.667 2.245 . . . . 0.0 114.033 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 59.83 -65.99 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 128.278 2.631 . . . . 0.0 114.488 -169.029 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -160.68 170.15 21.39 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 128.078 2.551 . . . . 0.0 110.746 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -73.82 -31.98 63.5 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.808 -1.183 . . . . 0.0 114.15 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -157.58 -58.72 0.08 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.768 1.227 . . . . 0.0 112.201 -177.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.1 p -77.3 130.7 37.53 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.468 0.707 . . . . 0.0 111.657 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.4 m -81.15 42.37 0.65 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.632 1.716 . . . . 0.0 115.632 -165.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -95.22 150.89 19.73 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.954 1.702 . . . . 0.0 111.45 176.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 ptm85 -76.01 171.56 14.24 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 113.871 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.8 -78.72 1.98 Allowed Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.839 1.209 . . . . 0.0 112.692 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -79.93 85.9 5.51 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.592 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -54.69 176.71 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.047 1.739 . . . . 0.0 113.669 168.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.58 -66.19 0.21 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.945 2.098 . . . . 0.0 114.444 -174.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -78.07 -5.46 51.56 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -89.94 -37.4 14.4 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.127 1.371 . . . . 0.0 111.939 175.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.8 t -56.13 -47.58 98.55 Favored Pre-proline 0 CA--C 1.549 0.914 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.89 5.41 3.47 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.294 1.996 . . . . 0.0 115.473 -164.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -60.41 -26.78 66.95 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.851 -1.156 . . . . 0.0 113.556 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.6 pp -115.32 13.2 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -175.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.88 148.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 125.204 1.402 . . . . 0.0 110.757 172.55 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.8 m -68.54 158.58 33.59 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.64 -0.662 . . . . 0.0 112.033 163.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -67.19 105.29 1.67 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.26 1.024 . . . . 0.0 112.492 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.5 t80 61.15 5.2 1.0 Allowed 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 117.999 2.592 . . . . 0.0 117.999 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 20.3 p -106.1 1.14 26.06 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -150.41 154.35 25.59 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.43 1.014 . . . . 0.0 114.937 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -113.44 20.44 16.07 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.887 1.675 . . . . 0.0 113.896 -174.601 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.277 2.8 t 60.44 -29.46 0.05 Allowed 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 129.608 3.163 . . . . 0.0 118.036 174.327 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.22 -24.81 27.69 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.506 1.522 . . . . 0.0 113.796 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -132.39 5.67 4.08 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.954 1.302 . . . . 0.0 114.049 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -89.86 148.5 23.13 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.139 -0.975 . . . . 0.0 113.383 -171.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -147.46 132.51 18.24 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.117 0.967 . . . . 0.0 111.725 170.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.9 m -58.7 -26.04 63.49 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.161 1.784 . . . . 0.0 114.677 -173.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -70.7 -21.32 62.58 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.068 1.347 . . . . 0.0 113.744 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -125.14 -19.8 5.05 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.809 1.244 . . . . 0.0 114.313 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.383 63.3 m 47.77 -106.92 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 127.822 2.449 . . . . 0.0 115.602 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -62.33 102.41 0.27 Allowed 'Trans proline' 0 C--N 1.356 0.962 0 CA-C-N 123.503 2.287 . . . . 0.0 113.771 -164.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -135.67 -15.37 1.84 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.662 1.985 . . . . 0.0 113.181 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -133.52 177.52 7.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.891 1.676 . . . . 0.0 111.409 -178.077 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 76.6 mt 65.1 -76.25 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 127.219 2.208 . . . . 0.0 111.687 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -59.54 162.82 4.63 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.643 0.777 . . . . 0.0 112.519 162.774 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 7.8 t -109.08 123.9 49.9 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.332 1.053 . . . . 0.0 109.284 163.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m 41.91 37.55 0.83 Allowed 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 165.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt 55.08 26.17 7.88 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.95 2.5 . . . . 0.0 115.221 -175.452 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.7 p -81.32 -61.73 1.86 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.154 0.888 . . . . 0.0 111.687 170.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -153.68 168.79 25.08 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.301 1.84 . . . . 0.0 111.329 172.631 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -56.61 4.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 130.89 3.676 . . . . 0.0 117.337 -175.554 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 m -164.82 -30.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.859 1 C-N-CA 132.04 4.136 . . . . 0.0 108.807 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.49 -157.95 19.37 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 127.181 2.324 . . . . 0.0 113.526 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.2 p-80 -75.44 64.24 1.56 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.781 2.033 . . . . 0.0 112.609 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.6 t80 49.15 -128.53 2.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.96 2.904 . . . . 0.0 112.851 178.944 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 52.47 43.63 30.8 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.854 1.661 . . . . 0.0 113.06 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.5 m 52.03 63.44 2.24 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.916 1.686 . . . . 0.0 113.836 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 58.5 41.38 22.7 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.796 1.639 . . . . 0.0 113.172 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 79.2 m 63.82 151.89 0.11 Allowed Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 129.202 3.001 . . . . 0.0 116.533 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -71.22 156.89 58.5 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 123.159 2.573 . . . . 0.0 112.83 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -76.01 -13.55 60.23 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -126.08 126.77 44.74 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.62 1.968 . . . . 0.0 109.146 171.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 50.2 t-105 -152.68 170.15 20.96 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -174.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.41 150.2 48.42 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.873 2.069 . . . . 0.0 112.126 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -63.81 165.9 7.95 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.652 1.581 . . . . 0.0 111.793 170.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m -55.25 157.44 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.677 -0.639 . . . . 0.0 111.539 164.405 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.98 -21.43 66.49 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 24.9 m -87.18 134.59 33.51 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.155 0.982 . . . . 0.0 111.697 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.2 t -63.31 -31.06 72.11 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.537 HD23 ' H ' ' A' ' 69' ' ' LEU . 2.6 pt? -104.55 18.78 21.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.889 1.676 . . . . 0.0 115.24 -172.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 61.9 m -127.98 158.96 36.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.132 1.373 . . . . 0.0 111.25 176.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -151.23 112.82 4.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.436 1.094 . . . . 0.0 110.899 169.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m 57.24 12.22 1.3 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 118.028 2.603 . . . . 0.0 118.028 168.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -141.89 152.59 43.72 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.496 1.918 . . . . 0.0 110.754 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -84.29 157.56 21.5 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.244 1.018 . . . . 0.0 112.2 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 33.8 p80 -135.81 178.78 6.78 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.095 2.158 . . . . 0.0 111.028 -172.177 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.2 t -114.7 166.33 11.86 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.779 1.232 . . . . 0.0 112.841 173.451 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -61.66 -17.88 57.25 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 127.732 2.413 . . . . 0.0 114.159 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -67.99 -25.77 65.58 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 169.047 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -92.72 -57.83 2.54 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.762 1.625 . . . . 0.0 110.873 172.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 24.2 p -160.41 154.41 19.48 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.986 1.315 . . . . 0.0 112.136 169.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -59.25 150.87 71.48 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.55 2.833 . . . . 0.0 116.175 -165.409 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 t -151.01 159.82 44.32 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.578 1.551 . . . . 0.0 110.788 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.9 pp -69.44 162.91 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 123.941 0.896 . . . . 0.0 113.368 -178.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 35.1 p90 -133.78 161.01 35.87 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.487 1.515 . . . . 0.0 112.623 -173.709 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 39.3 mmm-85 -132.24 9.61 4.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 126.122 1.769 . . . . 0.0 114.365 175.544 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . 58.72 14.65 3.29 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -174.666 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -86.0 14.32 6.34 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.733 1.613 . . . . 0.0 113.999 -173.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 47.6 mt 64.17 105.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 128.553 2.741 . . . . 0.0 113.353 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.79 158.0 22.98 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.861 1.264 . . . . 0.0 111.71 171.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 25.1 m -93.68 150.18 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.649 1.18 . . . . 0.0 112.558 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -119.29 -1.87 10.73 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.275 1.43 . . . . 0.0 113.188 175.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -83.35 141.9 31.44 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.554 1.142 . . . . 0.0 112.217 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -85.76 -14.97 43.61 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.45 55.53 3.22 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.046 1.338 . . . . 0.0 112.467 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -66.47 155.25 38.08 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.693 1.597 . . . . 0.0 113.441 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.05 164.27 30.49 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.634 1.574 . . . . 0.0 111.739 178.317 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -67.57 158.48 82.47 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 124.36 1.064 . . . . 0.0 112.199 178.664 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -64.77 -16.03 53.27 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.367 2.712 . . . . 0.0 116.659 -174.529 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.302 21.8 ptmt 52.72 -1.81 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 129.479 3.112 . . . . 0.0 118.679 179.533 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 70.0 t -83.32 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.979 1.312 . . . . 0.0 109.709 168.804 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' LEU . . . . . 0.562 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 3.2 tm? -124.06 -46.83 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.37 1.468 . . . . 0.0 114.364 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' PRO . . . . . 0.562 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 85.6 Cg_endo -73.45 158.77 47.58 Favored 'Trans proline' 0 C--N 1.355 0.906 0 CA-C-N 122.097 1.785 . . . . 0.0 113.347 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -130.06 163.22 27.01 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.671 1.588 . . . . 0.0 112.758 -175.422 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -125.95 21.17 7.57 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.889 1.676 . . . . 0.0 113.4 176.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 23.2 p -86.83 -5.67 59.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.408 1.883 . . . . 0.0 114.367 -171.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.0 tt -78.82 132.65 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.142 0.977 . . . . 0.0 111.152 174.277 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -141.36 169.49 17.51 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.196 1.398 . . . . 0.0 112.631 -176.866 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 17.6 t -71.92 158.29 36.3 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.35 1.06 . . . . 0.0 113.098 176.82 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -136.52 24.32 3.17 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.802 1.641 . . . . 0.0 112.488 172.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -139.3 167.61 21.69 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.22 1.808 . . . . 0.0 111.725 -171.485 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.285 18.6 p 47.25 23.65 0.35 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.999 2.52 . . . . 0.0 117.341 173.409 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.54 -31.64 2.01 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.707 1.622 . . . . 0.0 114.283 178.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 138.24 -161.33 25.61 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.977 1.275 . . . . 0.0 114.719 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -77.39 -176.74 4.32 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.222 1.809 . . . . 0.0 114.377 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.14 -53.53 4.87 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.153 1.358 . . . . 0.0 114.742 173.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -77.69 142.28 38.88 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.099 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 40.79 22.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 129.767 3.227 . . . . 0.0 117.877 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.25 -23.31 52.76 Favored Glycine 0 CA--C 1.536 1.353 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 -161.691 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -61.18 -44.6 97.05 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.054 1.342 . . . . 0.0 112.963 173.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -105.76 -30.73 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.259 1.824 . . . . 0.0 113.031 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 53.6 t -70.09 116.18 10.16 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.728 1.211 . . . . 0.0 110.445 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.39 158.88 43.75 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 127.399 2.28 . . . . 0.0 110.486 -176.187 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -76.0 130.14 37.96 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.706 0.402 . . . . 0.0 111.533 176.002 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LYS . . . . . 0.431 ' HA ' ' HE2' ' A' ' 124' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.328 0 C-N-CA 126.259 1.823 . . . . 0.0 111.766 -177.617 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.9 pttt . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.492 0.186 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -112.78 -6.72 13.83 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -161.927 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.16 149.39 28.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.224 1.01 . . . . 0.0 113.202 -178.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.29 -55.63 0.88 Allowed Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.304 1.041 . . . . 0.0 112.421 162.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.16 -37.03 3.68 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.949 2.432 . . . . 0.0 113.927 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.336 0.0 OUTLIER 53.12 -31.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 131.51 3.924 . . . . 0.0 118.271 -171.235 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.58 -179.79 8.53 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.488 1.915 . . . . 0.0 111.522 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -101.47 146.41 27.67 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.692 -0.63 . . . . 0.0 109.33 144.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.4 t30 59.45 -69.88 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 165.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.1 p -86.13 -15.35 41.38 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.611 1.565 . . . . 0.0 115.167 -170.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 m 55.92 30.73 16.53 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 160.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -142.62 19.79 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 175.312 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -144.59 143.08 30.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.166 1.386 . . . . 0.0 111.202 -177.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.98 -12.98 61.02 Favored Glycine 0 N--CA 1.475 1.244 0 N-CA-C 116.826 1.49 . . . . 0.0 116.826 -162.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -68.97 93.38 0.56 Allowed 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.576 1.188 . . . . 0.0 112.37 171.163 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -53.49 175.62 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.987 1.715 . . . . 0.0 113.595 172.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -62.01 0.94 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.943 1.297 . . . . 0.0 114.061 -165.463 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.48 -9.18 59.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -84.56 -31.55 24.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.075 1.35 . . . . 0.0 111.974 173.439 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.4 t -64.64 136.81 96.92 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.843 1.657 . . . . 0.0 111.073 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.69 158.46 57.11 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.797 2.998 . . . . 0.0 114.713 -170.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -132.58 170.27 15.43 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.754 2.021 . . . . 0.0 109.703 169.38 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.9 pp -62.13 150.56 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.0 mt -125.14 137.15 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 111.027 -167.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 32.8 t -61.35 109.37 1.13 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.17 1.388 . . . . 0.0 111.708 170.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.6 m 47.38 16.97 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 127.722 2.409 . . . . 0.0 116.724 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 48.45 34.18 4.58 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.98 1.312 . . . . 0.0 113.347 -168.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.7 p -96.93 -22.77 16.67 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -164.61 157.69 30.16 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.851 1.215 . . . . 0.0 112.151 177.553 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.56 121.89 14.97 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.318 1.059 . . . . 0.0 112.631 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.5 t -59.13 -26.89 65.11 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -75.27 -22.16 57.99 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -141.41 -18.25 0.79 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 -168.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 149.92 45.74 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.077 1.308 . . . . 0.0 112.85 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -147.08 167.74 23.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.589 1.556 . . . . 0.0 110.029 176.148 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.7 t -38.81 -45.64 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.986 2.115 . . . . 0.0 115.899 -172.62 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -73.59 -15.89 61.26 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -127.38 0.55 6.32 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.104 1.762 . . . . 0.0 113.539 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.8 t -40.3 -50.99 6.41 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 128.005 2.522 . . . . 0.0 115.81 -172.572 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -79.33 -2.83 12.61 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 123.192 2.595 . . . . 0.0 116.483 -176.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -128.83 11.29 6.1 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -162.008 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.27 24.14 4.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.2 mt -128.77 62.96 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 126.578 1.951 . . . . 0.0 108.742 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -145.4 150.26 36.22 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.265 -1.522 . . . . 0.0 113.99 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -76.25 168.0 20.84 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.258 1.023 . . . . 0.0 112.042 174.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 21.2 m -85.1 -18.95 32.69 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.2 tppt? -127.95 -9.01 5.46 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.043 1.337 . . . . 0.0 114.37 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 p -145.55 167.33 23.28 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.033 1.333 . . . . 0.0 111.776 174.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -76.89 132.19 38.98 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.43 -0.794 . . . . 0.0 112.566 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.63 141.85 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.836 2.454 . . . . 0.0 116.186 179.481 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.2 m -80.33 -21.41 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 O-C-N 120.451 -1.405 . . . . 0.0 110.797 157.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.92 -6.48 24.85 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.949 1.738 . . . . 0.0 116.399 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . 0.263 0.7 OUTLIER -87.64 -132.49 0.07 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.746 1.273 . . . . 0.0 113.122 172.453 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -61.6 126.42 27.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -157.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 45.85 30.84 0.93 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.647 2.379 . . . . 0.0 113.761 -175.086 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.1 p 49.8 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.805 3.642 . . . . 0.0 119.061 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -147.34 8.55 0.92 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.696 1.998 . . . . 0.0 112.982 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.8 m 58.92 27.74 0.05 OUTLIER Pre-proline 0 CA--C 1.563 1.48 0 N-CA-C 117.306 2.335 . . . . 0.0 117.306 -170.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -68.1 121.48 8.49 Favored 'Trans proline' 0 C--N 1.358 1.056 0 CA-C-N 122.922 2.079 . . . . 0.0 112.706 -178.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.0 m80 58.71 167.4 0.05 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.929 2.092 . . . . 0.0 115.122 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -71.55 -43.14 66.91 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.925 -1.109 . . . . 0.0 111.837 174.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -155.53 135.86 13.15 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.17 1.788 . . . . 0.0 110.024 175.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -152.39 41.59 0.63 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.426 1.091 . . . . 0.0 112.864 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -89.19 173.13 8.59 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.03 1.332 . . . . 0.0 112.641 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.5 p -114.27 150.78 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 126.64 1.976 . . . . 0.0 109.357 165.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 -70.26 -12.66 61.74 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.412 1.485 . . . . 0.0 113.238 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.3 m -111.8 166.83 10.85 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.22 1.408 . . . . 0.0 112.131 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 57.1 p -116.09 -3.43 12.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.894 1.677 . . . . 0.0 112.882 -158.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 pp -132.15 -3.42 3.52 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.063 2.145 . . . . 0.0 113.252 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 67.3 m -86.7 157.15 19.71 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.575 1.15 . . . . 0.0 112.191 -177.321 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptt -133.99 7.23 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.7 t -149.27 154.4 38.98 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.676 1.19 . . . . 0.0 112.138 175.675 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -83.3 -28.05 29.37 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.283 1.433 . . . . 0.0 114.454 -174.113 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -88.82 70.22 8.67 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.517 1.127 . . . . 0.0 111.942 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.9 p-80 -139.55 175.56 9.46 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.083 1.353 . . . . 0.0 112.322 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -133.49 165.34 25.1 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.691 1.597 . . . . 0.0 111.336 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -58.56 -32.61 69.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.204 1.402 . . . . 0.0 112.981 175.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -74.47 -23.06 58.83 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.646 1.178 . . . . 0.0 112.985 173.015 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -103.85 -12.24 17.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.388 1.875 . . . . 0.0 114.059 -173.798 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 46.3 m -46.77 131.66 8.5 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.346 1.458 . . . . 0.0 111.55 176.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -58.93 -29.78 91.38 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 122.713 2.275 . . . . 0.0 117.433 -163.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 64.5 m -114.7 19.28 16.11 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 125.071 1.348 . . . . 0.0 114.295 -177.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.8 tp -65.61 142.42 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 120.718 -1.239 . . . . 0.0 112.229 -177.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.6 t-105 -71.26 139.78 50.13 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.58 0.752 . . . . 0.0 112.813 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -151.57 145.89 25.45 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.432 1.893 . . . . 0.0 111.305 166.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.94 157.48 21.9 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -137.91 149.14 45.96 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.073 1.749 . . . . 0.0 111.927 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 20.7 tt -78.97 -38.36 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.509 0.724 . . . . 0.0 111.621 165.033 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 11.0 tp 52.41 27.59 5.06 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.21 2.204 . . . . 0.0 115.238 175.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 90.3 t -135.4 139.44 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 126.476 1.911 . . . . 0.0 108.751 175.251 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -143.45 165.05 28.61 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.744 1.218 . . . . 0.0 113.605 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -106.21 13.07 29.37 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.06 2.144 . . . . 0.0 114.418 -175.712 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -75.93 172.8 12.1 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.314 1.046 . . . . 0.0 111.844 176.531 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -61.84 122.74 16.17 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.349 -0.845 . . . . 0.0 111.286 176.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -146.33 147.77 31.69 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.19 1.796 . . . . 0.0 111.567 -173.708 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 53.98 -176.66 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.397 1.479 . . . . 0.0 113.773 -165.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.15 161.8 33.04 Favored Pre-proline 0 N--CA 1.476 0.838 0 C-N-CA 125.354 1.461 . . . . 0.0 112.436 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.37 -172.66 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 124.296 3.331 . . . . 0.0 113.819 168.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -66.8 9.73 0.17 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 126.84 2.056 . . . . 0.0 115.278 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t 65.12 121.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 128.891 2.877 . . . . 0.0 113.489 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -72.05 151.75 92.71 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.003 0.921 . . . . 0.0 112.623 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -64.9 128.42 20.77 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.401 2.068 . . . . 0.0 113.025 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -86.85 -29.74 21.98 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.071 0.948 . . . . 0.0 112.26 169.696 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -140.15 161.42 37.68 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.458 1.903 . . . . 0.0 110.211 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.7 p -126.12 144.25 50.81 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.19 1.396 . . . . 0.0 111.349 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.3 pp -87.6 159.18 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 123.905 0.882 . . . . 0.0 112.532 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -77.97 158.94 29.1 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.557 1.143 . . . . 0.0 113.015 -174.027 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 31.9 t -145.22 140.48 27.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.794 0.838 . . . . 0.0 112.058 171.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -138.54 -10.11 1.41 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -176.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -90.11 -44.82 9.54 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -161.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.8 p -119.06 5.11 11.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.266 1.826 . . . . 0.0 113.558 177.44 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 170.8 -172.28 44.18 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.428 1.966 . . . . 0.0 111.44 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -75.92 177.3 50.24 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 123.545 0.593 . . . . 0.0 113.341 170.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -54.27 140.19 33.81 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.378 1.471 . . . . 0.0 111.908 173.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 156.83 -9.34 0.25 Allowed Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.776 1.87 . . . . 0.0 117.776 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -137.49 -167.26 2.09 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.955 1.877 . . . . 0.0 112.942 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -69.42 45.39 0.06 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.313 1.845 . . . . 0.0 113.236 173.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -53.46 -21.14 12.64 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 128.188 2.804 . . . . 0.0 115.573 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -75.57 -44.56 42.6 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.304 1.052 . . . . 0.0 112.825 171.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -88.3 -11.42 46.5 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.511 1.524 . . . . 0.0 113.167 -177.431 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 2.1 p -69.18 1.07 3.97 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -176.308 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -54.13 140.04 33.4 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.225 1.41 . . . . 0.0 111.952 175.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -91.75 164.45 13.7 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.28 1.032 . . . . 0.0 113.382 -175.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.626 1.971 . . . . 0.0 111.215 175.969 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.583 0.23 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.8 -2.38 16.19 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.849 2.06 . . . . 0.0 113.891 174.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.52 126.53 16.36 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.263 1.025 . . . . 0.0 113.123 178.459 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -84.16 -49.18 0.66 Allowed Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 125.092 1.357 . . . . 0.0 113.19 159.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.2 -29.83 6.06 Favored 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.796 2.331 . . . . 0.0 114.857 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? 62.33 -63.45 0.1 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.968 2.507 . . . . 0.0 114.647 -172.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.4 t -156.82 172.3 18.88 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.758 2.423 . . . . 0.0 111.245 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -73.51 -39.62 64.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.13 -0.981 . . . . 0.0 113.417 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -155.97 -58.34 0.1 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.9 1.28 . . . . 0.0 113.105 -171.571 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.9 p -79.01 -9.74 59.62 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 46.62 51.76 11.77 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 159.829 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -143.84 6.12 1.38 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -175.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -150.41 157.52 43.13 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.295 1.838 . . . . 0.0 110.273 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.14 -9.52 42.1 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.267 1.267 . . . . 0.0 116.267 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -72.97 94.49 1.87 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.962 1.381 . . . . 0.0 113.098 175.514 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -54.75 175.75 0.05 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.857 2.063 . . . . 0.0 113.79 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.01 -63.66 0.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.827 2.051 . . . . 0.0 114.433 -172.389 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -82.6 -12.47 57.67 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.324 1.85 . . . . 0.0 115.382 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -83.47 -23.42 32.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.619 1.168 . . . . 0.0 111.992 171.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.9 t -61.25 -52.8 68.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 120.908 -1.12 . . . . 0.0 113.386 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.49 -179.68 5.55 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.849 2.366 . . . . 0.0 111.936 168.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -72.16 33.21 0.06 Allowed 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 126.116 1.766 . . . . 0.0 114.878 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.4 mt -109.33 160.49 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 127.774 2.43 . . . . 0.0 110.095 -173.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.4 pt -54.69 128.68 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.877 1.271 . . . . 0.0 112.623 178.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 17.3 p -78.99 -21.98 46.21 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 t -157.39 -162.63 1.23 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.125 2.17 . . . . 0.0 110.014 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.18 49.29 0.67 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.285 1.834 . . . . 0.0 112.253 174.559 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.3 p -147.85 150.51 34.3 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.636 1.974 . . . . 0.0 110.954 177.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.11 -179.12 28.75 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 124.958 1.266 . . . . 0.0 113.363 -167.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -107.3 145.95 32.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.426 1.49 . . . . 0.0 110.662 172.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.1 t -66.88 -5.28 11.82 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -114.03 -11.17 12.78 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 126.267 1.827 . . . . 0.0 114.178 170.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -157.27 105.7 2.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.532 1.533 . . . . 0.0 111.205 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -130.83 -21.34 2.74 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.514 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -64.23 -40.31 95.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.691 1.132 . . . . 0.0 112.143 173.645 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t 50.03 -152.78 0.15 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.673 1.189 . . . . 0.0 111.878 -170.727 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.8 mmp_? -80.43 -38.59 29.86 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.592 -1.318 . . . . 0.0 110.283 150.205 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -136.92 87.67 2.3 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.324 1.45 . . . . 0.0 111.784 177.601 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t 17.04 -74.1 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 129.572 3.149 . . . . 0.0 117.654 157.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -71.09 72.89 2.06 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 124.612 3.541 . . . . 0.0 112.995 177.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 tptm -134.33 -173.34 3.25 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.526 2.33 . . . . 0.0 110.958 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.09 -41.36 0.19 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 128.481 2.713 . . . . 0.0 116.956 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.1 mt -133.61 93.7 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.68 1.592 . . . . 0.0 109.285 -174.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -139.59 167.45 22.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.661 1.584 . . . . 0.0 111.86 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 94.5 m -70.34 161.49 30.32 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.292 1.044 . . . . 0.0 111.996 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.4 m -71.41 -20.78 62.08 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.158 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -134.41 2.35 3.24 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -175.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.8 p -152.37 165.95 33.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.769 1.227 . . . . 0.0 112.288 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.7 134.1 39.32 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.557 1.543 . . . . 0.0 113.807 -172.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 59.23 156.99 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 127.225 2.21 . . . . 0.0 115.296 -172.255 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.2 m -88.85 -22.76 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 120.222 -1.549 . . . . 0.0 110.196 153.747 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.83 -20.11 63.91 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 126.402 1.953 . . . . 0.0 115.512 -173.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -79.87 -14.35 58.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -169.35 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -150.77 124.4 9.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.974 0.91 . . . . 0.0 111.793 174.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 52.97 12.05 0.25 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 126.854 2.062 . . . . 0.0 115.138 -173.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.304 33.0 p 48.4 23.95 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.917 2.087 . . . . 0.0 115.183 -161.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -147.35 -36.11 0.23 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 25.4 t 42.78 65.51 5.2 Favored Pre-proline 0 CA--C 1.556 1.178 0 C-N-CA 126.548 1.939 . . . . 0.0 114.2 -178.522 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.17 150.61 72.03 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.943 2.429 . . . . 0.0 112.865 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -77.24 148.33 35.85 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.756 0.822 . . . . 0.0 111.739 172.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -91.13 157.83 16.99 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -173.085 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -144.28 -171.81 3.65 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.748 2.019 . . . . 0.0 109.376 163.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -51.51 120.77 5.46 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.418 1.087 . . . . 0.0 111.248 175.108 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -74.49 123.43 24.73 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.149 0.98 . . . . 0.0 111.236 -174.414 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.5 t -78.0 -37.56 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.757 1.223 . . . . 0.0 112.504 -169.259 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 62.6 -36.37 0.13 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 128.226 2.61 . . . . 0.0 115.809 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.5 m -78.59 -1.11 32.55 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.519 1.927 . . . . 0.0 114.902 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 15.0 t 56.36 -51.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 129.657 3.183 . . . . 0.0 118.59 -177.058 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 pp -86.37 -13.94 44.95 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.503 1.521 . . . . 0.0 113.828 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 96.7 m -79.67 168.79 18.88 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.308 1.043 . . . . 0.0 112.381 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -111.0 -30.33 7.55 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 177.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.2 p -87.27 172.89 9.54 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.388 1.475 . . . . 0.0 112.906 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 162.61 7.54 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.129 0.972 . . . . 0.0 113.376 174.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -52.82 147.05 9.51 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -173.422 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -148.19 17.34 1.07 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.564 1.545 . . . . 0.0 112.914 172.849 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.7 p -75.22 -38.77 60.5 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -152.035 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 47.89 34.78 4.24 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.657 1.583 . . . . 0.0 113.248 -169.276 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 56.73 18.04 3.51 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 126.546 1.938 . . . . 0.0 115.528 -172.448 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.3 tpt85 -125.08 -30.14 3.24 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.217 2.207 . . . . 0.0 114.136 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.8 t 49.55 66.07 6.15 Favored Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 125.543 1.537 . . . . 0.0 112.441 -166.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.02 168.99 20.31 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.392 2.728 . . . . 0.0 112.474 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.3 p -70.22 161.29 30.57 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.809 0.814 . . . . 0.0 112.662 166.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.2 tp -60.46 149.83 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.327 1.051 . . . . 0.0 111.808 176.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 73.0 t-105 -59.47 140.73 55.95 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.769 0.795 . . . . 0.0 113.025 -175.76 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 35.0 ptt85 -156.12 158.63 38.03 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.962 2.105 . . . . 0.0 111.443 -165.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.44 156.11 33.41 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -179.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -64.74 143.37 57.98 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.627 0.771 . . . . 0.0 112.336 177.461 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 31.0 mm -84.44 142.15 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 124.46 1.104 . . . . 0.0 110.545 -177.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.48 150.31 49.13 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.873 0.869 . . . . 0.0 111.918 176.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -65.21 135.91 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.456 0.703 . . . . 0.0 111.807 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -80.47 150.42 29.7 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.882 1.273 . . . . 0.0 113.419 -176.899 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -148.69 156.33 42.24 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.391 1.477 . . . . 0.0 111.442 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -110.96 157.42 19.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.23 1.812 . . . . 0.0 112.236 -174.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.92 163.87 31.19 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.592 1.557 . . . . 0.0 112.51 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 56.19 23.96 7.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.54 1.936 . . . . 0.0 114.893 176.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.41 156.9 29.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.362 1.065 . . . . 0.0 112.949 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -139.47 136.7 17.98 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 126.563 1.945 . . . . 0.0 110.57 178.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.91 143.37 54.77 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.731 2.287 . . . . 0.0 111.734 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -126.54 113.33 16.65 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.942 1.297 . . . . 0.0 110.824 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.12 19.21 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 126.391 1.876 . . . . 0.0 112.267 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.9 mt -72.56 155.76 90.79 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 125.49 1.516 . . . . 0.0 112.409 -176.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -62.13 152.9 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.062 2.508 . . . . 0.0 112.397 172.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -93.53 148.58 21.95 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.045 0.938 . . . . 0.0 112.794 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 24.2 m80 60.43 0.51 0.32 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 175.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 6.9 p -84.04 134.67 34.61 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.03 1.332 . . . . 0.0 111.296 173.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.31 18.03 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.485 1.514 . . . . 0.0 113.836 -173.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -136.57 156.16 48.94 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.383 1.473 . . . . 0.0 112.505 -175.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.4 t -124.73 12.19 8.52 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 -162.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -56.66 -35.84 68.86 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.294 -1.504 . . . . 0.0 114.084 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.05 -13.76 62.37 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -86.34 -6.43 58.95 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.985 1.714 . . . . 0.0 112.743 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 114.99 -7.64 21.56 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.313 1.911 . . . . 0.0 114.384 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 165.14 149.65 5.92 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-N 118.614 1.207 . . . . 0.0 113.89 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -65.2 -17.91 64.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.491 1.917 . . . . 0.0 114.257 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -71.86 -5.4 61.18 Favored Glycine 0 CA--C 1.538 1.482 0 N-CA-C 118.602 2.201 . . . . 0.0 118.602 -164.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -147.35 150.68 35.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.897 2.349 . . . . 0.0 115.535 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 39.16 29.44 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 129.978 3.311 . . . . 0.0 117.658 164.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.34 -11.7 35.09 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.961 1.267 . . . . 0.0 115.025 -174.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -67.86 -33.51 74.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.499 1.519 . . . . 0.0 113.92 174.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -151.39 -26.66 0.2 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -166.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 14.9 p -65.44 136.67 56.76 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 120.579 1.536 . . . . 0.0 113.535 -168.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' LYS . . . . . 0.427 ' HA ' ' HE2' ' A' ' 122' ' ' LYS . 0.7 OUTLIER -155.78 -29.23 0.1 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.007 1.323 . . . . 0.0 113.45 -176.251 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -74.94 163.56 27.5 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.895 2.078 . . . . 0.0 113.102 -179.395 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.1 tptp . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -61.81 153.23 29.32 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.966 1.706 . . . . 0.0 112.926 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -116.83 130.65 56.85 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.367 1.067 . . . . 0.0 112.804 -177.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -75.41 -51.4 3.3 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.001 0.92 . . . . 0.0 112.471 159.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -76.05 -41.39 0.51 Allowed 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.548 2.166 . . . . 0.0 114.74 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.295 0.1 OUTLIER 50.85 -33.95 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 131.343 3.857 . . . . 0.0 119.286 -171.98 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.9 t -157.79 164.49 36.97 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.416 1.886 . . . . 0.0 112.652 171.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -74.54 -40.21 61.86 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.515 1.126 . . . . 0.0 113.307 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -158.37 -31.3 0.07 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.741 1.617 . . . . 0.0 113.101 -171.343 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 m -73.21 -163.82 0.16 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.856 0.862 . . . . 0.0 110.654 169.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.1 p -135.87 155.69 49.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.893 -1.129 . . . . 0.0 112.9 170.884 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 56.51 -173.59 0.07 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.87 2.068 . . . . 0.0 114.716 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.265 9.1 ttp180 65.6 27.19 11.52 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.2 2.2 . . . . 0.0 115.659 172.48 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.48 -17.02 0.66 Allowed Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.907 1.923 . . . . 0.0 117.907 160.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -81.14 77.63 8.01 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.202 1.501 . . . . 0.0 111.142 -178.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -56.99 178.74 0.05 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 128.107 2.563 . . . . 0.0 113.693 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.21 -64.44 0.32 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.616 1.966 . . . . 0.0 114.252 -171.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -78.71 -13.97 59.54 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.083 1.753 . . . . 0.0 115.296 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.87 -14.78 31.08 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.336 1.454 . . . . 0.0 113.139 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.94 -53.91 45.12 Favored Pre-proline 0 CA--C 1.549 0.923 0 CA-C-O 118.08 -0.962 . . . . 0.0 113.018 171.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.26 154.44 41.3 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.199 1.932 . . . . 0.0 111.68 169.636 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -122.55 0.77 9.43 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ILE . . . . . 0.505 HD13 ' H ' ' A' ' 23' ' ' ILE . 0.2 OUTLIER -102.18 15.6 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.301 1.44 . . . . 0.0 114.073 -175.922 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.8 mm -107.17 134.62 48.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.645 1.578 . . . . 0.0 110.631 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.7 p -87.59 141.61 28.48 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.323 1.059 . . . . 0.0 112.272 173.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.2 p -70.17 137.5 51.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.314 1.446 . . . . 0.0 114.119 -164.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 50.66 14.29 0.17 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.121 1.768 . . . . 0.0 115.217 -169.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -150.39 29.49 0.7 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.183 0.993 . . . . 0.0 112.159 -163.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.7 153.99 24.86 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 120.297 -1.502 . . . . 0.0 114.863 -176.754 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -142.58 140.72 31.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.557 1.543 . . . . 0.0 110.101 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -21.54 64.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -171.374 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -138.84 15.0 2.68 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -138.7 -1.06 1.87 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -172.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 37.0 t-80 -106.37 150.19 26.25 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.068 1.347 . . . . 0.0 113.226 -172.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -142.37 147.21 35.88 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.158 1.383 . . . . 0.0 111.188 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.5 t -54.62 -40.95 69.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.692 1.597 . . . . 0.0 114.47 -172.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -79.13 -13.38 59.77 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -104.49 -18.21 14.46 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.218 1.407 . . . . 0.0 113.42 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' CYS . . . . . 0.503 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.288 1.2 m 24.43 -88.63 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 129.989 3.316 . . . . 0.0 116.561 172.44 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.503 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 25.0 Cg_exo -70.17 -19.95 33.54 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.284 1.851 . . . . 0.0 116.709 -158.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.03 1.91 22.36 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -174.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.52 60.59 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -175.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 mt -130.21 141.22 46.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.813 1.645 . . . . 0.0 108.854 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -147.6 161.44 41.13 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.0 t -67.04 156.91 34.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.525 1.53 . . . . 0.0 112.036 168.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.4 m -65.71 -17.72 64.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.18 1.392 . . . . 0.0 114.63 174.324 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -129.63 -2.57 4.81 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.33 1.452 . . . . 0.0 114.696 -171.468 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 31.1 p -149.27 156.01 41.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.368 1.067 . . . . 0.0 111.835 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.39 151.52 45.11 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.647 -0.658 . . . . 0.0 112.163 174.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 59.18 175.06 0.07 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.739 1.216 . . . . 0.0 113.278 -170.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.8 m -75.94 71.14 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 O-C-N 119.813 -1.805 . . . . 0.0 109.66 167.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.39 -116.29 0.09 OUTLIER Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.458 1.98 . . . . 0.0 117.132 -159.209 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -67.9 -7.92 32.4 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 117.704 2.483 . . . . 0.0 117.704 -154.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -128.93 118.67 23.04 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.475 1.034 . . . . 0.0 112.24 176.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 43.98 26.16 0.13 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.724 2.81 . . . . 0.0 116.66 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.0 m 52.66 30.25 8.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.31 1.444 . . . . 0.0 114.786 -172.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -145.02 -34.34 0.35 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.127 1.371 . . . . 0.0 113.38 -174.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 86.7 m 45.71 58.33 15.6 Favored Pre-proline 0 CA--C 1.555 1.17 0 C-N-CA 126.189 1.796 . . . . 0.0 114.813 -174.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -70.69 170.47 17.61 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.551 2.834 . . . . 0.0 113.065 175.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.8 p-80 -133.25 158.32 43.21 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.162 1.385 . . . . 0.0 112.123 172.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -86.38 140.3 30.14 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.965 1.306 . . . . 0.0 112.372 -176.753 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -74.17 158.7 33.68 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.226 1.01 . . . . 0.0 113.242 176.264 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -125.15 41.12 3.59 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 126.215 1.806 . . . . 0.0 111.739 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.9 tptt -70.9 154.16 42.06 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.639 1.176 . . . . 0.0 111.746 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.2 p -70.58 131.13 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.327 0.651 . . . . 0.0 112.044 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -103.69 6.7 37.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.285 1.434 . . . . 0.0 113.735 -173.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.4 m -74.11 -17.67 60.91 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 62.86 -47.76 0.2 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.212 2.605 . . . . 0.0 117.608 -166.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -86.36 0.07 54.8 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 91.8 m -111.37 156.28 21.83 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.866 1.266 . . . . 0.0 112.854 -178.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -114.48 160.95 18.62 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 126.027 1.731 . . . . 0.0 109.619 161.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.8 m -76.04 -20.83 57.44 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.638 1.347 . . . . 0.0 114.638 -172.323 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -66.84 134.13 51.47 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.521 0.728 . . . . 0.0 112.262 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.2 tttp 47.61 35.22 4.18 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.764 2.025 . . . . 0.0 114.221 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -82.51 131.61 35.21 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.824 0.85 . . . . 0.0 112.668 -171.227 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.8 m -94.3 110.96 22.68 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.914 0.886 . . . . 0.0 111.956 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.86 135.45 57.33 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.782 0.833 . . . . 0.0 111.578 -177.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 54.52 20.07 2.67 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.355 1.862 . . . . 0.0 115.669 -173.421 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -130.87 -40.04 1.2 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.43 1.492 . . . . 0.0 113.356 177.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.8 m 63.91 148.64 0.1 Allowed Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 128.655 2.782 . . . . 0.0 115.667 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.91 -32.69 17.48 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.057 2.505 . . . . 0.0 112.812 171.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.4 t -126.36 151.99 46.87 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.483 1.913 . . . . 0.0 111.476 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 16.8 tt -137.74 -28.47 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -174.602 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 13.6 t-105 -96.29 -19.4 19.3 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -163.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -92.36 25.54 2.93 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.542 1.537 . . . . 0.0 113.824 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -87.22 -8.29 57.0 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -173.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -82.6 -18.91 39.59 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -170.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 73.1 mt -88.35 132.5 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.603 1.161 . . . . 0.0 110.443 -178.241 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.2 mt -124.66 8.11 8.24 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.441 1.497 . . . . 0.0 113.934 -172.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 41.1 t -82.12 110.58 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 124.121 0.968 . . . . 0.0 111.562 -171.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -156.69 136.73 12.7 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.605 1.562 . . . . 0.0 111.298 172.7 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -155.05 150.22 27.01 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.115 1.366 . . . . 0.0 113.052 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -150.4 170.91 17.93 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.101 1.761 . . . . 0.0 112.087 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -97.28 141.91 29.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.387 1.075 . . . . 0.0 112.296 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -137.15 -59.2 0.7 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 125.25 1.42 . . . . 0.0 112.869 -172.358 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.66 157.04 36.02 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.973 0.909 . . . . 0.0 112.945 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 7.9 ptpp? -148.58 146.43 22.36 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.624 1.57 . . . . 0.0 112.347 -178.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 97' ' ' LYS . 31.6 Cg_exo -70.69 -33.86 12.4 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.741 2.294 . . . . 0.0 114.822 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -138.17 158.35 44.48 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.414 1.885 . . . . 0.0 111.633 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -121.05 -4.65 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.375 1.47 . . . . 0.0 113.777 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 21.2 tp -68.71 124.41 90.08 Favored Pre-proline 0 CA--C 1.551 1.01 0 O-C-N 121.183 -0.948 . . . . 0.0 110.974 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -80.64 159.42 21.98 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.84 2.36 . . . . 0.0 113.774 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -144.42 158.47 43.73 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 127.72 2.408 . . . . 0.0 109.607 173.797 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 32.6 p80 -73.1 -23.74 60.55 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -170.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.1 t -87.81 61.81 6.62 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 123.786 1.755 . . . . 0.0 113.569 -178.156 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.7 pt -72.35 11.72 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 C-N-CA 126.165 1.786 . . . . 0.0 115.172 -171.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -99.25 9.33 43.61 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 -152.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 59.05 164.11 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -172.956 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -70.87 -17.64 62.72 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -168.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -64.6 -32.09 73.59 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.159 0.89 . . . . 0.0 111.81 170.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 55.6 m -99.1 -3.64 34.15 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.393 1.877 . . . . 0.0 113.3 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.66 8.74 76.31 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.431 1.491 . . . . 0.0 115.801 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -106.94 -157.97 21.2 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 126.404 1.954 . . . . 0.0 113.606 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -140.49 150.99 44.45 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.051 2.14 . . . . 0.0 111.601 174.441 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 88.2 -152.18 23.37 Favored Glycine 0 CA--C 1.54 1.636 0 N-CA-C 116.271 1.268 . . . . 0.0 116.271 176.257 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.305 0.6 OUTLIER 47.52 -161.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 128.952 2.901 . . . . 0.0 115.661 -170.014 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -67.07 36.89 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.729 2.012 . . . . 0.0 113.736 171.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.17 -30.04 16.6 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 126.53 2.014 . . . . 0.0 113.877 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.1 -38.62 65.55 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.518 1.927 . . . . 0.0 114.189 172.45 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -97.68 -34.16 11.03 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.798 1.639 . . . . 0.0 111.798 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.3 t -71.18 -7.63 48.08 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.486 1.514 . . . . 0.0 113.839 -177.385 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.6 -8.49 57.94 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.205 1.402 . . . . 0.0 114.313 169.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -107.82 146.45 32.24 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.237 1.415 . . . . 0.0 112.455 173.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? . . . . . 0 C--O 1.253 1.265 0 C-N-CA 126.499 1.92 . . . . 0.0 111.076 174.127 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.713 0 N-CA-C 113.072 0.767 . . . . 0.0 113.072 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.68 -51.14 22.3 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 124.259 1.024 . . . . 0.0 113.289 165.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.44 -38.25 0.78 Allowed 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 122.616 2.211 . . . . 0.0 114.267 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.403 0.0 OUTLIER 49.73 -42.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 130.843 3.657 . . . . 0.0 118.537 -169.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.7 t -159.66 160.57 34.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.685 1.994 . . . . 0.0 111.693 174.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -71.01 -29.25 65.14 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 173.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -161.64 -35.67 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.9 m -76.19 -21.19 56.78 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.8 m 58.49 11.87 1.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 119.012 2.967 . . . . 0.0 119.012 171.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -133.08 -3.25 3.15 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 -175.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -126.14 160.39 30.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.383 1.473 . . . . 0.0 111.857 -172.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.01 -19.23 69.7 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.03 92.57 3.18 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -57.38 179.21 0.06 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.891 2.077 . . . . 0.0 114.049 170.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -63.8 0.53 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.489 1.916 . . . . 0.0 114.475 -170.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -79.22 -11.46 59.96 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.57 1.548 . . . . 0.0 114.887 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -81.04 -37.82 28.45 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.175 0.99 . . . . 0.0 111.475 176.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.2 t -58.34 -37.4 54.5 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo . . . . . 0 C--N 1.353 0.813 0 C-N-CA 122.777 2.318 . . . . 0.0 114.754 174.783 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm . . . . . 0 N--CA 1.479 0.978 0 CA-C-O 123.099 1.428 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.3 mm -87.88 133.87 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 127.442 2.297 . . . . 0.0 108.546 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 m -61.81 142.41 57.33 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.989 -0.444 . . . . 0.0 110.812 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 73.5 m -51.1 -30.35 15.92 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 -159.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -142.26 11.79 1.95 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 174.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 44.3 m -64.59 -48.52 74.67 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.58 -1.325 . . . . 0.0 113.03 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . 0.473 ' HA2' ' H ' ' A' ' 43' ' ' ILE . . . -165.79 178.45 40.54 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -153.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.63 138.8 47.69 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.36 1.464 . . . . 0.0 109.915 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 t -56.37 -19.24 13.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.959 1.704 . . . . 0.0 114.361 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -65.65 -19.26 65.84 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 172.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -139.23 -34.87 0.57 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.376 1.47 . . . . 0.0 114.485 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -66.51 123.97 21.5 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.144 1.778 . . . . 0.0 112.053 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -155.22 169.37 24.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.42 1.488 . . . . 0.0 110.673 -174.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -63.12 -13.15 33.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.003 1.721 . . . . 0.0 115.509 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -109.35 2.55 20.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.295 1.838 . . . . 0.0 113.652 170.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -136.55 0.71 2.52 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -172.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.3 t -37.29 -51.88 2.37 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.194 2.198 . . . . 0.0 114.93 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.87 -8.45 19.06 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.436 2.758 . . . . 0.0 116.066 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -102.1 5.99 40.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.362 1.865 . . . . 0.0 113.653 -173.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -86.81 -152.64 0.19 Allowed 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.122 1.369 . . . . 0.0 113.355 -173.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . 0.473 ' H ' ' HA2' ' A' ' 29' ' ' GLY . 95.3 mt -55.43 -40.37 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.621 1.569 . . . . 0.0 113.48 -169.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -118.74 154.33 32.96 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 24.6 p -83.29 -34.29 25.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.855 1.262 . . . . 0.0 114.031 -175.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.0 t -159.37 -155.77 0.48 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.097 1.359 . . . . 0.0 111.322 -170.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -62.79 -24.99 68.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 127.013 2.125 . . . . 0.0 112.692 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 24.4 p -89.82 155.08 19.41 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.045 1.338 . . . . 0.0 112.467 172.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -72.3 134.17 45.39 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -166.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 60.26 148.48 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 128.827 2.851 . . . . 0.0 117.006 176.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.6 m -71.8 -15.66 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 119.783 -1.823 . . . . 0.0 110.714 161.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.91 18.87 1.32 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 128.025 2.726 . . . . 0.0 116.457 -170.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.0 155.31 44.64 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.809 1.304 . . . . 0.0 112.171 174.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.9 t80 59.9 137.64 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 128.069 2.547 . . . . 0.0 115.722 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.99 148.58 20.98 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.483 1.113 . . . . 0.0 112.486 -175.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 m 57.32 32.68 22.15 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -168.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 54.96 45.88 25.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.625 1.97 . . . . 0.0 113.495 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.7 t . . . . . 0 CA--C 1.555 1.144 0 C-N-CA 126.881 2.072 . . . . 0.0 113.585 -175.875 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.5 t . . . . . 0 N--CA 1.477 0.914 0 CA-C-O 120.649 0.261 . . . . 0.0 110.985 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -69.98 -35.84 74.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.489 0.716 . . . . 0.0 112.019 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 22.2 m -76.55 156.74 32.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 123.688 1.709 . . . . 0.0 112.168 166.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 36.9 p -113.31 -15.26 12.71 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.673 2.389 . . . . 0.0 111.702 -161.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.19 -21.46 21.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.078 1.751 . . . . 0.0 111.861 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 76.0 m -99.5 -22.35 15.53 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.715 1.206 . . . . 0.0 114.222 -164.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.62 -55.48 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 129.617 3.167 . . . . 0.0 118.91 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 58.2 m -112.76 122.37 47.47 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -162.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt 56.54 -51.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.746 3.619 . . . . 0.0 119.24 168.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -80.33 151.03 29.69 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -160.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 54.84 177.68 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 119.241 3.052 . . . . 0.0 119.241 159.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 68.4 m -139.63 170.61 15.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 127.492 2.317 . . . . 0.0 111.39 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -56.87 -31.76 65.15 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -176.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -73.83 -19.31 60.78 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -102.01 -17.36 16.12 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.227 1.811 . . . . 0.0 112.97 174.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 43.8 t . . . . . 0 CA--C 1.553 1.085 0 C-N-CA 125.851 1.66 . . . . 0.0 112.471 176.216 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 . . . . . 0 CA--C 1.544 0.729 0 N-CA-C 112.432 0.53 . . . . 0.0 112.432 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -68.09 134.13 50.09 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -172.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -150.68 161.75 42.0 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.776 1.63 . . . . 0.0 111.073 -175.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -59.51 156.47 13.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.006 1.322 . . . . 0.0 113.442 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -141.22 175.36 9.71 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 112.433 -176.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? 43.89 59.49 12.45 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 127.497 2.319 . . . . 0.0 115.835 174.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -76.8 70.8 6.37 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.272 3.314 . . . . 0.0 112.62 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -137.16 161.19 36.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.302 2.641 . . . . 0.0 111.104 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 26.9 m -65.1 148.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.141 0.976 . . . . 0.0 112.487 176.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.8 mt -84.92 156.6 60.81 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.281 1.032 . . . . 0.0 112.652 -177.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.25 159.6 30.17 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.798 2.999 . . . . 0.0 114.444 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.9 p90 . . . . . 0 CA--C 1.542 0.668 0 C-N-CA 124.324 1.05 . . . . 0.0 112.931 176.929 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.6 p . . . . . 0 CA--C 1.552 1.044 0 N-CA-C 119.397 3.11 . . . . 0.0 119.397 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.3 t80 60.94 6.46 1.22 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.619 2.367 . . . . 0.0 114.847 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -106.96 -25.02 11.81 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.716 1.607 . . . . 0.0 112.168 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.2 p -145.38 18.43 1.53 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.77 1.628 . . . . 0.0 113.963 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 162.62 -133.94 3.27 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.016 1.293 . . . . 0.0 113.292 175.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.31 -159.64 1.07 Allowed Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.908 1.718 . . . . 0.0 113.014 171.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -109.65 150.71 27.86 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.46 1.63 . . . . 0.0 112.941 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 154.57 -103.46 0.24 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 115.265 0.866 . . . . 0.0 115.265 -177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -70.67 151.31 45.07 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 -153.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 45.89 28.14 0.56 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.409 2.283 . . . . 0.0 116.835 164.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.21 -16.47 34.29 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.725 1.155 . . . . 0.0 115.669 -170.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.43 -33.64 76.0 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.754 1.621 . . . . 0.0 113.958 173.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -138.6 -21.14 1.02 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.951 1.301 . . . . 0.0 114.367 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.6 t . . . . . 0 CA--C 1.55 0.944 0 C-N-CA 125.524 1.53 . . . . 0.0 111.135 172.522 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.839 0 N-CA-C 113.36 0.874 . . . . 0.0 113.36 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.05 61.08 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 123.993 0.917 . . . . 0.0 112.061 164.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.42 -46.02 0.23 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.551 2.167 . . . . 0.0 113.196 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.252 1.8 pttm 41.98 -165.72 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.324 1.45 . . . . 0.0 112.45 -149.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 m -56.2 155.38 6.75 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.077 -1.64 . . . . 0.0 114.442 178.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -61.18 -44.33 97.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.439 1.496 . . . . 0.0 114.636 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -157.57 -34.61 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.335 2.654 . . . . 0.0 109.974 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.9 t -55.61 168.48 0.41 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.486 1.514 . . . . 0.0 111.309 153.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.2 m -134.54 76.51 1.64 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -175.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -132.92 161.01 35.38 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.268 1.427 . . . . 0.0 110.586 162.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -78.15 -32.82 50.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.933 1.293 . . . . 0.0 112.822 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -73.76 -177.64 35.85 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 124.666 1.127 . . . . 0.0 112.81 169.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.331 0.6 OUTLIER 21.62 64.92 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 128.006 2.523 . . . . 0.0 114.85 -176.181 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.596 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.47 -178.28 0.18 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.438 1.895 . . . . 0.0 114.103 -174.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -22.72 -69.98 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 127.782 2.433 . . . . 0.0 115.068 -174.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -77.06 -14.29 59.84 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.059 1.744 . . . . 0.0 115.645 -178.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.33 -26.34 16.61 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.567 1.947 . . . . 0.0 113.219 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -56.94 -46.7 99.84 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.057 1.343 . . . . 0.0 114.437 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo . . . . . 0 CA--C 1.543 0.972 0 C-N-CA 122.892 2.395 . . . . 0.0 113.822 178.847 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.5 mt . . . . . 0 N--CA 1.474 0.765 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.0 mt -118.98 58.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.426 1.49 . . . . 0.0 109.585 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.5 m 49.3 50.92 17.26 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.702 1.601 . . . . 0.0 113.541 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.1 m 56.51 46.52 20.44 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.709 1.204 . . . . 0.0 113.667 -173.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 12.1 t80 56.64 56.01 5.91 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.574 1.95 . . . . 0.0 113.558 -177.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 p -72.04 -30.09 64.83 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.052 -1.03 . . . . 0.0 112.48 173.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -177.69 -159.44 22.62 Favored Glycine 0 CA--C 1.53 0.986 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 -169.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.16 174.22 10.36 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.364 1.066 . . . . 0.0 111.613 173.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.2 t -110.12 -18.87 13.23 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -177.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -97.04 -39.2 9.45 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.862 -1.149 . . . . 0.0 113.829 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -85.86 11.73 10.66 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.766 1.227 . . . . 0.0 112.433 169.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -70.99 126.44 29.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.668 1.987 . . . . 0.0 112.681 -174.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -152.0 150.59 30.15 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.66 1.184 . . . . 0.0 111.031 171.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.1 m -61.35 -27.43 68.5 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.593 1.557 . . . . 0.0 114.616 -171.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -75.67 -29.96 59.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.797 1.239 . . . . 0.0 113.149 174.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.2 m170 -101.47 -28.39 12.59 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -170.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.3 m -5.03 -75.22 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 129.833 3.253 . . . . 0.0 117.7 -174.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -76.87 -12.76 17.87 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.12 2.546 . . . . 0.0 115.574 -172.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -92.52 33.03 1.14 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.478 1.911 . . . . 0.0 113.02 -172.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -110.51 -38.16 5.28 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -163.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 58.6 mt -128.19 126.73 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.87 0.868 . . . . 0.0 111.681 -167.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.89 158.09 43.95 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 127.135 2.174 . . . . 0.0 110.113 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.1 t -75.96 143.64 41.45 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.453 0.701 . . . . 0.0 110.96 173.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.1 p -61.13 -37.4 82.69 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.929 1.292 . . . . 0.0 114.034 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -122.14 -7.7 8.81 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.742 1.617 . . . . 0.0 114.619 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 39.7 m -117.03 8.04 13.27 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 61.65 0.6 0.5 Allowed 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 119.119 3.007 . . . . 0.0 119.119 166.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -141.64 148.5 39.26 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 120.78 1.627 . . . . 0.0 112.73 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.292 11.2 m 53.55 -9.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 1 N-CA-C 121.847 4.017 . . . . 0.0 121.847 164.229 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 117.02 -177.22 16.59 Favored Glycine 0 N--CA 1.48 1.567 0 CA-C-N 121.136 1.789 . . . . 0.0 114.308 171.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -117.98 0.04 11.78 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 115.779 1.77 . . . . 0.0 115.779 -170.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -83.44 153.32 24.54 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.581 -1.324 . . . . 0.0 111.908 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -60.65 -24.85 65.89 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -167.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -80.48 -12.4 59.55 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -132.79 -19.02 2.35 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -172.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 13.4 t . . . . . 0 CA--C 1.548 0.88 0 CA-C-N 119.992 1.269 . . . . 0.0 112.021 179.051 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 N--CA 1.484 1.256 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 61.92 6.62 1.74 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 126.865 2.066 . . . . 0.0 115.753 177.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 71.0 m -88.37 0.8 55.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.594 1.158 . . . . 0.0 113.702 173.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.281 6.3 t 57.29 -42.94 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 129.452 3.101 . . . . 0.0 117.768 -169.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -101.35 7.9 42.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 178.224 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 71.9 m -112.26 147.4 36.34 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.186 0.994 . . . . 0.0 112.229 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -106.92 178.9 4.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.913 1.685 . . . . 0.0 110.371 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.1 p -66.29 -29.48 69.7 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -80.79 160.03 24.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.273 1.429 . . . . 0.0 112.77 171.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . 0.265 22.5 pttp 49.52 30.29 3.39 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.962 2.505 . . . . 0.0 116.202 174.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -109.16 120.17 41.74 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.076 0.95 . . . . 0.0 112.529 -174.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.3 m -144.05 139.85 29.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.229 1.412 . . . . 0.0 111.78 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.64 -38.93 89.5 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.121 0.968 . . . . 0.0 112.871 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -80.98 -10.03 59.77 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.365 1.066 . . . . 0.0 113.775 179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -108.49 -24.58 11.34 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.429 1.491 . . . . 0.0 113.716 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.9 t . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 125.139 1.376 . . . . 0.0 114.383 179.818 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.8 t70 . . . . . 0 CA--C 1.549 0.924 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.41 14.54 4.83 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 129.039 2.936 . . . . 0.0 115.494 176.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -137.61 152.42 49.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.096 1.758 . . . . 0.0 111.726 176.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -134.88 4.13 3.26 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.583 1.553 . . . . 0.0 114.75 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.21 154.44 23.37 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.028 1.331 . . . . 0.0 112.411 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -79.25 161.65 66.99 Favored Pre-proline 0 N--CA 1.476 0.836 0 C-N-CA 124.604 1.162 . . . . 0.0 112.665 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.46 162.98 19.0 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.312 2.675 . . . . 0.0 114.173 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -118.3 155.18 31.07 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.164 1.786 . . . . 0.0 111.172 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.2 t -128.17 138.03 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 125.145 1.378 . . . . 0.0 110.743 -176.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.598 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 60.5 tp -126.33 -49.26 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.743 1.617 . . . . 0.0 113.686 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.598 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 90.7 Cg_endo -73.15 162.36 40.89 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.064 1.842 . . . . 0.0 112.629 176.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 59.7 t80 . . . . . 0 CA--C 1.54 0.582 0 C-N-CA 125.206 1.402 . . . . 0.0 111.721 -179.919 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 40.4 t . . . . . 0 CA--C 1.541 0.614 0 CA-C-O 121.27 0.557 . . . . 0.0 110.526 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -69.85 -37.34 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -169.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -100.02 -33.77 10.36 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 68.4 m -95.05 -11.71 27.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -161.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 75.65 -20.64 2.19 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.056 1.312 . . . . 0.0 114.367 -169.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -76.15 177.56 50.37 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.2 1.381 . . . . 0.0 113.95 170.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -141.93 147.7 37.48 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.585 1.554 . . . . 0.0 111.609 -172.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.29 9.83 55.55 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 162.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.409 ' C ' ' H ' ' A' ' 118' ' ' GLY . 3.0 p80 -83.05 -154.35 0.14 Allowed 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.489 1.644 . . . . 0.0 112.103 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -65.05 25.96 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 126.572 1.949 . . . . 0.0 114.556 167.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -43.13 -29.43 0.94 Allowed Glycine 0 CA--C 1.538 1.482 0 C-N-CA 129.083 3.23 . . . . 0.0 115.044 168.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.83 -38.06 84.18 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.745 1.618 . . . . 0.0 114.08 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -102.85 -21.47 14.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.49 1.516 . . . . 0.0 112.36 176.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 24.9 t . . . . . 0 CA--C 1.554 1.116 0 C-N-CA 126.721 2.008 . . . . 0.0 111.097 169.762 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.652 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -80.95 -54.35 0.74 Allowed Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 123.824 0.849 . . . . 0.0 112.076 155.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -76.7 -48.32 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.382 2.055 . . . . 0.0 114.313 -177.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.262 7.0 pttm 42.17 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.571 1.549 . . . . 0.0 112.587 -148.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.8 m -54.13 148.74 10.56 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 119.848 -1.782 . . . . 0.0 113.8 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.416 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 56.0 t30 -60.33 -39.69 87.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.558 0.743 . . . . 0.0 112.0 174.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -136.81 -48.31 0.62 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -169.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.5 p -97.95 16.78 19.92 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -167.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.0 m 52.23 59.1 4.76 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 118.054 2.612 . . . . 0.0 118.054 164.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -129.67 164.76 23.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.897 1.279 . . . . 0.0 111.899 165.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -94.31 155.59 16.93 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.256 1.822 . . . . 0.0 111.828 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.77 -19.37 29.62 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 125.087 1.327 . . . . 0.0 115.958 170.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.279 11.8 p-80 -126.73 55.95 1.51 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 123.756 1.741 . . . . 0.0 109.925 170.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.659 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.67 -179.4 0.18 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.528 2.331 . . . . 0.0 114.808 -173.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -14.81 -71.52 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 128.788 2.835 . . . . 0.0 115.74 -177.845 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -77.01 -20.56 55.87 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -94.34 -2.97 51.26 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.217 2.207 . . . . 0.0 113.243 175.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.9 t -61.76 -41.12 75.69 Favored Pre-proline 0 CA--C 1.557 1.223 0 C-N-CA 126.491 1.917 . . . . 0.0 114.329 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo . . . . . 0 C--N 1.359 1.097 0 C-N-CA 122.542 2.161 . . . . 0.0 112.926 171.081 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.479 1.021 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.4 pt -60.42 147.23 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 119.947 1.249 . . . . 0.0 112.876 177.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.0 m -73.08 -65.09 0.85 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 m -149.2 -61.54 0.22 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.274 1.03 . . . . 0.0 112.215 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -146.55 59.16 1.21 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.72 1.608 . . . . 0.0 110.267 -178.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.4 p -151.99 168.18 26.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.976 1.711 . . . . 0.0 111.112 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 52.09 -152.93 6.16 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.792 1.663 . . . . 0.0 113.454 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.89 146.41 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.202 1.401 . . . . 0.0 108.946 164.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.1 t -60.41 -23.77 64.63 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -92.85 -11.32 33.88 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.537 1.535 . . . . 0.0 113.991 175.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -156.26 100.03 1.97 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.268 1.427 . . . . 0.0 111.622 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -150.26 143.54 25.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.008 0.923 . . . . 0.0 112.857 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -165.57 170.9 13.77 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 128.668 2.787 . . . . 0.0 108.472 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.8 m -57.36 -32.41 66.73 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.343 -1.473 . . . . 0.0 114.545 177.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -96.5 3.83 52.47 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.86 1.264 . . . . 0.0 114.288 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -116.92 0.55 12.48 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.348 1.459 . . . . 0.0 113.354 173.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -37.28 -50.64 2.41 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.253 1.421 . . . . 0.0 112.445 155.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -82.1 23.57 0.77 Allowed 'Trans proline' 0 CA--C 1.552 1.376 0 C-N-CA 124.639 3.559 . . . . 0.0 116.437 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -75.19 -84.73 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.196 -1.565 . . . . 0.0 112.643 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.22 -12.22 30.75 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -167.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.0 mt -141.46 112.9 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.756 1.622 . . . . 0.0 107.09 -169.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.271 3.8 pm0 47.48 174.1 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.891 1.676 . . . . 0.0 115.072 -159.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 59.3 m -140.48 151.63 44.98 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 127.112 2.165 . . . . 0.0 109.483 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 p -71.76 -32.11 67.34 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.258 1.423 . . . . 0.0 113.192 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -99.81 -34.14 10.28 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.052 1.741 . . . . 0.0 113.004 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 3.1 m -103.67 -1.43 28.12 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.4 t0 58.45 -155.96 0.34 Allowed 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.402 1.481 . . . . 0.0 113.19 -171.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -42.51 8.27 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 C-N-CA 134.139 4.976 . . . . 0.0 121.123 -169.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -101.75 -36.01 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.527 1.531 . . . . 0.0 114.498 -161.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.44 164.83 6.45 Favored Glycine 0 CA--C 1.541 1.672 0 C-N-CA 124.351 0.977 . . . . 0.0 114.462 -174.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -87.12 28.61 0.91 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.899 1.28 . . . . 0.0 114.078 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -65.68 154.04 40.0 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.122 -0.986 . . . . 0.0 112.126 171.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -23.68 44.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.612 1.965 . . . . 0.0 114.946 -172.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.7 m -104.37 4.18 33.17 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -119.47 -37.92 3.09 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.992 1.717 . . . . 0.0 111.847 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 91.0 m . . . . . 0 CA--C 1.55 0.946 0 C-N-CA 126.582 1.953 . . . . 0.0 110.97 169.122 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 108.197 -1.038 . . . . 0.0 108.197 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -66.19 -30.58 71.07 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.729 0.412 . . . . 0.0 111.807 -175.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.3 m -74.32 170.24 16.01 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.764 1.745 . . . . 0.0 113.109 175.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.2 p -135.16 -23.29 1.51 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 127.796 2.438 . . . . 0.0 111.209 -162.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mp -78.39 -23.78 46.64 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.373 1.869 . . . . 0.0 111.441 165.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.2 m -104.28 155.51 18.69 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.708 1.203 . . . . 0.0 113.568 -163.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -81.86 164.77 21.37 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.736 1.215 . . . . 0.0 109.904 164.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 p -73.25 41.29 0.11 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.604 2.762 . . . . 0.0 114.501 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -98.08 163.13 12.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.424 2.29 . . . . 0.0 110.983 177.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -55.31 146.35 19.54 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.081 1.352 . . . . 0.0 112.643 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -133.77 160.73 36.72 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.079 1.752 . . . . 0.0 111.167 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.7 t -100.68 146.04 27.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.055 0.942 . . . . 0.0 112.565 164.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -62.2 -40.55 96.43 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.128 1.371 . . . . 0.0 113.499 -177.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.83 -19.81 19.31 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.985 1.105 . . . . 0.0 113.985 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -124.89 -2.34 7.77 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -167.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . 0.417 21.7 t . . . . . 0 CA--C 1.556 1.208 0 CA-C-O 115.165 -2.35 . . . . 0.0 114.745 175.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 . . . . . 0 CA--C 1.547 0.83 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -131.82 132.78 44.02 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.07 1.748 . . . . 0.0 110.954 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -78.56 -30.32 46.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.998 1.319 . . . . 0.0 113.465 -178.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -108.87 157.38 18.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.409 1.483 . . . . 0.0 114.098 -171.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.28 160.61 41.78 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.952 1.701 . . . . 0.0 111.472 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -70.81 134.17 86.05 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 124.112 0.965 . . . . 0.0 111.171 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -66.76 -28.46 43.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.853 2.369 . . . . 0.0 114.748 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -150.27 161.94 41.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.449 1.9 . . . . 0.0 112.126 -173.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.2 m -89.03 -5.97 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.481 1.112 . . . . 0.0 113.588 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.07 149.07 40.88 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.451 1.101 . . . . 0.0 111.8 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -63.42 175.29 2.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.937 3.091 . . . . 0.0 114.616 172.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 . . . . . 0 CA--C 1.548 0.866 0 C-N-CA 125.382 1.473 . . . . 0.0 113.935 173.499 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t . . . . . 0 CA--C 1.551 1.016 0 CA-C-O 120.763 0.316 . . . . 0.0 111.563 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -141.0 -23.27 0.77 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.932 1.693 . . . . 0.0 114.471 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -114.36 172.94 6.71 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.899 2.08 . . . . 0.0 111.827 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.326 14.5 p 51.65 12.36 0.17 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 128.809 2.844 . . . . 0.0 118.6 170.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 163.6 -165.79 36.99 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.45 1.5 . . . . 0.0 112.942 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -72.86 149.58 43.22 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 123.938 0.78 . . . . 0.0 112.823 172.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -62.43 -15.49 49.73 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -170.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -78.9 -22.0 67.1 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 118.563 -1.132 . . . . 0.0 115.83 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -79.67 134.74 36.43 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.13 1.965 . . . . 0.0 114.761 -162.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 31.62 36.25 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 130.378 3.471 . . . . 0.0 117.388 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.76 -17.67 43.13 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.859 1.219 . . . . 0.0 115.153 -170.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -63.39 -35.24 79.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.247 1.819 . . . . 0.0 113.799 172.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -131.51 -12.38 3.47 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.822 1.649 . . . . 0.0 113.816 -170.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 26.8 t . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 124.474 1.11 . . . . 0.0 111.454 177.767 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.624 0 N-CA-C 111.882 0.327 . . . . 0.0 111.882 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.52 28.6 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 0.0 113.229 164.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.78 -39.34 0.99 Allowed 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 122.707 2.271 . . . . 0.0 114.988 -175.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? 58.37 -57.77 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 128.441 2.696 . . . . 0.0 116.283 -170.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -155.22 159.47 40.11 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.257 2.223 . . . . 0.0 111.525 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -72.99 -30.16 63.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -161.23 -42.2 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.208 1.403 . . . . 0.0 112.74 -172.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.4 -12.75 60.6 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -168.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m 54.31 26.34 6.78 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.956 1.836 . . . . 0.0 115.956 -173.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -98.12 161.32 13.77 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.041 1.336 . . . . 0.0 112.717 175.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -72.28 161.33 30.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.63 1.572 . . . . 0.0 113.882 -175.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.05 -71.4 2.62 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.177 1.37 . . . . 0.0 114.174 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.278 0.6 OUTLIER -83.51 77.46 9.82 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 123.15 1.452 . . . . 0.0 112.9 -172.371 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -60.6 -179.4 0.12 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.261 2.225 . . . . 0.0 113.498 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.7 -62.84 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 126.164 1.786 . . . . 0.0 114.062 -171.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -80.41 -2.75 46.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.62 1.968 . . . . 0.0 115.419 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.31 -17.9 13.89 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.746 1.618 . . . . 0.0 113.664 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.6 t -48.91 -48.66 71.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -172.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo . . . . . 0 CA--C 1.544 1.016 0 C-N-CA 122.461 2.108 . . . . 0.0 114.545 179.52 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.7 pp . . . . . 0 N--CA 1.478 0.968 0 N-CA-C 114.26 1.207 . . . . 0.0 114.26 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.4 pt -81.56 152.03 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.556 1.143 . . . . 0.0 112.109 173.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.6 p -134.79 152.85 52.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.484 1.514 . . . . 0.0 111.109 174.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.71 20.82 1.2 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.584 1.554 . . . . 0.0 115.028 176.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.2 t80 47.87 34.31 3.89 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.863 2.065 . . . . 0.0 114.45 -169.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 p -93.56 2.38 56.41 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 115.143 1.535 . . . . 0.0 115.143 -172.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -157.63 167.31 34.09 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 123.833 0.73 . . . . 0.0 114.639 -177.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.09 135.15 34.52 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.807 0.843 . . . . 0.0 110.736 172.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -64.6 -14.63 58.71 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -85.76 -18.11 33.93 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.931 1.292 . . . . 0.0 114.275 176.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -140.76 -5.29 1.18 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 116.477 2.029 . . . . 0.0 116.477 -174.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -63.48 142.29 58.45 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.419 1.087 . . . . 0.0 112.288 174.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -136.08 111.77 9.38 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.289 1.435 . . . . 0.0 109.189 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 61.9 p -64.27 -20.59 66.16 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -168.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -69.14 -24.83 64.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.388 1.475 . . . . 0.0 112.973 173.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -132.83 -34.02 1.16 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 -167.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 m 60.78 166.51 0.09 OUTLIER Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 126.89 2.076 . . . . 0.0 114.059 -166.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -119.6 -170.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 122.495 2.13 . . . . 0.0 114.365 -155.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.96 66.64 0.91 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.817 2.047 . . . . 0.0 109.48 167.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.05 -36.64 2.33 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -163.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.3 mt -126.93 35.04 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 126.832 2.053 . . . . 0.0 108.453 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -145.57 154.76 42.52 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.287 3.035 . . . . 0.0 107.817 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 31.3 p -70.46 170.32 12.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 122.027 0.918 . . . . 0.0 112.237 167.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -70.21 134.65 48.28 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.724 -0.61 . . . . 0.0 111.04 165.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.318 19.4 ptpt 53.65 136.94 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 129.62 3.168 . . . . 0.0 115.463 -165.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . 0.298 0.5 OUTLIER 55.55 179.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 126.355 1.862 . . . . 0.0 114.874 -160.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -120.06 32.27 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.301 1.841 . . . . 0.0 114.854 -158.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -133.24 162.19 32.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.379 1.472 . . . . 0.0 112.136 -176.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.7 t -69.06 129.88 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.353 1.461 . . . . 0.0 112.42 -174.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.98 -169.13 7.61 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 124.703 1.144 . . . . 0.0 115.046 174.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.79 2.36 4.43 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 168.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -71.0 158.74 35.99 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.699 0.8 . . . . 0.0 111.802 173.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -64.26 149.96 46.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.664 0.786 . . . . 0.0 110.607 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 m 63.96 -18.61 0.07 Allowed 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 116.645 2.091 . . . . 0.0 116.645 -170.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -86.64 -47.13 9.44 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.476 1.11 . . . . 0.0 110.93 169.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 27.9 t . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 126.289 1.836 . . . . 0.0 110.86 176.785 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.4 t . . . . . 0 N--CA 1.478 0.971 0 CA-C-O 121.101 0.476 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -66.23 -25.21 66.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.491 1.117 . . . . 0.0 113.398 -169.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 60.6 m -76.49 -3.14 35.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.586 1.554 . . . . 0.0 114.906 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 10.8 t 58.64 -42.45 0.06 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.865 3.266 . . . . 0.0 118.072 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 pp -104.87 -9.41 18.02 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.994 1.717 . . . . 0.0 114.333 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.4 t -74.07 138.9 44.29 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.403 0.62 . . . . 0.0 112.468 -172.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -155.19 142.26 19.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.509 1.924 . . . . 0.0 109.356 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.3 m 58.16 34.85 24.56 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt 54.86 34.8 22.85 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.332 1.853 . . . . 0.0 114.53 174.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -69.44 152.11 45.29 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.973 0.909 . . . . 0.0 111.342 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 49.77 6.84 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.827 2.451 . . . . 0.0 117.359 -173.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.0 m -80.4 -22.4 41.29 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -155.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -57.79 117.5 4.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.86 0.864 . . . . 0.0 111.433 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 55.76 20.9 4.31 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.093 1.757 . . . . 0.0 115.138 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -115.33 -44.14 3.01 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.096 1.758 . . . . 0.0 112.541 171.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m . . . . . 0 CA--C 1.553 1.093 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -176.957 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.4 t0 . . . . . 0 CA--C 1.546 0.809 0 CA-C-O 120.944 0.402 . . . . 0.0 111.846 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 61.72 164.73 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.115 2.566 . . . . 0.0 114.409 -174.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 55.0 32.18 17.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.765 2.026 . . . . 0.0 113.63 -175.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -111.94 -3.79 14.73 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.31 1.844 . . . . 0.0 114.816 -171.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.9 149.6 48.71 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -171.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -139.49 152.56 69.2 Favored Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 127.15 2.18 . . . . 0.0 110.668 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -68.68 -29.09 30.13 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 122.983 2.456 . . . . 0.0 113.073 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.274 60.8 pttt 52.52 174.9 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.773 3.229 . . . . 0.0 117.459 173.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -151.51 158.22 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 127.204 2.201 . . . . 0.0 109.556 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.38 109.19 62.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 124.734 1.214 . . . . 0.0 109.926 174.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -71.09 -12.42 30.31 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.5 2.8 . . . . 0.0 114.83 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 50.4 t80 . . . . . 0 CA--C 1.548 0.897 0 C-N-CA 125.414 1.486 . . . . 0.0 113.591 -178.281 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 13.6 t . . . . . 0 CA--C 1.54 0.57 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -76.11 145.08 40.27 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.287 171.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.3 t30 63.21 -53.32 0.19 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.863 2.465 . . . . 0.0 115.341 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 93.7 m -69.85 134.56 48.61 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.222 1.809 . . . . 0.0 112.874 -174.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -72.16 -14.54 76.53 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 123.849 0.738 . . . . 0.0 114.279 172.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.07 -11.69 79.12 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 125.132 1.349 . . . . 0.0 116.068 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt 43.67 -85.22 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.795 2.838 . . . . 0.0 116.166 169.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -73.57 7.03 14.28 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 126.203 1.858 . . . . 0.0 116.546 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -158.07 0.08 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 119.072 1.436 . . . . 0.0 112.442 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -61.42 20.48 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.824 2.049 . . . . 0.0 115.056 169.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.14 -16.5 26.66 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 127.635 2.541 . . . . 0.0 116.378 -170.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.37 -35.79 71.22 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.195 1.398 . . . . 0.0 113.373 172.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -117.94 -16.97 9.84 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.936 2.094 . . . . 0.0 113.193 -167.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 21.2 p . . . . . 0 CA--C 1.544 0.745 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -169.561 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.582 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.66 21.31 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 123.966 0.906 . . . . 0.0 112.98 165.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -79.55 -35.23 0.84 Allowed 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 122.304 2.003 . . . . 0.0 113.942 -178.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt 48.04 -166.19 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.211 1.005 . . . . 0.0 111.431 -151.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.9 m -57.93 158.09 7.0 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 120.513 -1.367 . . . . 0.0 111.926 163.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.405 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 42.7 t30 -66.38 97.0 0.39 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.185 -0.947 . . . . 0.0 110.032 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 61.28 -33.86 0.09 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.529 2.732 . . . . 0.0 117.543 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.8 p -81.54 -2.6 50.5 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -172.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.4 p 49.34 0.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 120.003 3.334 . . . . 0.0 120.003 170.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -118.84 125.75 50.25 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.643 1.565 . . . . 0.0 113.695 -169.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.263 39.6 ptt180 50.22 122.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 130.983 3.713 . . . . 0.0 118.744 167.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 66.85 -143.82 44.16 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 124.148 0.88 . . . . 0.0 114.107 173.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -6.3 97.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 129.318 3.047 . . . . 0.0 117.609 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -62.33 -176.64 0.11 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.23 1.412 . . . . 0.0 114.187 170.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -39.3 -67.47 0.22 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.404 1.882 . . . . 0.0 114.377 -174.154 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -74.55 -1.13 20.08 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.807 1.643 . . . . 0.0 115.111 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -98.69 -33.21 11.03 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.665 1.586 . . . . 0.0 111.886 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.6 m -46.63 -39.98 18.03 Favored Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo . . . . . 0 CA--C 1.544 0.993 0 CA-C-N 122.372 1.883 . . . . 0.0 115.37 -178.923 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.0 pp . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 113.018 0.747 . . . . 0.0 113.018 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.2 pt -83.53 122.77 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.578 1.151 . . . . 0.0 111.434 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 p -84.5 143.52 29.3 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.309 0.644 . . . . 0.0 111.054 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.7 p 44.35 23.25 0.06 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 127.306 2.242 . . . . 0.0 116.752 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 50.18 32.82 6.39 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 126.135 1.774 . . . . 0.0 114.724 -171.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 p -79.32 -25.9 42.28 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.425 -1.422 . . . . 0.0 113.766 -173.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.32 172.35 18.71 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.854 1.692 . . . . 0.0 111.879 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.52 148.28 29.26 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.531 0.732 . . . . 0.0 110.99 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 t -66.02 -17.8 64.92 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.006 -1.059 . . . . 0.0 113.723 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.21 -4.53 29.29 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.202 1.401 . . . . 0.0 113.882 172.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -153.62 89.84 1.36 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 0.0 111.291 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -155.33 126.23 7.04 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.467 1.507 . . . . 0.0 109.426 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -149.7 152.9 36.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.473 0.709 . . . . 0.0 112.818 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.6 m -63.88 -26.35 68.57 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -168.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -103.21 145.81 29.36 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.816 0.847 . . . . 0.0 110.507 156.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.5 m170 67.46 -12.93 0.25 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.328 2.251 . . . . 0.0 116.48 -173.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.491 ' HB3' ' HD3' ' A' ' 40' ' ' PRO 0.313 2.8 t 21.56 -75.6 0.0 OUTLIER Pre-proline 0 CA--C 1.56 1.351 0 C-N-CA 129.841 3.256 . . . . 0.0 118.409 152.809 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 68.1 Cg_endo -79.47 -9.07 14.96 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.872 3.048 . . . . 0.0 116.555 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -86.04 22.63 1.68 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.499 1.52 . . . . 0.0 114.921 -166.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.62 0.14 9.82 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 38.4 mm -101.33 39.87 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 125.009 1.324 . . . . 0.0 109.559 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -151.46 160.33 43.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.237 1.415 . . . . 0.0 112.176 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 38.6 t -102.82 166.99 10.15 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.797 1.639 . . . . 0.0 110.602 170.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.7 m -50.97 135.01 25.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.328 1.051 . . . . 0.0 112.413 170.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.302 22.2 ptmt 47.74 22.36 0.34 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.127 2.171 . . . . 0.0 116.13 -170.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 58.0 m -118.61 154.82 32.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.226 1.811 . . . . 0.0 110.54 172.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -102.61 -6.05 23.19 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.762 1.225 . . . . 0.0 113.774 171.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -138.58 178.83 6.85 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.346 2.258 . . . . 0.0 109.187 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.8 m -75.54 58.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 120.423 -1.423 . . . . 0.0 110.686 165.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.76 -5.9 88.98 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 118.534 2.174 . . . . 0.0 118.534 -147.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -147.67 160.48 42.64 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.851 1.825 . . . . 0.0 112.4 177.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 38.1 t80 57.02 116.37 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.658 2.383 . . . . 0.0 115.459 -176.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 48.65 22.84 0.56 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 126.632 1.973 . . . . 0.0 114.329 -175.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.1 m 51.6 30.28 6.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 114.962 -170.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -143.17 -17.36 0.65 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.039 1.335 . . . . 0.0 113.887 -170.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 60.7 m . . . . . 0 CA--C 1.557 1.231 0 C-N-CA 124.43 1.092 . . . . 0.0 110.622 -161.995 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.304 7.5 p . . . . . 0 N--CA 1.488 1.427 0 N-CA-C 116.189 1.922 . . . . 0.0 116.189 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -69.66 -4.51 19.78 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.485 -1.384 . . . . 0.0 114.728 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.1 m -146.72 131.52 18.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.728 1.611 . . . . 0.0 111.974 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.6 t -52.22 -34.53 46.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.996 0.918 . . . . 0.0 112.924 163.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.91 -18.41 65.37 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.275 1.43 . . . . 0.0 114.66 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 55.8 m -88.48 6.73 36.32 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -50.97 109.28 0.31 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.902 1.281 . . . . 0.0 110.284 163.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.6 m 55.44 21.96 4.68 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -152.28 142.99 22.87 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.137 1.775 . . . . 0.0 110.667 -178.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.1 ttmm -128.01 134.88 49.28 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.585 1.154 . . . . 0.0 112.138 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -138.12 15.18 2.83 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.683 1.593 . . . . 0.0 113.548 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.9 m -66.75 -32.78 74.3 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -151.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -65.14 -23.68 67.19 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.152 0.981 . . . . 0.0 113.339 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -100.06 -17.53 17.43 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.044 1.338 . . . . 0.0 113.964 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -133.87 -36.28 0.94 Allowed 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -167.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m . . . . . 0 CA--C 1.543 0.698 0 CA-C-N 119.716 1.143 . . . . 0.0 112.342 -169.406 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -116.83 7.69 13.41 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.885 1.274 . . . . 0.0 114.317 -171.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -136.21 148.26 48.02 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.101 1.36 . . . . 0.0 111.524 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -135.67 143.99 45.76 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.742 2.017 . . . . 0.0 112.224 -172.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -92.47 161.01 14.8 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.511 1.124 . . . . 0.0 111.71 169.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -132.96 59.27 41.53 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 125.009 1.324 . . . . 0.0 112.905 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -71.31 144.82 46.89 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.09 2.527 . . . . 0.0 112.483 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -153.06 150.12 28.82 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.214 1.806 . . . . 0.0 111.163 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 44.4 t -131.86 136.35 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.472 1.509 . . . . 0.0 110.374 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.5 mt -132.81 94.64 20.9 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 125.994 1.717 . . . . 0.0 109.855 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -65.62 140.38 62.18 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 123.476 2.784 . . . . 0.0 114.563 -174.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 23.0 t80 . . . . . 0 CA--C 1.545 0.775 0 C-N-CA 125.826 1.65 . . . . 0.0 111.436 174.174 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 34.7 t . . . . . 0 CA--C 1.548 0.892 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -154.85 -16.96 0.12 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.6 m-20 -67.69 -18.4 64.91 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -172.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 19.1 p -134.12 32.32 3.46 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.843 1.257 . . . . 0.0 114.383 -173.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 81.55 16.06 74.39 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.699 1.44 . . . . 0.0 116.699 164.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -154.87 151.31 22.96 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.96 1.267 . . . . 0.0 112.026 176.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.18 -35.61 5.84 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 -168.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.58 11.96 50.48 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -171.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.267 1.2 p80 -99.89 -137.05 0.31 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.911 1.356 . . . . 0.0 114.078 -168.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -74.34 35.7 0.1 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 127.669 2.388 . . . . 0.0 113.139 -169.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.0 -18.35 8.79 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 128.05 2.738 . . . . 0.0 115.79 -172.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.21 -40.51 94.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.529 1.532 . . . . 0.0 113.304 170.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -130.51 -22.73 2.69 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -165.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 16.2 p . . . . . 0 CA--C 1.55 0.944 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -165.921 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 114.805 1.409 . . . . 0.0 114.805 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.64 -46.54 60.79 Favored Pre-proline 0 CA--C 1.554 1.117 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 168.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -79.25 -42.37 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.931 0 C-N-CA 122.262 1.975 . . . . 0.0 114.093 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? 57.69 -56.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.923 2.889 . . . . 0.0 116.285 -171.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.8 t -156.96 160.02 38.65 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.58 2.352 . . . . 0.0 110.925 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -72.64 -24.57 61.07 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.026 -1.047 . . . . 0.0 113.703 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -159.28 -37.65 0.06 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.256 1.423 . . . . 0.0 112.978 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.9 m -77.3 -163.88 0.42 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.59 1.156 . . . . 0.0 111.489 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 78.2 p -136.73 19.31 3.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -115.56 143.57 45.13 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.318 1.047 . . . . 0.0 112.47 172.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ptt85 -78.69 -3.18 42.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.43 -20.82 71.98 Favored Glycine 0 CA--C 1.537 1.463 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -176.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.43 89.72 1.52 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.846 1.258 . . . . 0.0 112.14 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -60.96 -179.55 0.14 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.884 1.674 . . . . 0.0 113.445 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.31 -65.08 0.37 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 126.354 1.862 . . . . 0.0 114.675 -171.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ptmm? -76.21 -9.7 58.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 126.329 1.852 . . . . 0.0 115.303 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.17 -20.48 17.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.263 1.425 . . . . 0.0 112.723 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -66.0 -51.06 49.01 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 124.644 1.178 . . . . 0.0 113.835 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo . . . . . 0 C--N 1.353 0.773 0 C-N-CA 122.282 1.988 . . . . 0.0 112.481 174.532 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.9 tp . . . . . 0 CA--C 1.546 0.82 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.5 pt -73.14 161.66 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 126.631 1.972 . . . . 0.0 112.908 172.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 59.5 m -77.77 7.05 6.3 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m 64.24 130.64 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.453 2.301 . . . . 0.0 114.57 -164.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 52.18 25.76 3.5 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.707 1.603 . . . . 0.0 114.261 -172.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.2 t -153.93 113.01 3.71 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.444 1.897 . . . . 0.0 108.6 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.55 174.19 45.89 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.917 1.246 . . . . 0.0 115.441 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.67 139.11 47.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.342 1.457 . . . . 0.0 109.55 166.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.5 t -64.01 -22.93 67.14 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -89.07 -14.19 36.93 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -151.01 95.07 2.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.386 1.475 . . . . 0.0 111.707 -172.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -155.47 134.67 12.28 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -158.12 160.96 37.87 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.342 1.457 . . . . 0.0 110.6 172.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -58.47 -28.63 65.52 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.063 1.745 . . . . 0.0 115.055 -175.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -72.6 -24.89 61.15 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.794 1.238 . . . . 0.0 113.367 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -122.05 -0.58 9.45 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.524 1.529 . . . . 0.0 114.414 -171.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -25.03 -60.06 0.14 Allowed Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 129.034 2.934 . . . . 0.0 117.665 -177.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -80.49 54.51 5.26 Favored 'Trans proline' 0 CA--C 1.55 1.291 0 C-N-CA 123.571 2.847 . . . . 0.0 114.298 -168.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.41 171.53 8.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.608 1.963 . . . . 0.0 113.533 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.67 -60.89 0.17 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 128.565 2.746 . . . . 0.0 116.622 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.2 mt -106.93 49.2 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 123.245 1.498 . . . . 0.0 110.261 -164.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.0 mm-40 -148.19 165.15 31.77 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.939 2.496 . . . . 0.0 109.725 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 10.6 p -126.0 124.38 40.58 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.529 1.132 . . . . 0.0 111.405 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.4 p -71.32 -16.12 62.43 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -165.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -93.05 -13.02 29.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.578 1.151 . . . . 0.0 113.269 176.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.3 t -143.3 -20.79 0.62 Allowed 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -157.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 60.58 141.5 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 128.114 2.566 . . . . 0.0 114.666 -162.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.284 10.5 pt-20 46.54 126.23 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 131.298 3.839 . . . . 0.0 119.225 -175.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.47 -12.15 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 119.08 -2.262 . . . . 0.0 112.04 163.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.43 4.94 3.37 Favored Glycine 0 CA--C 1.541 1.715 0 C-N-CA 126.43 1.967 . . . . 0.0 116.986 -177.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.26 169.87 14.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.732 1.613 . . . . 0.0 112.075 173.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 53.42 88.21 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.055 1.742 . . . . 0.0 112.926 -172.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 53.64 26.05 5.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 126.349 1.86 . . . . 0.0 114.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.6 m 55.12 23.04 4.96 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.645 1.578 . . . . 0.0 114.733 -172.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -141.35 -17.05 0.81 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.288 1.435 . . . . 0.0 114.022 -169.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 35.4 m . . . . . 0 CA--C 1.555 1.141 0 C-N-CA 125.827 1.651 . . . . 0.0 114.09 -154.789 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.4 m . . . . . 0 N--CA 1.478 0.937 0 N-CA-C 112.495 0.554 . . . . 0.0 112.495 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 pp0? -68.17 -19.65 64.81 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -168.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.8 m -76.13 -20.23 57.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 172.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 61.47 -28.47 0.06 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.105 2.162 . . . . 0.0 115.155 -156.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 44.7 mt -89.72 -15.82 31.69 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.397 1.879 . . . . 0.0 114.533 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -176.25 2.47 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -174.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.7 tptt 66.7 -24.59 0.11 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 128.217 2.607 . . . . 0.0 115.177 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.8 t -73.59 150.9 41.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.815 1.246 . . . . 0.0 113.312 168.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -70.23 -22.44 62.9 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.612 1.965 . . . . 0.0 114.178 177.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -75.95 -44.1 41.62 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.345 1.058 . . . . 0.0 113.136 -175.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -77.05 -42.95 36.32 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -165.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.1 m -76.42 -11.59 59.91 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.184 1.92 . . . . 0.0 116.184 -158.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -51.52 124.7 12.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.292 1.437 . . . . 0.0 112.029 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . 0.285 10.0 pt-20 49.97 4.6 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 128.909 2.884 . . . . 0.0 118.486 -178.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -124.58 -24.23 4.24 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.198 1.399 . . . . 0.0 114.605 -177.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 86.5 m . . . . . 0 CA--C 1.549 0.918 0 C-N-CA 124.921 1.288 . . . . 0.0 112.007 168.232 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 N--CA 1.476 0.857 0 N-CA-C 114.33 1.233 . . . . 0.0 114.33 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -79.98 151.36 30.07 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.553 1.141 . . . . 0.0 112.251 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -138.5 139.82 38.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.409 1.484 . . . . 0.0 111.716 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -108.58 150.12 27.94 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.817 1.647 . . . . 0.0 110.85 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -101.5 -16.18 16.89 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -82.34 137.64 45.38 Favored Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 124.023 0.929 . . . . 0.0 111.204 176.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.32 160.35 50.19 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.871 2.381 . . . . 0.0 113.081 173.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -85.02 -26.53 27.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.179 1.791 . . . . 0.0 112.949 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.7 t -124.46 145.53 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.997 1.719 . . . . 0.0 110.543 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -120.05 164.76 20.58 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 126.053 1.741 . . . . 0.0 111.739 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -58.28 156.48 30.12 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.821 3.014 . . . . 0.0 115.787 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 . . . . . 0 CA--C 1.542 0.659 0 C-N-CA 125.768 1.627 . . . . 0.0 112.799 -179.446 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 4.5 t . . . . . 0 CA--C 1.549 0.924 0 CA-C-O 121.762 0.791 . . . . 0.0 112.511 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -61.49 -9.3 5.45 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -176.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -64.96 -22.06 66.94 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.398 1.079 . . . . 0.0 113.119 170.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 95.6 m -105.95 176.03 5.3 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.972 2.109 . . . . 0.0 112.354 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.05 -7.76 38.98 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 124.937 1.256 . . . . 0.0 115.712 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -159.54 154.13 25.18 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.427 1.489 . . . . 0.0 112.47 172.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -86.16 -22.08 27.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -77.99 33.16 1.71 Allowed Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.825 1.679 . . . . 0.0 117.149 -163.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.99 151.17 31.7 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.827 1.314 . . . . 0.0 113.108 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 44.39 28.74 0.32 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.359 2.264 . . . . 0.0 116.905 154.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.93 -18.45 59.88 Favored Glycine 0 CA--C 1.536 1.348 0 O-C-N 121.017 -1.052 . . . . 0.0 114.898 -167.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.32 -46.42 41.09 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.37 1.468 . . . . 0.0 113.483 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -111.44 -20.85 12.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.764 1.626 . . . . 0.0 114.463 -162.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 5.1 t . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -170.721 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.698 0 CA-C-O 121.269 0.557 . . . . 0.0 112.221 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.97 -51.64 79.17 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 171.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.75 -35.44 0.53 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.482 2.122 . . . . 0.0 113.993 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.401 0.0 OUTLIER 51.87 -53.64 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 130.138 3.375 . . . . 0.0 117.482 -168.608 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 16' ' ' LEU . 4.5 m -163.56 165.82 23.17 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 131.564 3.946 . . . . 0.0 109.623 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -72.84 -94.8 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.901 -1.125 . . . . 0.0 112.502 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -90.22 -22.3 21.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.527 1.131 . . . . 0.0 111.476 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -67.17 166.77 13.39 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.713 1.605 . . . . 0.0 110.792 165.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.5 p -134.52 15.56 3.71 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -165.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -84.14 164.28 19.27 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.693 0.797 . . . . 0.0 112.312 174.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.6 mtt-85 -91.67 111.82 23.49 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 170.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.25 152.33 16.34 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.522 1.534 . . . . 0.0 112.586 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.363 13.3 p-80 51.53 62.87 2.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-O 123.438 1.589 . . . . 0.0 111.644 -161.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.531 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.13 -170.42 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.387 1.875 . . . . 0.0 114.391 -175.407 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -34.94 -64.75 0.25 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.504 1.922 . . . . 0.0 114.522 -169.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -74.68 -11.17 60.11 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.151 1.78 . . . . 0.0 115.437 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -99.98 -13.63 19.01 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.376 1.87 . . . . 0.0 113.635 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.9 m -65.1 167.32 10.05 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.74 1.216 . . . . 0.0 112.274 159.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 CA--C 1.54 0.815 0 C-N-CA 124.147 3.231 . . . . 0.0 114.759 176.586 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.8 pp . . . . . 0 N--CA 1.476 0.872 0 N-CA-C 113.76 1.022 . . . . 0.0 113.76 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.1 mt -68.76 127.23 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.121 1.369 . . . . 0.0 110.331 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.0 p -62.43 128.37 35.7 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 121.897 0.856 . . . . 0.0 112.204 -175.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.9 m 51.32 14.56 0.24 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.3 t80 45.65 35.89 2.37 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.777 1.631 . . . . 0.0 113.359 -166.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 p -86.5 -14.44 43.07 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.96 -173.0 18.55 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 114.977 0.751 . . . . 0.0 114.977 -174.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.0 -176.89 1.2 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.956 0.902 . . . . 0.0 111.731 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -119.69 -40.86 2.72 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 173.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -79.61 -24.84 41.69 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.3 p30 -133.39 32.96 3.6 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.304 1.842 . . . . 0.0 112.652 174.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 23.1 t-160 -46.42 -55.14 7.84 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.48 2.712 . . . . 0.0 115.427 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.23 -43.58 56.5 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 m -70.12 -16.71 63.15 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -167.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -77.72 22.78 0.25 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.682 1.593 . . . . 0.0 113.289 172.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.8 m80 50.99 58.2 5.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.83 1.252 . . . . 0.0 111.258 -163.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.348 32.2 t 34.38 -90.75 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 129.379 3.072 . . . . 0.0 115.93 176.74 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 97.0 Cg_endo -73.13 -5.72 17.67 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 123.327 2.685 . . . . 0.0 115.768 -175.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -90.5 36.05 0.88 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.471 1.508 . . . . 0.0 113.536 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -131.14 -13.71 3.49 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 117.188 2.292 . . . . 0.0 117.188 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.1 mm -120.18 45.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-N 120.49 1.496 . . . . 0.0 110.473 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.76 158.29 43.96 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 120.65 -1.281 . . . . 0.0 112.888 166.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 43.4 t -55.02 155.77 4.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.143 2.177 . . . . 0.0 112.064 169.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -62.22 -28.47 69.71 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.621 -1.3 . . . . 0.0 114.423 -174.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -131.74 4.11 4.19 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.74 1.616 . . . . 0.0 113.987 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 m -135.3 158.82 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.094 1.358 . . . . 0.0 111.333 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -88.56 0.19 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -160.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -122.49 153.08 39.63 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.954 -1.091 . . . . 0.0 113.375 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.6 t -6.32 -60.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.241 1 C-N-CA 132.581 4.352 . . . . 0.0 119.021 -167.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.03 165.26 32.61 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 124.872 1.225 . . . . 0.0 112.238 -169.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -79.62 9.48 4.96 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 116.717 2.118 . . . . 0.0 116.717 -159.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -61.27 151.34 32.08 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.503 -1.373 . . . . 0.0 112.301 174.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -0.02 1.48 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -175.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.8 p -127.47 3.63 6.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.368 1.867 . . . . 0.0 113.289 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -119.4 -27.23 5.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.266 1.826 . . . . 0.0 112.733 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 19.8 t . . . . . 0 CA--C 1.555 1.157 0 C-N-CA 125.932 1.693 . . . . 0.0 111.569 169.503 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.293 2.2 p . . . . . 0 N--CA 1.486 1.355 0 N-CA-C 115.359 1.614 . . . . 0.0 115.359 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 54.36 0.85 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.54 2.336 . . . . 0.0 116.264 -170.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.3 m -145.02 144.8 31.2 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.61 1.096 . . . . 0.0 112.662 -169.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.0 t -77.65 -24.62 49.38 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.674 0.79 . . . . 0.0 113.124 161.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.9 mt -74.55 -15.74 60.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.906 1.283 . . . . 0.0 113.966 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 87.4 m -112.51 159.39 18.83 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.671 1.189 . . . . 0.0 112.866 -169.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -126.27 154.09 43.87 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.086 1.754 . . . . 0.0 110.368 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 p -51.93 137.01 27.58 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.379 1.071 . . . . 0.0 112.483 176.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.304 8.8 ptpp? 48.23 20.23 0.26 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 127.978 2.511 . . . . 0.0 116.775 -171.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -133.59 30.95 3.75 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.894 2.078 . . . . 0.0 112.698 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -73.22 171.94 12.05 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.876 0.87 . . . . 0.0 112.809 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.2 m 66.59 -7.04 0.46 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 127.989 2.516 . . . . 0.0 117.532 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -53.66 151.21 6.29 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.587 1.555 . . . . 0.0 112.25 171.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 51.85 37.83 21.73 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.301 1.44 . . . . 0.0 113.135 -174.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? 53.44 62.59 2.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.761 2.025 . . . . 0.0 112.256 -177.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t . . . . . 0 CA--C 1.561 1.377 0 C-N-CA 125.762 1.625 . . . . 0.0 114.322 177.674 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 . . . . . 0 CA--C 1.54 0.564 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 51.9 30.41 7.14 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.372 1.869 . . . . 0.0 114.726 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -144.27 152.11 40.34 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.068 1.747 . . . . 0.0 111.146 -175.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -143.68 153.5 42.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.439 1.896 . . . . 0.0 112.915 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.38 -15.04 56.46 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -106.92 126.58 29.88 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 124.924 1.289 . . . . 0.0 112.215 -174.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -80.41 166.71 19.91 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.646 2.897 . . . . 0.0 112.583 173.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -138.69 125.23 20.64 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.653 1.581 . . . . 0.0 109.863 167.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.0 t -104.01 -35.74 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -162.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.1 tp -143.68 127.57 9.21 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.782 1.233 . . . . 0.0 110.757 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -91.2 -13.92 1.87 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.118 2.546 . . . . 0.0 114.415 -177.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 41.9 t80 . . . . . 0 N--CA 1.472 0.637 0 C-N-CA 125.028 1.331 . . . . 0.0 112.855 -171.741 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.9 m . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -77.35 -10.21 59.31 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 120.847 -1.158 . . . . 0.0 113.803 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -110.32 -20.63 12.56 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.0 p -154.79 164.89 38.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.239 1.016 . . . . 0.0 113.087 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -67.92 123.3 18.22 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.013 0.815 . . . . 0.0 113.994 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.78 142.26 1.08 Allowed Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.746 1.641 . . . . 0.0 114.514 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -80.28 56.38 2.47 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.935 1.694 . . . . 0.0 112.614 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -76.11 -12.38 84.13 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.177 1.37 . . . . 0.0 116.434 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -144.6 -161.29 1.26 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.028 1.414 . . . . 0.0 112.452 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -70.24 44.37 0.07 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.427 2.291 . . . . 0.0 113.023 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -43.84 -19.67 0.12 Allowed Glycine 0 CA--C 1.532 1.094 1 C-N-CA 131.359 4.314 . . . . 0.0 118.452 -170.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.78 -38.81 89.45 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.401 1.601 . . . . 0.0 112.352 169.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -112.44 -14.14 13.29 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.648 1.979 . . . . 0.0 113.007 171.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 CA--C 1.543 0.695 0 C-N-CA 127.357 2.263 . . . . 0.0 114.78 166.145 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.623 0 CA-C-O 120.866 0.365 . . . . 0.0 111.731 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.96 -52.18 1.61 Allowed Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.328 1.051 . . . . 0.0 112.947 165.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.14 -36.49 1.88 Allowed 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.763 2.308 . . . . 0.0 114.556 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 60.92 -64.84 0.06 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 127.91 2.484 . . . . 0.0 114.368 -169.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.5 t -159.55 161.29 35.21 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 128.416 2.686 . . . . 0.0 110.368 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -68.26 -35.45 77.91 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.063 -1.023 . . . . 0.0 112.933 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -145.4 -62.83 0.34 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 p -87.76 95.94 10.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.601 1.161 . . . . 0.0 111.934 -176.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.0 p -71.66 63.53 0.43 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 128.373 2.669 . . . . 0.0 115.887 -168.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 pp0? -121.09 148.16 44.55 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 127.376 2.27 . . . . 0.0 110.545 165.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.8 mtm180 -73.07 136.26 44.94 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.639 0.776 . . . . 0.0 111.727 -172.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 147.07 -37.67 1.15 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.798 1.19 . . . . 0.0 113.79 176.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -139.72 101.06 4.11 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.179 0.991 . . . . 0.0 112.992 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.86 -178.69 0.33 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.557 1.143 . . . . 0.0 112.938 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.83 -66.21 0.35 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.945 1.698 . . . . 0.0 113.802 -171.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -74.34 -11.1 60.16 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.865 1.431 . . . . 0.0 114.865 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -85.64 -26.76 25.83 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.347 1.059 . . . . 0.0 112.263 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.2 t -59.1 -42.34 93.06 Favored Pre-proline 0 CA--C 1.557 1.235 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo . . . . . 0 C--N 1.357 0.988 0 C-N-CA 122.442 2.095 . . . . 0.0 114.389 -173.369 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.4 pp . . . . . 0 N--CA 1.48 1.029 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 mt -113.86 145.36 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.163 1.385 . . . . 0.0 111.595 -170.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.7 t -43.22 117.47 1.11 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.853 2.061 . . . . 0.0 114.136 -174.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.7 m 51.58 20.34 1.04 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.661 1.984 . . . . 0.0 116.245 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.9 t80 52.15 26.38 3.85 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 125.298 1.439 . . . . 0.0 113.789 -167.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.4 p -115.48 -25.86 7.76 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.945 1.698 . . . . 0.0 113.627 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -96.99 155.5 20.74 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.688 1.613 . . . . 0.0 113.779 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -109.92 142.54 41.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.437 1.095 . . . . 0.0 110.849 166.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -59.62 -26.18 65.26 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.413 1.485 . . . . 0.0 114.875 -168.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.16 1.27 28.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -140.91 -13.59 0.94 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 115.931 1.826 . . . . 0.0 115.931 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -64.24 138.57 58.5 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.868 -1.145 . . . . 0.0 113.409 -176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.46 133.75 46.56 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.799 1.639 . . . . 0.0 110.227 171.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.9 t -58.67 -29.68 66.77 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 171.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -62.93 -25.19 68.22 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.627 1.571 . . . . 0.0 114.087 174.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -131.64 -16.29 3.01 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -165.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.53 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.346 2.1 m 41.22 -98.18 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 128.057 2.543 . . . . 0.0 115.927 178.59 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.53 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 19.9 Cg_exo -77.33 -3.38 13.61 Favored 'Trans proline' 0 C--N 1.36 1.146 0 CA-C-N 123.544 2.301 . . . . 0.0 117.626 -155.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.75 -3.96 2.75 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -171.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.3 -23.38 17.23 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.031 1.332 . . . . 0.0 114.148 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.5 mt -128.51 -15.75 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.266 1.427 . . . . 0.0 112.623 -176.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -128.81 173.28 10.5 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.725 -1.234 . . . . 0.0 111.625 155.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 28.0 p -117.3 -176.67 3.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.51 1.524 . . . . 0.0 110.392 167.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.1 p -75.99 -17.93 59.5 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -176.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -96.1 -31.81 12.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.571 1.148 . . . . 0.0 113.768 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -156.09 167.56 30.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.795 1.238 . . . . 0.0 112.263 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.96 18.38 0.18 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.378 1.871 . . . . 0.0 114.853 -169.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -132.09 158.12 42.42 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.86 1.664 . . . . 0.0 112.359 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.99 121.75 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 125.032 1.333 . . . . 0.0 113.465 -165.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 54.44 -150.77 15.58 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 124.786 1.184 . . . . 0.0 115.776 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.3 m80 -139.46 10.37 2.5 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.096 1.358 . . . . 0.0 113.705 170.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -72.09 148.98 45.22 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.129 -0.982 . . . . 0.0 112.146 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.0 tpt85 -60.68 -23.21 64.65 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.715 1.606 . . . . 0.0 114.266 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -90.92 -8.09 50.32 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.287 1.835 . . . . 0.0 114.45 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -119.61 -42.14 2.65 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.966 1.306 . . . . 0.0 113.944 -171.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.3 t . . . . . 0 CA--C 1.543 0.687 0 C-N-CA 123.891 0.876 . . . . 0.0 112.211 -171.785 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.6 m . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 111.943 0.349 . . . . 0.0 111.943 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -12.27 33.5 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.4 m -87.15 99.91 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.428 0.691 . . . . 0.0 112.451 -172.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.4 p 33.23 -79.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 117.483 2.401 . . . . 0.0 117.483 136.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 pp -109.65 -10.03 14.84 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.63 2.772 . . . . 0.0 114.729 -170.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.26 161.39 26.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.423 1.089 . . . . 0.0 113.1 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -125.73 148.31 49.1 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.157 1.783 . . . . 0.0 109.662 171.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.8 p -58.33 137.22 57.35 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.476 1.511 . . . . 0.0 112.197 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.4 tttt 53.45 23.55 3.47 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.294 1.837 . . . . 0.0 114.798 -174.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -132.14 12.07 4.65 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.19 1.396 . . . . 0.0 114.386 -175.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -147.83 171.1 16.25 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.904 0.882 . . . . 0.0 111.966 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.9 t -129.26 153.6 47.63 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 79' ' ' ARG . 56.7 mtmt -66.33 -4.23 7.56 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.851 2.06 . . . . 0.0 114.046 165.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -66.99 43.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 126.54 1.936 . . . . 0.0 111.676 155.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . 0.438 ' H ' ' C ' ' A' ' 77' ' ' LYS . 62.9 mmt-85 48.94 50.4 17.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 129.829 3.252 . . . . 0.0 115.423 175.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m . . . . . 0 CA--C 1.556 1.193 0 C-N-CA 126.118 1.767 . . . . 0.0 115.602 166.663 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 . . . . . 0 CA--C 1.544 0.742 0 N-CA-C 113.795 1.035 . . . . 0.0 113.795 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -123.04 157.43 32.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.142 1.377 . . . . 0.0 112.944 -173.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 60.96 161.47 0.06 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.776 2.431 . . . . 0.0 116.305 -177.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -129.19 161.3 30.45 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.597 2.359 . . . . 0.0 110.574 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -136.01 152.91 51.41 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.316 1.046 . . . . 0.0 113.182 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.49 158.6 60.12 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.594 2.358 . . . . 0.0 110.435 170.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.45 154.58 58.11 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.129 2.553 . . . . 0.0 114.103 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -87.44 22.49 2.16 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.804 1.642 . . . . 0.0 113.105 174.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -149.85 150.61 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 127.218 2.207 . . . . 0.0 110.008 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -130.16 146.31 61.0 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.252 1.421 . . . . 0.0 111.214 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.03 -13.72 19.24 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.81 3.007 . . . . 0.0 114.127 -176.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 31.9 t80 . . . . . 0 CA--C 1.547 0.838 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -172.913 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 8.6 t . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 120.954 0.407 . . . . 0.0 111.972 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -137.46 11.54 2.98 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.898 1.279 . . . . 0.0 112.925 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -142.88 158.18 43.87 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.415 1.886 . . . . 0.0 110.157 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 p 52.64 -5.4 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 119.684 3.216 . . . . 0.0 119.684 173.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.68 -167.94 39.66 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.29 1.424 . . . . 0.0 114.002 -178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.77 161.78 48.79 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.648 1.118 . . . . 0.0 113.954 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -65.28 -19.0 65.76 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -166.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.27 -37.22 15.45 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 116.293 1.277 . . . . 0.0 116.293 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.28 141.77 30.71 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.382 1.591 . . . . 0.0 115.016 -164.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 37.71 31.78 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 129.486 3.114 . . . . 0.0 117.17 164.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.54 -11.41 41.51 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.302 1.43 . . . . 0.0 115.441 -165.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.16 -35.27 73.88 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.671 1.588 . . . . 0.0 113.747 173.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -143.99 -27.54 0.53 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -159.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.0 p . . . . . 0 N--CA 1.475 0.775 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -175.744 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.547 0.856 0 N-CA-C 114.659 1.355 . . . . 0.0 114.659 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -45.64 -47.44 38.15 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 173.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 -40.36 0.33 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 122.056 1.838 . . . . 0.0 114.067 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm 40.63 -158.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.693 1.197 . . . . 0.0 111.773 -146.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.1 t -59.77 157.7 11.69 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.408 -1.433 . . . . 0.0 112.834 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -63.58 -35.8 81.68 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.272 -0.892 . . . . 0.0 111.763 168.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -150.15 -48.08 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -166.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 55.6 m -70.25 -40.24 74.52 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.743 1.156 . . . . 0.0 113.924 -170.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.8 m 56.8 21.71 6.28 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 117.446 2.387 . . . . 0.0 117.446 176.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -129.26 8.55 5.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.313 1.445 . . . . 0.0 112.9 175.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -143.49 150.68 39.32 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.629 1.572 . . . . 0.0 111.707 -172.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -68.31 -10.83 60.65 Favored Glycine 0 CA--C 1.533 1.215 0 N-CA-C 116.19 1.236 . . . . 0.0 116.19 -170.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.58 92.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.124 1.462 . . . . 0.0 112.432 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -59.02 175.57 0.27 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.089 1.356 . . . . 0.0 113.169 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -32.79 -68.98 0.09 Allowed 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 126.751 2.02 . . . . 0.0 114.45 -173.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -78.49 -8.03 58.1 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -27.32 26.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.046 1.339 . . . . 0.0 111.821 171.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.09 139.49 95.99 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.257 1.423 . . . . 0.0 112.013 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo . . . . . 0 CA--C 1.541 0.844 0 C-N-CA 123.574 2.849 . . . . 0.0 114.995 178.107 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.0 pt . . . . . 0 CA--C 1.542 0.667 0 CA-C-O 121.105 0.479 . . . . 0.0 112.062 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.9 mt 54.69 22.97 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 126.678 1.991 . . . . 0.0 113.585 175.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.1 m 46.82 27.58 0.71 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.136 1.774 . . . . 0.0 114.616 -174.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . 0.299 5.7 p 42.07 79.58 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.588 1.955 . . . . 0.0 113.315 -162.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 68.54 17.09 9.08 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.454 2.702 . . . . 0.0 116.984 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -109.09 66.1 0.63 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 108.434 164.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 164.29 -162.6 35.45 Favored Glycine 0 CA--C 1.524 0.631 0 O-C-N 121.195 -0.94 . . . . 0.0 114.0 173.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -136.41 158.03 45.39 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.617 1.567 . . . . 0.0 108.597 163.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.5 t -67.41 -24.76 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -175.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -119.63 -39.09 2.9 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -107.82 61.95 0.61 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.153 0.981 . . . . 0.0 112.959 -171.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -153.76 134.95 14.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.241 1.416 . . . . 0.0 111.031 -176.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -156.12 171.22 20.53 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.227 1.011 . . . . 0.0 112.648 -172.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -53.69 -32.08 50.38 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.083 1.753 . . . . 0.0 114.564 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -84.9 -8.96 58.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.015 1.726 . . . . 0.0 113.649 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -131.78 -0.55 3.85 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.839 1.656 . . . . 0.0 114.699 -170.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 t -27.96 -52.84 0.24 Allowed Pre-proline 0 CA--C 1.557 1.222 0 C-N-CA 127.969 2.508 . . . . 0.0 117.25 -175.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -65.41 -18.49 60.17 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 122.701 2.267 . . . . 0.0 116.167 -178.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -73.16 128.08 34.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.782 1.233 . . . . 0.0 110.692 174.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.73 138.96 21.3 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -172.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 35.9 mm 58.38 139.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 130.51 3.524 . . . . 0.0 116.709 165.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -162.24 158.94 25.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.345 1.858 . . . . 0.0 112.858 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.6 t -99.49 162.34 13.09 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.079 1.352 . . . . 0.0 110.14 159.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.5 p -56.2 140.46 44.39 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 120.938 -1.101 . . . . 0.0 111.692 177.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt 56.94 6.71 0.34 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.639 1.976 . . . . 0.0 115.687 -174.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.5 m -93.85 -36.44 12.24 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.225 1.01 . . . . 0.0 112.523 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 60.01 -20.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 128.087 2.555 . . . . 0.0 116.769 -176.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -136.58 127.58 27.72 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.959 2.103 . . . . 0.0 110.021 162.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.274 13.5 m 40.78 -62.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.026 1 C-N-CA 132.575 4.35 . . . . 0.0 118.949 178.943 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 166.26 155.37 8.8 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.981 1.276 . . . . 0.0 114.051 -172.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -77.26 113.64 15.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.287 1.435 . . . . 0.0 112.602 175.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.6 t80 66.02 154.53 0.08 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.794 2.038 . . . . 0.0 115.662 -173.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 48.84 16.49 0.12 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 128.383 2.673 . . . . 0.0 114.982 -167.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.0 m 50.13 28.23 2.94 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.119 1.768 . . . . 0.0 114.515 -170.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -157.94 -14.79 0.08 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 115.861 1.8 . . . . 0.0 115.861 -174.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 31.5 p . . . . . 0 CA--C 1.556 1.192 0 C-N-CA 127.793 2.437 . . . . 0.0 115.998 -172.897 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m . . . . . 0 N--CA 1.476 0.856 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -81.02 -19.07 44.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.481 1.112 . . . . 0.0 113.076 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.0 m -97.89 148.35 23.52 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.042 0.937 . . . . 0.0 111.943 178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.2 t -74.72 -35.21 62.67 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 69' ' ' LEU . 1.7 pt? -95.23 -25.2 16.46 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.72 147.06 39.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.92 0.888 . . . . 0.0 112.853 -169.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -103.85 -31.4 9.8 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.608 1.163 . . . . 0.0 112.676 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.4 m -79.57 160.67 26.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.291 1.036 . . . . 0.0 113.542 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.49 163.7 22.1 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.857 1.663 . . . . 0.0 112.712 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.4 tppt? 56.53 31.25 18.67 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.467 1.907 . . . . 0.0 113.385 -173.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -89.72 158.84 17.37 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.724 1.609 . . . . 0.0 113.265 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.4 p -162.37 -65.27 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 176.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -56.04 147.64 19.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.7 2.0 . . . . 0.0 113.718 -161.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 55.93 27.31 10.92 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.851 1.66 . . . . 0.0 113.72 -171.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.5 mmt85 50.38 50.65 18.33 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 126.526 1.93 . . . . 0.0 111.917 -169.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m . . . . . 0 CA--C 1.549 0.93 0 C-N-CA 129.096 2.958 . . . . 0.0 113.681 -162.075 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.9 t70 . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 113.811 1.041 . . . . 0.0 113.811 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.85 107.3 13.54 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.26 -0.9 . . . . 0.0 110.988 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.71 -11.54 59.61 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -173.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -121.27 119.44 32.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.435 1.494 . . . . 0.0 111.343 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -138.81 19.87 2.67 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.838 1.655 . . . . 0.0 112.136 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -91.77 153.33 43.74 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 126.203 1.801 . . . . 0.0 113.172 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.94 164.61 35.1 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.26 2.64 . . . . 0.0 112.943 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -123.76 168.31 12.88 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.604 1.962 . . . . 0.0 111.373 174.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.31 -2.3 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -168.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.47 ' H ' HD23 ' A' ' 101' ' ' LEU . 1.6 pt? -104.16 144.82 29.47 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.882 1.273 . . . . 0.0 113.738 -176.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -82.59 169.42 13.72 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.093 3.196 . . . . 0.0 113.94 -176.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 40.1 t80 . . . . . 0 CA--C 1.548 0.88 0 C-N-CA 125.902 1.681 . . . . 0.0 112.385 178.015 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 66.5 m . . . . . 0 CA--C 1.539 0.546 0 CA-C-O 121.374 0.607 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -72.18 172.7 9.72 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.873 -0.517 . . . . 0.0 111.068 159.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 56.0 t30 65.52 -61.71 0.24 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.555 2.342 . . . . 0.0 115.991 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.94 -21.79 26.04 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -170.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.51 -5.59 28.39 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 124.758 1.17 . . . . 0.0 115.457 -173.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -78.8 -171.81 40.56 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.866 1.222 . . . . 0.0 112.789 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -144.34 146.08 32.35 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.881 1.672 . . . . 0.0 110.697 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.47 17.71 48.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 162.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -140.01 132.64 28.83 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.547 1.673 . . . . 0.0 113.23 168.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 40.16 30.55 0.07 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 128.225 2.61 . . . . 0.0 117.141 168.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.7 -31.38 37.67 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.794 1.188 . . . . 0.0 115.514 -164.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.13 -38.34 86.01 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.022 1.729 . . . . 0.0 114.284 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -106.74 -19.98 13.49 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.728 2.011 . . . . 0.0 112.894 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 48.2 t . . . . . 0 CA--C 1.547 0.846 0 C-N-CA 126.684 1.994 . . . . 0.0 112.425 174.962 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.643 0 N-CA-C 112.689 0.625 . . . . 0.0 112.689 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.05 -51.91 25.5 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.371 1.068 . . . . 0.0 113.223 167.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.86 -39.73 1.68 Allowed 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.447 2.098 . . . . 0.0 113.763 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER 61.1 -55.05 0.1 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 128.251 2.62 . . . . 0.0 115.956 -176.377 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -158.92 158.72 33.89 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.3 2.24 . . . . 0.0 110.809 174.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -67.79 -39.06 84.06 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 112.923 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -160.03 -34.71 0.06 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.934 1.694 . . . . 0.0 113.391 -177.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.5 m -68.44 -30.17 68.98 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -171.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 m 53.2 22.63 2.72 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 170.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -134.82 6.06 3.4 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.298 1.039 . . . . 0.0 113.45 177.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 -141.02 154.93 46.23 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.971 1.708 . . . . 0.0 112.091 -164.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -72.07 -18.01 77.56 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 116.374 1.31 . . . . 0.0 116.374 -169.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.22 95.82 0.79 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 118.448 1.124 . . . . 0.0 111.921 172.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.32 178.15 0.57 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.138 1.375 . . . . 0.0 112.688 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.83 -64.56 0.48 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.149 1.779 . . . . 0.0 114.323 -170.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -74.67 -15.46 60.8 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.897 1.679 . . . . 0.0 115.075 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.26 -20.02 30.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.704 1.202 . . . . 0.0 111.773 178.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.98 154.09 90.86 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 124.18 0.992 . . . . 0.0 112.243 157.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo . . . . . 0 CA--C 1.54 0.796 0 C-N-CA 123.317 2.678 . . . . 0.0 111.585 177.188 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.8 mt . . . . . 0 N--CA 1.479 1.002 0 CA-C-O 122.761 1.267 . . . . 0.0 111.407 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.0 mt -101.1 120.03 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.72 1.608 . . . . 0.0 108.728 -174.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 p -62.66 126.82 28.64 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.449 1.022 . . . . 0.0 110.298 -176.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.0 m 46.87 29.02 0.93 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -175.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 t80 55.03 30.89 15.04 Favored 'General case' 0 CA--C 1.552 1.058 0 C-N-CA 126.704 2.002 . . . . 0.0 115.195 -172.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 91.4 m -73.87 106.63 5.68 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.545 1.538 . . . . 0.0 112.783 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.44 -151.28 50.55 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.538 -0.726 . . . . 0.0 113.951 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -105.12 139.62 39.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.669 1.188 . . . . 0.0 110.202 170.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.3 t -55.17 -27.34 45.03 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -172.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.89 -35.3 22.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -99.53 -13.02 19.64 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -63.9 130.27 43.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.849 1.66 . . . . 0.0 111.745 174.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -147.24 149.42 32.86 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.841 1.256 . . . . 0.0 109.804 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.4 p -64.97 -21.11 66.79 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -163.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.9 ptt180 -73.78 -19.41 60.78 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -108.5 -35.66 6.42 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.921 1.688 . . . . 0.0 112.323 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.502 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.449 1.6 t 47.72 -114.45 0.0 OUTLIER Pre-proline 0 CA--C 1.563 1.454 0 C-N-CA 128.063 2.545 . . . . 0.0 113.973 174.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.502 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 56.0 Cg_endo -79.99 -11.52 13.64 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 CA-C-N 124.491 2.64 . . . . 0.0 116.276 -167.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -83.48 54.87 2.98 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.212 1.405 . . . . 0.0 114.321 -165.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.07 -11.46 0.75 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 177.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 mm -119.12 11.55 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 125.565 1.546 . . . . 0.0 112.56 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.442 ' HA ' ' HA ' ' A' ' 50' ' ' GLU . 8.3 pt20 -133.06 160.06 38.27 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -173.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -65.57 165.34 12.46 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.638 1.175 . . . . 0.0 111.61 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 m -71.48 -31.29 66.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -134.61 19.74 3.59 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.06 1.744 . . . . 0.0 113.012 -176.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.0 t -153.13 169.13 23.73 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 126.632 1.973 . . . . 0.0 109.881 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -70.04 -174.43 0.78 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 125.335 1.454 . . . . 0.0 113.822 178.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 44' ' ' GLN . 1.5 mp0 -40.59 128.29 2.49 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.406 2.282 . . . . 0.0 114.967 -172.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m -66.85 -7.88 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 O-C-N 120.953 -1.092 . . . . 0.0 112.374 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 -15.51 31.18 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.928 1.251 . . . . 0.0 114.848 167.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.91 -178.12 6.5 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.289 1.544 . . . . 0.0 114.333 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.6 173.31 2.82 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 118.237 2.68 . . . . 0.0 118.237 -158.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 44.19 95.74 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.834 3.254 . . . . 0.0 115.114 161.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.5 m 61.46 22.06 12.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 52.72 72.52 0.41 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.916 1.286 . . . . 0.0 111.024 -167.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 2.0 t . . . . . 0 CA--C 1.553 1.095 0 C-N-CA 128.186 2.594 . . . . 0.0 112.237 -162.861 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p . . . . . 0 N--CA 1.476 0.831 0 CA-C-O 121.167 0.508 . . . . 0.0 111.593 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -87.1 -12.03 48.34 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 46.2 m -84.18 150.62 25.37 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.29 1.036 . . . . 0.0 112.169 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.5 t -78.97 -36.04 42.06 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.828 1.251 . . . . 0.0 113.601 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -93.9 -9.36 37.45 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -172.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 72.2 m -89.28 148.93 23.3 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.022 0.929 . . . . 0.0 112.325 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -79.48 169.35 18.18 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.542 1.137 . . . . 0.0 111.081 166.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.0 m -82.48 26.92 0.53 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.369 1.068 . . . . 0.0 113.528 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.8 tppt? -150.1 162.06 41.15 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.119 2.168 . . . . 0.0 109.805 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 55.84 39.22 30.69 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.471 1.509 . . . . 0.0 113.113 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -119.6 160.49 22.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.646 1.578 . . . . 0.0 111.924 -174.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 p -152.5 158.86 43.16 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.403 1.081 . . . . 0.0 113.067 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -69.28 171.03 9.13 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.968 1.307 . . . . 0.0 112.912 -176.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 57.87 37.65 26.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.993 1.317 . . . . 0.0 112.826 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? 59.18 60.39 2.4 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.134 2.174 . . . . 0.0 112.851 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.6 p . . . . . 0 CA--C 1.556 1.206 0 C-N-CA 127.768 2.427 . . . . 0.0 116.895 171.403 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.9 p30 . . . . . 0 CA--C 1.549 0.911 0 N-CA-C 113.647 0.98 . . . . 0.0 113.647 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.311 0.5 OUTLIER 55.83 19.31 3.42 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 170.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -89.84 147.65 23.66 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.216 0.916 . . . . 0.0 111.595 166.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -135.95 -178.87 5.33 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.78 1.632 . . . . 0.0 113.233 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 68.67 134.43 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 129.004 2.922 . . . . 0.0 115.131 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -147.38 97.68 4.04 Favored Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 127.415 2.286 . . . . 0.0 108.941 -178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.63 -14.86 7.62 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.951 2.434 . . . . 0.0 113.952 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -76.72 152.14 35.81 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.529 1.132 . . . . 0.0 113.419 -175.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -139.01 160.82 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.691 1.597 . . . . 0.0 111.415 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.2 mt -111.39 86.24 6.43 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 125.921 1.689 . . . . 0.0 109.097 173.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -83.57 170.07 11.84 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.613 2.875 . . . . 0.0 113.905 -167.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 . . . . . 0 CA--C 1.548 0.894 0 C-N-CA 126.021 1.728 . . . . 0.0 115.254 170.252 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 12.7 t . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 111.59 0.218 . . . . 0.0 111.59 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -144.2 -43.17 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -80.1 -30.9 39.25 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -164.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 24.2 p -149.6 139.71 22.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.886 1.274 . . . . 0.0 110.782 -176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 67.14 20.83 71.42 Favored Glycine 0 CA--C 1.541 1.665 0 O-C-N 121.415 -0.803 . . . . 0.0 114.459 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 61.07 -134.08 48.98 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-N 118.088 0.944 . . . . 0.0 112.168 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -92.26 -1.41 57.12 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.866 1.266 . . . . 0.0 114.084 169.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.25 -156.35 27.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.626 1.584 . . . . 0.0 115.355 -173.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.7 p80 45.53 -157.14 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.593 2.757 . . . . 0.0 115.516 -178.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -71.61 28.76 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.951 1.701 . . . . 0.0 113.097 168.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . 0.444 ' HA2' ' SG ' ' A' ' 121' ' ' CYS . . . -52.36 -24.52 16.82 Favored Glycine 0 CA--C 1.541 1.69 0 C-N-CA 127.962 2.696 . . . . 0.0 115.58 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -67.04 -40.25 87.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.267 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -98.09 -17.57 19.02 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.318 1.847 . . . . 0.0 113.176 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . 0.444 ' SG ' ' HA2' ' A' ' 118' ' ' GLY . 1.8 p . . . . . 0 CA--C 1.551 0.992 0 N-CA-C 115.033 1.494 . . . . 0.0 115.033 -174.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.628 0 N-CA-C 113.082 0.771 . . . . 0.0 113.082 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.72 37.86 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.747 1.219 . . . . 0.0 113.58 165.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -46.16 0.36 Allowed 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.044 1.829 . . . . 0.0 114.029 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt 41.71 -163.31 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.95 1.3 . . . . 0.0 112.816 -149.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 m -58.52 150.13 23.58 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.08 -1.637 . . . . 0.0 113.129 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 38.4 t30 -64.43 -44.95 89.6 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.691 0.797 . . . . 0.0 112.277 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -121.72 -58.25 1.76 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.63 1.172 . . . . 0.0 112.249 -167.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.5 p -79.48 -166.37 0.95 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.684 0.793 . . . . 0.0 110.931 167.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 62.3 p -134.61 23.47 3.68 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -69.19 171.66 8.06 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.774 -0.579 . . . . 0.0 111.631 168.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.58 149.32 39.85 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.787 1.235 . . . . 0.0 111.964 168.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 122.03 -93.28 0.5 Allowed Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.093 1.33 . . . . 0.0 110.716 -169.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.08 74.8 2.95 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 121.956 0.884 . . . . 0.0 113.047 176.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.426 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.03 173.86 1.0 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.865 1.266 . . . . 0.0 113.008 173.583 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.1 OUTLIER -16.03 -73.63 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.776 2.83 . . . . 0.0 115.44 -171.589 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -67.46 -26.26 66.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.309 1.843 . . . . 0.0 115.65 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.94 -20.52 24.39 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.201 1.8 . . . . 0.0 112.828 176.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -56.92 -40.93 88.64 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.243 1.817 . . . . 0.0 114.56 -173.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo . . . . . 0 C--N 1.354 0.819 0 C-N-CA 122.865 2.377 . . . . 0.0 112.474 173.026 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.5 mt . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.16 155.65 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 126.8 2.04 . . . . 0.0 110.553 -176.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 73.9 m -87.05 1.05 54.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.093 1.357 . . . . 0.0 113.853 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.0 m 63.66 126.13 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.343 2.257 . . . . 0.0 114.065 -163.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 40.2 t80 57.83 -21.09 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 127.412 2.285 . . . . 0.0 116.012 -164.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.0 t -110.82 138.15 47.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.378 2.271 . . . . 0.0 111.036 178.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.55 -178.14 51.47 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.047 1.308 . . . . 0.0 114.864 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -140.03 144.66 37.01 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.51 1.524 . . . . 0.0 110.229 171.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.0 t -69.98 -16.04 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -172.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.2 -21.69 15.42 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.663 1.585 . . . . 0.0 114.006 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.83 108.61 4.03 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.533 1.133 . . . . 0.0 111.841 -175.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -148.4 143.19 26.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.871 1.269 . . . . 0.0 110.799 -178.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -135.99 105.47 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 -167.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.2 m 54.76 -160.01 0.17 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.533 1.533 . . . . 0.0 114.527 167.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.6 2.07 23.75 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 166.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -80.13 -40.54 27.23 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.71 1.204 . . . . 0.0 111.733 177.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.9 m 63.85 166.04 0.11 Allowed Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 128.121 2.568 . . . . 0.0 114.83 -178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -118.42 -153.78 0.0 OUTLIER 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.481 2.788 . . . . 0.0 112.814 -160.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -66.95 -15.58 63.79 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.064 1.746 . . . . 0.0 115.446 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 58.35 -166.39 0.16 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.008 1.723 . . . . 0.0 115.148 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.3 mt -83.43 52.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.123 1.769 . . . . 0.0 112.095 -163.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -150.32 148.83 29.31 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.579 1.552 . . . . 0.0 113.661 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.3 t -81.13 133.22 35.43 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.88 2.072 . . . . 0.0 109.503 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.7 p -67.16 -21.6 65.8 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -77.09 -26.22 53.14 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.917 1.287 . . . . 0.0 113.059 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.7 p -153.56 -92.91 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -136.67 -164.55 1.59 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.52 1.928 . . . . 0.0 111.772 -166.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -45.71 139.47 4.01 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.702 1.601 . . . . 0.0 113.946 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.0 m -64.83 -8.61 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 121.176 -0.952 . . . . 0.0 112.585 173.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.88 -8.14 2.02 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 127.159 2.314 . . . . 0.0 115.754 171.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -147.41 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.921 1.688 . . . . 0.0 112.445 163.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -52.64 126.16 18.87 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.814 -1.179 . . . . 0.0 112.732 176.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.4 mmt-85 -66.41 160.24 25.25 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.897 2.079 . . . . 0.0 112.852 -171.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m 55.71 36.66 27.67 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.441 1.096 . . . . 0.0 113.076 -166.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.271 10.6 pt20 42.12 90.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.941 2.896 . . . . 0.0 115.843 -178.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.7 t . . . . . 0 CA--C 1.556 1.201 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 164.377 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.509 HG12 ' H ' ' A' ' 67' ' ' CYS . 21.6 t . . . . . 0 N--CA 1.476 0.827 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -77.81 -0.39 26.99 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.509 ' H ' HG12 ' A' ' 65' ' ' VAL . 80.8 m -124.63 165.58 17.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.965 1.706 . . . . 0.0 111.443 170.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.2 p -127.73 -28.48 2.71 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.061 2.144 . . . . 0.0 110.852 -159.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.4 -37.79 87.16 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.114 1.766 . . . . 0.0 110.501 161.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.9 m -82.79 129.55 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.01 1.324 . . . . 0.0 111.677 -173.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -114.59 14.57 17.69 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.488 1.515 . . . . 0.0 113.49 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.3 t -140.95 161.79 37.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.421 1.888 . . . . 0.0 112.401 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.6 -18.66 59.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.0 1.32 . . . . 0.0 114.262 173.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -79.18 147.05 32.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.085 0.954 . . . . 0.0 111.074 168.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -142.65 146.3 34.33 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.506 1.122 . . . . 0.0 111.878 -175.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.8 m -133.85 105.25 6.67 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -168.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -66.03 -17.35 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.144 1.377 . . . . 0.0 114.242 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -85.74 -9.77 56.61 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.077 0.951 . . . . 0.0 113.389 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -119.81 -43.6 2.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.533 1.533 . . . . 0.0 113.792 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 t . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -171.038 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.8 t0 . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 111.928 0.344 . . . . 0.0 111.928 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -110.97 144.2 40.44 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.574 1.549 . . . . 0.0 112.461 -175.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -134.45 138.94 45.16 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.241 1.416 . . . . 0.0 111.481 176.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -154.07 159.65 41.63 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.1 1.76 . . . . 0.0 112.416 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -114.14 167.11 10.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.628 1.571 . . . . 0.0 112.758 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -132.6 134.9 25.29 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.785 1.634 . . . . 0.0 112.089 -176.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -80.85 -177.54 3.81 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.371 3.381 . . . . 0.0 113.124 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -64.55 160.86 18.6 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 113.304 175.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.07 143.15 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 126.42 1.888 . . . . 0.0 108.778 166.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 146.34 99.02 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -173.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.41 140.65 9.7 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.336 2.69 . . . . 0.0 112.788 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.8 p90 . . . . . 0 CA--C 1.548 0.867 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 172.244 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . 0.426 ' HB2' ' H ' ' A' ' 115' ' ' GLY . 2.9 t . . . . . 0 CA--C 1.548 0.883 0 CA-C-O 121.333 0.587 . . . . 0.0 112.011 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -58.93 -18.21 31.53 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -168.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -62.63 -29.63 70.77 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.492 1.517 . . . . 0.0 114.802 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 22.8 p -150.68 -2.07 0.37 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.63 -169.09 46.59 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.809 1.195 . . . . 0.0 113.279 -171.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.58 0.64 87.81 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.289 0.947 . . . . 0.0 115.088 -174.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt 28.87 99.06 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 129.849 3.26 . . . . 0.0 116.256 170.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . 0.426 ' H ' ' HB2' ' A' ' 108' ' ' CYS . . . 98.06 3.9 57.79 Favored Glycine 0 CA--C 1.534 1.255 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -91.51 121.4 33.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.991 . . . . 0.0 112.008 169.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 38.73 35.63 0.12 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.656 2.382 . . . . 0.0 115.274 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.32 -33.17 52.46 Favored Glycine 0 N--CA 1.476 1.307 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 -150.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.35 -48.64 49.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.242 1.417 . . . . 0.0 113.282 177.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -77.28 -26.82 52.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.142 1.377 . . . . 0.0 112.269 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 8.1 t . . . . . 0 CA--C 1.551 1.018 0 C-N-CA 126.271 1.828 . . . . 0.0 113.382 -179.986 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.749 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -86.66 -51.03 0.46 Allowed Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.344 1.457 . . . . 0.0 113.404 158.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.15 -31.52 7.67 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 123.032 2.488 . . . . 0.0 115.314 -173.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.264 1.4 tmmt? 62.25 -60.93 0.12 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 128.115 2.566 . . . . 0.0 117.011 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -164.54 152.58 12.23 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.738 2.815 . . . . 0.0 109.54 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -68.53 -34.39 75.78 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -144.92 -39.98 0.25 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.254 1.421 . . . . 0.0 113.223 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.6 p -88.0 -156.4 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.731 1.612 . . . . 0.0 111.364 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -146.25 143.78 29.42 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -172.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 58.71 46.21 14.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.752 2.021 . . . . 0.0 115.004 160.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -126.54 14.25 7.6 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.979 1.711 . . . . 0.0 113.858 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.62 -41.73 1.92 Allowed Glycine 0 N--CA 1.477 1.39 0 C-N-CA 125.543 1.544 . . . . 0.0 115.704 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.54 84.4 0.43 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.265 1.426 . . . . 0.0 111.935 172.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.501 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -63.44 -179.66 0.36 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.678 1.591 . . . . 0.0 113.529 176.518 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.03 -68.08 0.06 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 127.171 2.189 . . . . 0.0 114.97 -171.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -73.96 -22.57 59.59 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.339 1.856 . . . . 0.0 115.386 -179.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.15 -26.92 26.53 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.58 1.552 . . . . 0.0 112.339 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.44 -50.85 83.81 Favored Pre-proline 0 CA--C 1.546 0.798 0 C-N-CA 125.789 1.636 . . . . 0.0 114.86 -173.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo . . . . . 0 C--N 1.355 0.905 0 C-N-CA 121.86 1.706 . . . . 0.0 112.014 -177.472 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.1 mt . . . . . 0 N--CA 1.474 0.756 0 CA-C-O 122.344 1.069 . . . . 0.0 110.787 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.2 mt -135.25 146.4 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.22 2.208 . . . . 0.0 109.285 172.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.1 t -71.16 125.55 27.23 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.344 0.658 . . . . 0.0 111.091 173.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 10.0 t -65.63 127.25 31.14 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -164.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 50.51 31.74 5.9 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.146 1.778 . . . . 0.0 114.329 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.8 t -135.39 -21.48 1.56 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.625 1.17 . . . . 0.0 113.868 -167.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.96 170.7 37.7 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.593 1.092 . . . . 0.0 113.13 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -100.96 158.6 15.87 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.557 1.543 . . . . 0.0 110.763 170.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.8 t -59.95 -31.28 69.72 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -100.13 -7.69 24.55 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.901 1.28 . . . . 0.0 113.705 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -149.21 87.57 1.54 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.496 1.119 . . . . 0.0 112.27 -173.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . 0.404 ' CD2' ' H ' ' A' ' 35' ' ' TYR . 46.9 t-80 -153.34 174.6 14.12 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.03 2.132 . . . . 0.0 110.009 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.404 ' H ' ' CD2' ' A' ' 34' ' ' HIS 0.297 1.7 p90 59.06 -30.24 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 131.157 3.783 . . . . 0.0 117.994 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 86.6 p -60.83 163.56 5.59 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.487 1.039 . . . . 0.0 111.423 162.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.9 ttt-85 54.98 24.72 6.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.587 1.155 . . . . 0.0 112.508 -164.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 46.24 96.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.043 2.537 . . . . 0.0 114.263 -167.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.433 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.431 6.4 t 73.18 -105.02 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.236 0 C-N-CA 127.984 2.514 . . . . 0.0 115.602 177.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.433 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 61.2 Cg_endo -66.75 138.96 50.79 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.695 2.264 . . . . 0.0 113.773 -166.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -143.62 -29.19 0.52 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -171.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.46 174.67 13.6 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -173.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.276 2.7 mt 64.15 63.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 127.48 2.312 . . . . 0.0 114.174 169.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -128.83 168.74 15.47 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.478 1.511 . . . . 0.0 113.095 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 83.9 m -70.91 163.48 27.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.792 0.806 . . . . 0.0 112.237 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m -74.32 -24.02 59.14 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -120.64 -5.65 9.72 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.6 p -148.53 158.72 44.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.579 1.151 . . . . 0.0 111.995 178.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -74.37 137.92 43.08 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.562 1.145 . . . . 0.0 113.202 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.05 155.41 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 128.538 2.735 . . . . 0.0 115.203 -172.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m -88.4 -10.52 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 O-C-N 120.571 -1.33 . . . . 0.0 111.164 157.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.06 40.26 0.7 Allowed Glycine 0 CA--C 1.537 1.449 0 C-N-CA 128.593 2.996 . . . . 0.0 117.174 -164.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.06 -138.03 0.22 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.533 2.333 . . . . 0.0 111.33 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -51.92 121.91 7.46 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 124.957 1.303 . . . . 0.0 113.194 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 47.75 23.28 0.42 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.062 2.545 . . . . 0.0 114.562 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.28 77.3 p 44.63 27.99 0.29 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.807 2.443 . . . . 0.0 114.906 -166.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -145.67 -13.33 0.5 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -171.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.315 1.7 t . . . . . 0 CA--C 1.557 1.222 0 N-CA-C 118.987 2.958 . . . . 0.0 118.987 173.237 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.452 HG22 ' H ' ' A' ' 67' ' ' CYS . 1.9 p . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -94.77 -4.29 47.56 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.986 0.915 . . . . 0.0 113.36 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.452 ' H ' HG22 ' A' ' 65' ' ' VAL . 78.0 m -112.58 1.15 15.69 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.663 1.585 . . . . 0.0 114.879 -166.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.263 11.0 t 55.7 -46.72 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 129.292 3.037 . . . . 0.0 118.266 -171.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 pp -90.92 -18.04 25.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.958 1.703 . . . . 0.0 114.23 -176.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.05 166.63 23.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.153 0.981 . . . . 0.0 112.265 177.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.18 150.34 43.85 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.487 -0.758 . . . . 0.0 111.921 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.2 p -74.92 28.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 128.461 2.705 . . . . 0.0 116.064 -176.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -122.09 156.35 33.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.508 1.923 . . . . 0.0 110.48 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -65.26 116.42 6.58 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.728 0.811 . . . . 0.0 110.87 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 49.6 p-80 -137.71 2.82 2.45 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.131 1.772 . . . . 0.0 112.861 -174.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.7 m -81.28 34.61 0.37 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.029 1.731 . . . . 0.0 115.568 -156.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -54.15 139.16 36.31 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.274 1.43 . . . . 0.0 112.224 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 45.92 45.98 12.09 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.905 1.282 . . . . 0.0 113.522 -170.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.7 mtm180 58.26 38.75 26.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.374 1.87 . . . . 0.0 113.45 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.7 t . . . . . 0 CA--C 1.551 1.01 0 C-N-CA 129.085 2.954 . . . . 0.0 113.394 -165.176 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.7 t0 . . . . . 0 N--CA 1.474 0.746 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -78.65 136.19 37.4 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.519 1.128 . . . . 0.0 111.88 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -103.42 157.72 16.84 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.634 1.173 . . . . 0.0 113.229 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -78.3 128.56 33.88 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.27 1.028 . . . . 0.0 111.024 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -133.82 -0.93 3.09 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -176.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -88.07 147.91 41.78 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.522 1.129 . . . . 0.0 112.15 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.88 155.03 51.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.399 2.733 . . . . 0.0 114.204 175.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -149.65 -172.8 4.24 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.251 1.82 . . . . 0.0 111.07 177.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.5 p -53.05 144.32 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.068 1.347 . . . . 0.0 112.886 177.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.63 159.73 82.56 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.352 1.061 . . . . 0.0 112.51 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -59.42 -23.01 68.6 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.575 2.85 . . . . 0.0 115.064 177.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 60.0 t80 . . . . . 0 CA--C 1.537 0.467 0 C-N-CA 125.531 1.532 . . . . 0.0 110.244 172.678 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 43.5 t . . . . . 0 CA--C 1.535 0.386 0 CA-C-O 121.513 0.673 . . . . 0.0 111.174 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -70.63 -22.69 62.5 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.103 0.961 . . . . 0.0 113.538 -178.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -83.0 -19.62 36.65 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -171.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 31.5 p -150.08 10.12 0.69 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.07 3.71 85.21 Favored Glycine 0 CA--C 1.537 1.443 0 O-C-N 121.033 -1.042 . . . . 0.0 115.199 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -81.4 -159.76 23.95 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.758 1.171 . . . . 0.0 113.874 176.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.36 169.07 25.56 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 112.272 176.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 70.31 22.3 77.53 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 117.055 1.582 . . . . 0.0 117.055 158.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . 0.414 ' C ' ' H ' ' A' ' 118' ' ' GLY . 1.7 p80 -138.81 -165.45 1.83 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.845 1.323 . . . . 0.0 112.145 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -66.04 30.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.259 1.823 . . . . 0.0 113.998 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -53.42 -25.75 28.04 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 128.232 2.825 . . . . 0.0 114.869 -178.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.9 -40.24 94.75 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.298 1.839 . . . . 0.0 113.533 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -111.61 -15.35 13.49 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.056 1.742 . . . . 0.0 113.027 -172.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 1.6 p . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 121.809 0.814 . . . . 0.0 112.698 178.022 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 120.253 0.073 . . . . 0.0 110.982 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.73 -48.31 93.82 Favored Pre-proline 0 CA--C 1.551 1.017 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 170.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -41.47 0.54 Allowed 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.63 2.22 . . . . 0.0 113.988 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? 59.01 -54.03 0.05 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 128.778 2.831 . . . . 0.0 116.122 -171.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 167.95 28.94 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.828 2.451 . . . . 0.0 111.703 175.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -74.48 -34.03 63.0 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -153.89 -47.32 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.966 1.306 . . . . 0.0 112.879 -175.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.9 p -79.06 -164.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.284 1.034 . . . . 0.0 111.96 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 t -139.15 29.26 2.25 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -162.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -94.83 156.33 16.41 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.966 1.306 . . . . 0.0 111.512 175.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -76.29 161.25 28.9 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.17 1.788 . . . . 0.0 112.49 178.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.22 -11.73 41.96 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.652 1.821 . . . . 0.0 117.652 162.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.253 0.6 OUTLIER -134.82 72.6 1.46 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.591 1.696 . . . . 0.0 111.744 173.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.75 177.9 0.1 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.129 2.172 . . . . 0.0 113.858 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.24 -68.84 0.06 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 127.184 2.194 . . . . 0.0 115.271 -173.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -75.5 -18.54 59.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -92.09 -21.97 20.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.837 1.655 . . . . 0.0 113.114 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.1 t -56.97 -43.66 99.49 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.58 1.552 . . . . 0.0 114.934 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo . . . . . 0 C--N 1.355 0.9 0 C-N-CA 122.519 2.146 . . . . 0.0 117.044 -168.937 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.6 tt . . . . . 0 CA--C 1.546 0.815 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mt -104.85 129.62 57.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.421 1.888 . . . . 0.0 109.414 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 p -75.95 133.44 40.47 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.416 -0.803 . . . . 0.0 110.375 168.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 p -57.71 120.61 8.67 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.658 1.583 . . . . 0.0 113.774 -164.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 55.3 -13.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.358 2.663 . . . . 0.0 116.984 -171.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -87.63 46.34 1.37 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 110.941 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.23 159.73 10.24 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 120.594 -1.316 . . . . 0.0 114.864 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.58 134.14 53.05 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.034 1.333 . . . . 0.0 109.524 163.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.7 t -66.77 -9.54 37.94 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -162.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -104.08 -10.27 18.14 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.278 1.431 . . . . 0.0 114.519 172.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.94 -17.91 8.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.043 1.737 . . . . 0.0 113.682 -174.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -87.47 145.07 26.42 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.833 1.653 . . . . 0.0 112.922 -173.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -150.66 155.43 39.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.504 1.522 . . . . 0.0 109.855 174.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.1 p -61.43 -30.26 70.46 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -173.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.6 mtp-105 -82.79 -28.65 30.15 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.145 1.378 . . . . 0.0 112.915 171.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -85.94 -9.35 57.03 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.314 1.446 . . . . 0.0 113.448 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.5 t -17.51 -61.87 0.04 OUTLIER Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 130.558 3.543 . . . . 0.0 117.3 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -63.57 -21.76 70.54 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.757 2.305 . . . . 0.0 115.982 -174.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -83.93 112.1 19.85 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.803 1.183 . . . . 0.0 110.165 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.77 -155.8 0.66 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.838 1.255 . . . . 0.0 112.331 -159.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.5 87.29 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 124.709 1.204 . . . . 0.0 109.511 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -128.38 160.37 32.45 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.181 1.792 . . . . 0.0 113.154 -171.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.62 -4.11 35.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.379 2.271 . . . . 0.0 113.63 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 48.2 m 64.66 -28.75 0.1 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 128.102 2.561 . . . . 0.0 117.471 -171.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -124.45 3.84 8.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.155 1.782 . . . . 0.0 113.71 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.3 t -154.44 47.3 0.58 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.896 1.278 . . . . 0.0 111.031 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 49.39 -159.11 0.06 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.864 1.266 . . . . 0.0 114.203 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' H ' ' A' ' 52' ' ' GLY . 21.0 tt0 -48.17 140.17 7.59 Favored 'General case' 0 CA--C 1.552 1.054 0 O-C-N 120.018 -1.677 . . . . 0.0 113.193 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.4 m -63.73 -23.21 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 119.742 -1.849 . . . . 0.0 111.507 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . 0.463 ' H ' ' HG2' ' A' ' 50' ' ' GLU . . . -81.13 -13.94 80.02 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.962 1.744 . . . . 0.0 116.294 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -79.86 -17.7 52.55 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.098 1.949 . . . . 0.0 115.152 -168.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -131.74 144.16 50.77 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.904 1.282 . . . . 0.0 110.922 169.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -58.84 152.8 18.43 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.392 1.477 . . . . 0.0 112.395 -173.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.7 m 58.91 40.81 22.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 113.175 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.275 18.7 pt20 48.14 49.16 17.82 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.809 2.044 . . . . 0.0 114.454 -175.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 73.7 m . . . . . 0 CA--C 1.552 1.02 0 C-N-CA 128.362 2.665 . . . . 0.0 115.762 -170.595 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.2 p . . . . . 0 N--CA 1.475 0.795 0 CA-C-O 120.642 0.258 . . . . 0.0 110.688 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 8.5 tm0? -84.03 24.62 0.9 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.039 1.336 . . . . 0.0 113.298 -173.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.8 m -137.05 154.36 50.38 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.783 1.633 . . . . 0.0 110.701 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -70.5 -177.37 1.47 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 122.098 -0.376 . . . . 0.0 110.588 149.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.305 2.9 pp 55.25 9.92 0.39 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.865 2.466 . . . . 0.0 116.805 173.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 46.7 m -116.43 164.21 14.89 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.577 1.551 . . . . 0.0 114.022 -171.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 59.78 1.55 0.31 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.989 2.916 . . . . 0.0 118.353 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.0 p -72.67 -32.71 66.02 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.124 0.969 . . . . 0.0 112.137 156.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -139.25 -179.03 5.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.011 2.925 . . . . 0.0 110.23 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -54.97 148.44 13.51 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.424 1.49 . . . . 0.0 113.107 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -85.11 114.83 22.53 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.96 0.904 . . . . 0.0 111.882 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.9 m -77.25 78.04 3.78 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.443 1.497 . . . . 0.0 112.759 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -57.15 -28.27 62.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.336 1.455 . . . . 0.0 114.1 -174.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.06 -9.91 59.76 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -131.72 -31.28 1.56 Allowed 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -169.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 49.8 t . . . . . 0 CA--C 1.55 0.952 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -175.981 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.603 0.964 . . . . 0.0 113.603 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -102.23 14.23 32.53 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -170.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -67.53 122.41 17.94 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.421 -1.424 . . . . 0.0 111.243 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -83.02 -26.92 30.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 57.64 -19.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 128.68 2.792 . . . . 0.0 118.295 -179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 46.4 71.69 1.49 Allowed Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 128.256 2.623 . . . . 0.0 113.587 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -63.6 150.4 88.58 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.284 1.99 . . . . 0.0 110.929 168.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -131.16 154.29 48.51 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.38 1.472 . . . . 0.0 111.735 -176.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.5 m -110.86 13.35 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.889 1.676 . . . . 0.0 112.906 176.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.5 tp -66.96 -30.95 3.5 Favored Pre-proline 0 CA--C 1.553 1.058 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 172.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -58.94 162.1 14.15 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 122.862 2.375 . . . . 0.0 113.779 171.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.5 t80 . . . . . 0 CA--C 1.545 0.766 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -177.261 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 p . . . . . 0 CA--C 1.546 0.814 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -130.14 -41.42 1.27 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.621 1.168 . . . . 0.0 113.317 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -79.74 4.19 17.05 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.736 1.214 . . . . 0.0 113.524 175.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 36.0 t -139.01 145.54 39.79 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.091 2.157 . . . . 0.0 108.785 168.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.25 164.64 40.47 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.559 1.076 . . . . 0.0 115.191 -175.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.5 -13.29 23.09 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.35 1.452 . . . . 0.0 116.269 174.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . 0.278 64.4 pttt 45.92 31.41 1.08 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 127.804 2.442 . . . . 0.0 116.411 172.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.26 -17.07 19.02 Favored Glycine 0 CA--C 1.537 1.443 0 N-CA-C 117.095 1.598 . . . . 0.0 117.095 -168.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -151.53 156.19 40.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.211 1.505 . . . . 0.0 114.508 -166.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 19.3 t80 46.71 33.67 2.2 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.269 2.227 . . . . 0.0 115.33 166.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.74 -14.54 30.03 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.653 1.597 . . . . 0.0 116.73 -166.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.95 -34.49 78.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.575 1.15 . . . . 0.0 113.523 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -141.79 -11.21 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -172.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 46.5 t . . . . . 0 CA--C 1.545 0.783 0 O-C-N 121.017 -1.052 . . . . 0.0 113.374 -174.445 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 112.597 0.592 . . . . 0.0 112.597 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -72.92 -54.63 4.48 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.134 0.974 . . . . 0.0 112.798 172.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -80.42 -27.71 3.3 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.0 2.466 . . . . 0.0 114.132 178.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 tptt 57.61 -67.92 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.31 2.644 . . . . 0.0 115.524 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 36.0 t -166.17 154.88 11.08 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 129.145 2.978 . . . . 0.0 108.675 177.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -67.32 -55.28 14.51 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.85 -1.156 . . . . 0.0 112.747 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -121.13 -58.59 1.79 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.835 0.854 . . . . 0.0 113.056 -168.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.5 p -86.81 -159.05 0.47 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.896 1.279 . . . . 0.0 111.194 172.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 61.4 m -149.9 169.37 21.29 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.606 1.162 . . . . 0.0 113.646 -174.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 61.55 27.11 16.68 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.184 1.793 . . . . 0.0 115.418 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.8 mtp85 -120.3 6.02 10.7 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.343 1.457 . . . . 0.0 114.837 -177.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.51 -33.69 0.98 Allowed Glycine 0 CA--C 1.536 1.377 0 C-N-CA 125.44 1.495 . . . . 0.0 115.71 175.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -71.13 96.29 1.34 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.387 1.094 . . . . 0.0 112.263 175.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.03 179.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 127.186 2.195 . . . . 0.0 113.404 169.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.2 -64.37 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.506 1.522 . . . . 0.0 114.077 -169.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.95 -1.8 41.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.81 1.644 . . . . 0.0 115.29 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -94.53 -26.89 16.23 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.101 1.361 . . . . 0.0 111.166 172.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.5 t -62.81 149.73 88.95 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 125.555 1.542 . . . . 0.0 110.958 173.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo . . . . . 0 CA--C 1.541 0.873 0 C-N-CA 122.748 2.299 . . . . 0.0 115.888 -161.913 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm . . . . . 0 N--CA 1.483 1.176 0 CA-C-O 121.547 0.689 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.5 mm -62.53 136.14 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 125.776 1.631 . . . . 0.0 110.334 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.4 p -69.06 -43.38 74.73 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.178 -0.951 . . . . 0.0 113.562 -173.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.7 p -159.72 171.15 20.05 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 128.808 2.843 . . . . 0.0 108.851 162.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -76.34 37.74 0.17 Allowed 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -173.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.5 p -99.15 -31.54 11.7 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.144 2.177 . . . . 0.0 112.706 167.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 174.41 170.84 38.09 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 115.392 0.917 . . . . 0.0 115.392 -177.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.52 106.92 3.62 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 67.3 -150.09 0.18 Allowed 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 114.577 -1.192 . . . . 0.0 113.496 135.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -92.57 1.49 57.23 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.419 -1.426 . . . . 0.0 113.182 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -86.64 -31.31 21.18 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -173.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.86 157.13 24.5 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.814 0.846 . . . . 0.0 112.351 171.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -115.83 179.21 4.04 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.167 1.387 . . . . 0.0 111.409 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.7 m -69.44 16.67 0.05 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.283 2.233 . . . . 0.0 116.111 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -125.75 -3.47 7.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.962 2.105 . . . . 0.0 113.156 166.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.01 4.7 3.81 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.491 2.316 . . . . 0.0 113.324 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.0 t -47.75 -48.32 60.51 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 125.06 1.344 . . . . 0.0 113.012 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -85.02 80.35 2.14 Favored 'Trans proline' 0 CA--C 1.55 1.317 0 C-N-CA 123.296 2.664 . . . . 0.0 112.512 167.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -151.99 153.39 33.96 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.04 1.336 . . . . 0.0 112.401 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.24 -31.64 0.1 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.159 2.584 . . . . 0.0 117.202 -175.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 16.2 mm -112.78 55.52 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 126.143 1.777 . . . . 0.0 109.527 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . 0.432 ' HA ' ' C ' ' A' ' 50' ' ' GLU . 5.5 pm0 -140.91 148.29 40.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.525 1.13 . . . . 0.0 112.246 174.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 29.7 p -86.98 167.39 14.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.092 0.957 . . . . 0.0 111.718 170.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.9 t -58.66 133.7 56.13 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt 55.47 19.15 3.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.819 2.048 . . . . 0.0 114.441 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.4 m -130.14 178.51 6.51 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.473 1.909 . . . . 0.0 112.522 -175.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -111.65 -15.91 13.35 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -166.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.432 ' C ' ' HA ' ' A' ' 44' ' ' GLN . 47.4 mt-10 -134.19 167.32 20.89 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.766 2.027 . . . . 0.0 108.996 173.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.6 -11.3 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.408 -1.432 . . . . 0.0 113.99 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.93 140.18 3.04 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 127.153 2.311 . . . . 0.0 109.936 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -125.73 -3.96 7.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.763 1.625 . . . . 0.0 112.525 -176.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -134.53 141.9 46.84 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 126.546 1.938 . . . . 0.0 108.884 163.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.68 47.52 2.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.037 1.735 . . . . 0.0 112.855 178.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 m 64.16 -30.52 0.11 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -139.12 -4.26 1.53 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.826 1.651 . . . . 0.0 114.071 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.292 18.1 p . . . . . 0 CA--C 1.557 1.221 0 C-N-CA 128.789 2.836 . . . . 0.0 116.914 -172.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.9 p . . . . . 0 N--CA 1.476 0.87 0 CA-C-O 120.729 0.299 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -72.4 -17.82 61.77 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . 0.405 ' C ' ' H ' ' A' ' 69' ' ' LEU . 77.0 m -87.11 -28.95 22.2 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 58.1 -36.28 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 127.482 2.313 . . . . 0.0 116.081 -151.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 67' ' ' CYS . 29.3 tp -70.55 -15.68 62.8 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 129.907 3.283 . . . . 0.0 114.12 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.7 t -107.03 156.77 18.39 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.625 1.17 . . . . 0.0 112.587 -170.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -115.52 1.03 13.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.681 1.592 . . . . 0.0 114.418 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.7 t -87.34 147.97 25.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -111.17 2.07 17.6 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.532 2.333 . . . . 0.0 115.115 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -112.75 -8.33 13.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.543 1.937 . . . . 0.0 113.599 -172.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -78.09 165.3 24.16 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -165.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.3 t -69.59 145.66 52.36 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.9 -22.71 65.95 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 127.265 2.226 . . . . 0.0 114.965 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -77.25 33.76 0.16 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 125.117 1.367 . . . . 0.0 112.519 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 46.19 47.47 13.26 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.485 2.314 . . . . 0.0 112.815 -165.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 27.6 p . . . . . 0 CA--C 1.552 1.053 0 C-N-CA 127.707 2.403 . . . . 0.0 116.204 168.262 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.7 t70 . . . . . 0 N--CA 1.478 0.932 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -143.8 159.54 42.33 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.452 1.501 . . . . 0.0 112.004 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.36 -5.88 6.53 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -174.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -138.56 159.67 41.51 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.824 1.25 . . . . 0.0 113.591 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.75 165.08 30.72 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.946 1.699 . . . . 0.0 111.529 175.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.58 146.59 42.4 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.243 1.417 . . . . 0.0 112.273 172.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -64.5 160.59 38.85 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.262 2.642 . . . . 0.0 114.023 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -134.78 157.16 47.45 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.186 1.794 . . . . 0.0 111.477 173.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.6 m -90.28 -10.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 124.918 1.287 . . . . 0.0 114.301 -177.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.9 tp -73.33 -35.15 2.56 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -61.8 148.69 92.53 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.031 2.487 . . . . 0.0 114.578 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 24.7 p90 . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.754 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 57.3 m . . . . . 0 CA--C 1.548 0.902 0 N-CA-C 114.822 1.415 . . . . 0.0 114.822 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 63.42 -26.91 0.07 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 118.132 2.642 . . . . 0.0 118.132 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -133.16 -12.04 2.85 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -176.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 28.4 p -151.26 172.27 16.12 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.348 0.976 . . . . 0.0 112.915 -173.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -62.31 161.29 30.38 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 124.203 0.906 . . . . 0.0 113.695 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.29 172.07 39.58 Favored Glycine 0 CA--C 1.537 1.425 0 CA-C-O 121.677 0.598 . . . . 0.0 112.797 -165.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -125.58 -20.84 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -165.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -171.43 22.18 0.08 OUTLIER Glycine 0 CA--C 1.535 1.337 0 N-CA-C 117.538 1.775 . . . . 0.0 117.538 -175.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -66.97 -51.0 60.53 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 120.183 1.991 . . . . 0.0 112.459 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -135.29 30.52 3.25 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.395 2.278 . . . . 0.0 108.716 161.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -16.25 22.99 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 127.18 2.324 . . . . 0.0 115.258 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -63.26 -37.27 86.6 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.459 1.504 . . . . 0.0 113.542 171.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -141.97 -4.16 1.07 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -166.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.7 p . . . . . 0 CA--C 1.555 1.15 0 O-C-N 120.329 -1.482 . . . . 0.0 114.922 176.047 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.71 0 CA-C-O 120.84 0.353 . . . . 0.0 111.525 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.66 -50.54 71.47 Favored Pre-proline 0 CA--C 1.552 1.027 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 175.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.43 -44.35 0.12 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.023 1.815 . . . . 0.0 113.773 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? 61.48 -55.09 0.11 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 128.047 2.539 . . . . 0.0 114.612 -167.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -153.8 159.83 42.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.656 2.782 . . . . 0.0 111.359 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -76.3 -53.17 8.6 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.614 -0.679 . . . . 0.0 109.945 157.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -134.84 161.54 34.91 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.632 1.973 . . . . 0.0 110.207 176.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . 0.318 14.6 p 47.02 -159.39 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 126.397 1.879 . . . . 0.0 112.967 -161.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -145.43 28.96 1.17 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -163.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -91.29 145.62 24.5 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.287 1.035 . . . . 0.0 112.357 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.19 -28.79 66.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -165.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -81.81 -13.65 79.26 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 116.169 1.227 . . . . 0.0 116.169 -164.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -142.65 81.85 1.75 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.642 1.221 . . . . 0.0 113.437 -169.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.12 -178.33 0.16 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.224 1.41 . . . . 0.0 113.211 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.63 -68.81 0.11 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 126.495 1.918 . . . . 0.0 114.81 -166.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -68.9 -20.63 64.25 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -91.7 -24.53 19.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.746 1.618 . . . . 0.0 113.103 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.7 t -57.06 -43.99 99.58 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.657 1.583 . . . . 0.0 114.83 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo . . . . . 0 CA--C 1.544 1.013 0 C-N-CA 122.554 2.169 . . . . 0.0 115.454 -174.701 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.2 pp . . . . . 0 N--CA 1.481 1.105 0 N-CA-C 113.406 0.891 . . . . 0.0 113.406 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 12.4 pt -83.98 142.34 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.041 1.336 . . . . 0.0 112.774 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.37 101.99 12.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.215 1.006 . . . . 0.0 110.2 171.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m 44.39 49.72 8.07 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.232 1.813 . . . . 0.0 115.681 170.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.9 t80 57.85 32.72 22.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.976 1.71 . . . . 0.0 115.255 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 52.8 t -66.61 -19.73 65.84 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.191 1.396 . . . . 0.0 112.791 170.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -166.58 -171.09 32.3 Favored Glycine 0 CA--C 1.531 1.09 0 O-C-N 120.695 -1.253 . . . . 0.0 114.688 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -88.41 127.92 35.51 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.419 1.087 . . . . 0.0 111.98 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -58.15 -22.54 51.62 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -83.78 -11.47 57.04 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -141.18 -1.32 1.37 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -169.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -83.97 142.8 30.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.82 -1.175 . . . . 0.0 113.345 -175.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -156.45 159.48 38.7 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.074 1.349 . . . . 0.0 111.116 175.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.1 m -60.47 -29.96 69.38 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -169.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.93 4.47 34.76 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 173.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -108.44 -19.05 13.59 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.886 1.674 . . . . 0.0 112.941 176.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 m -14.35 -65.55 0.03 OUTLIER Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 130.198 3.399 . . . . 0.0 117.191 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -67.63 -17.44 48.05 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.927 2.418 . . . . 0.0 115.802 -171.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -100.53 53.43 0.87 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.468 1.507 . . . . 0.0 112.143 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -134.42 -107.67 0.23 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.954 1.302 . . . . 0.0 112.253 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.262 33.4 mt -96.54 22.5 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 125.37 1.468 . . . . 0.0 110.736 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -133.5 153.79 51.35 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.318 -1.489 . . . . 0.0 112.031 165.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 19.7 p -102.17 169.32 8.8 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 112.125 174.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.3 m -59.63 143.33 50.79 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt 58.63 11.02 1.6 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.351 1.86 . . . . 0.0 114.716 -173.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 73.0 m -138.79 174.72 10.23 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.915 1.686 . . . . 0.0 112.843 -170.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -114.5 5.04 15.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.413 1.485 . . . . 0.0 114.088 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -153.2 150.51 29.09 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.472 1.509 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.8 m -77.75 13.64 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.666 -1.271 . . . . 0.0 111.858 168.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.72 -136.29 0.13 Allowed Glycine 0 CA--C 1.531 1.062 0 C-N-CA 127.833 2.635 . . . . 0.0 114.359 -172.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 57.0 -147.38 0.53 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.095 0.958 . . . . 0.0 111.532 -173.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.9 p90 -93.37 176.49 6.37 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.805 1.242 . . . . 0.0 113.764 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -23.36 134.13 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 130.618 3.567 . . . . 0.0 116.133 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.1 m 55.59 47.52 20.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.657 1.583 . . . . 0.0 113.918 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.255 14.4 pt20 50.39 43.86 26.79 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.725 2.01 . . . . 0.0 114.593 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.555 1.138 0 C-N-CA 127.527 2.331 . . . . 0.0 115.267 -171.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 p . . . . . 0 N--CA 1.477 0.909 0 N-CA-C 112.67 0.619 . . . . 0.0 112.67 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.1 pm0 -108.83 -2.41 18.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.476 1.91 . . . . 0.0 114.372 -173.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 57.1 m -77.31 -5.17 48.51 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -163.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.284 10.9 t 59.34 -39.47 0.07 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 129.034 2.934 . . . . 0.0 118.211 -174.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -81.35 -1.96 47.39 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.575 -1.328 . . . . 0.0 113.558 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.3 m -107.84 177.84 4.7 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.719 1.608 . . . . 0.0 111.994 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.9 tptt 68.5 138.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.867 2.067 . . . . 0.0 111.32 -156.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 t 54.95 -171.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.34 -143.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 62.7 mttm 60.91 -8.94 0.07 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 129.047 2.939 . . . . 0.0 116.301 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 83.0 tttt 57.81 111.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 128.302 2.641 . . . . 0.0 112.508 -161.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -76.45 148.73 37.05 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.6 p -133.59 113.95 12.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.916 1.686 . . . . 0.0 110.891 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -66.9 140.05 57.76 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.116 -0.99 . . . . 0.0 111.419 -175.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 60.22 10.18 2.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 126.903 2.081 . . . . 0.0 116.115 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtm180 -130.43 -50.18 1.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.289 1.436 . . . . 0.0 113.14 -175.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 85.0 m . . . . . 0 CA--C 1.554 1.125 0 C-N-CA 128.538 2.735 . . . . 0.0 114.468 -170.749 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.8 t70 . . . . . 0 CA--C 1.541 0.633 0 CA-C-O 120.8 0.333 . . . . 0.0 111.038 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -142.9 154.79 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.276 1.43 . . . . 0.0 111.642 -177.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -136.92 143.69 43.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.258 1.823 . . . . 0.0 111.164 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -132.85 157.9 43.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.881 1.672 . . . . 0.0 112.327 176.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.76 -177.75 2.9 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.196 0.999 . . . . 0.0 112.145 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -57.29 150.83 40.48 Favored Pre-proline 0 N--CA 1.478 0.936 0 C-N-CA 124.011 0.924 . . . . 0.0 111.192 171.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 149.37 88.21 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.355 2.703 . . . . 0.0 113.348 -173.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -69.79 160.62 31.39 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -170.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.2 t -121.72 151.88 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.023 2.129 . . . . 0.0 108.506 169.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 99.1 mt -57.28 142.1 76.27 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 123.803 0.841 . . . . 0.0 112.607 -174.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -77.27 -15.16 16.16 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.302 2.668 . . . . 0.0 113.606 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 125.22 1.408 . . . . 0.0 112.019 -179.974 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.552 1.034 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -63.56 -16.11 59.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 -166.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -63.91 -20.12 65.62 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.181 1.392 . . . . 0.0 114.545 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.1 p -107.63 8.13 28.95 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.638 1.575 . . . . 0.0 113.819 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.51 131.83 1.94 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 126.017 1.77 . . . . 0.0 112.284 -166.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.85 112.99 0.26 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.25 1.405 . . . . 0.0 113.232 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -69.84 -9.3 54.26 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -174.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 179.96 124.08 0.87 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.801 1.191 . . . . 0.0 111.638 170.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -144.16 -46.15 0.26 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.614 0.766 . . . . 0.0 113.045 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -130.3 37.31 3.89 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.23 1.812 . . . . 0.0 109.266 165.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.44 -17.9 27.55 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 126.815 2.15 . . . . 0.0 115.077 -170.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.62 -34.56 67.38 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.497 1.519 . . . . 0.0 113.455 171.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -129.07 -25.26 2.78 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.722 1.609 . . . . 0.0 113.675 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 7.8 t . . . . . 0 CA--C 1.551 1.007 0 C-N-CA 124.619 1.168 . . . . 0.0 113.699 -177.404 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.675 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.36 -51.5 13.13 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 123.957 0.903 . . . . 0.0 112.783 165.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.64 -29.95 2.65 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.811 2.34 . . . . 0.0 114.328 178.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 58.76 -63.78 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.438 2.695 . . . . 0.0 115.962 -175.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -158.11 164.34 36.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 128.07 2.548 . . . . 0.0 110.302 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -68.28 -31.42 70.86 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.997 -1.064 . . . . 0.0 113.171 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.79 -51.02 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.653 1.581 . . . . 0.0 112.466 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 p -91.11 63.07 4.99 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.64 1.576 . . . . 0.0 113.387 -172.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.6 m -35.92 89.46 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.665 3.586 . . . . 0.0 117.387 -172.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -137.67 143.09 41.17 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.998 2.119 . . . . 0.0 108.68 164.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -74.39 158.25 34.24 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -169.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.25 -23.54 23.87 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 125.567 1.556 . . . . 0.0 115.145 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.264 13.9 p-80 -123.9 78.16 1.6 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 123.235 1.493 . . . . 0.0 111.756 173.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.63 -179.54 0.38 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.613 1.965 . . . . 0.0 113.472 174.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.47 -66.55 0.19 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.967 2.107 . . . . 0.0 114.512 -174.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -74.76 -16.49 60.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -94.78 -14.14 24.97 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.374 1.47 . . . . 0.0 113.203 -177.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -64.0 143.54 98.21 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 124.409 1.084 . . . . 0.0 111.607 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo . . . . . 0 CA--C 1.54 0.802 0 C-N-CA 122.862 2.375 . . . . 0.0 115.591 -164.629 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.7 tt . . . . . 0 N--CA 1.47 0.54 0 N-CA-C 114.208 1.188 . . . . 0.0 114.208 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.6 mt 56.04 -74.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 127.642 2.377 . . . . 0.0 112.708 -172.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 38.9 t -156.03 78.71 0.97 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.28 2.632 . . . . 0.0 106.955 172.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m 49.75 51.51 16.38 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 8.8 t80 61.51 42.94 10.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.065 2.146 . . . . 0.0 113.908 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -102.54 172.63 6.75 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.122 1.369 . . . . 0.0 112.374 169.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.93 -171.64 38.33 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.829 1.491 . . . . 0.0 116.829 158.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -123.86 5.82 8.72 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.585 1.554 . . . . 0.0 112.684 174.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.303 5.0 t 53.88 154.71 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.716 2.006 . . . . 0.0 115.133 -150.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.1 t70 59.21 -52.58 0.06 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 129.984 3.314 . . . . 0.0 115.085 -168.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -94.98 67.1 3.08 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.231 2.212 . . . . 0.0 111.021 176.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -147.85 138.66 23.25 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.739 1.615 . . . . 0.0 110.646 177.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -150.75 157.42 42.92 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.928 1.291 . . . . 0.0 110.394 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . 0.442 ' HA ' ' SG ' ' A' ' 39' ' ' CYS . 72.2 p -60.18 -22.04 62.45 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.455 1.902 . . . . 0.0 115.031 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -72.6 -25.93 61.51 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.932 1.293 . . . . 0.0 112.724 173.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -112.95 -34.15 5.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.959 1.303 . . . . 0.0 114.435 -169.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 36' ' ' SER 0.335 64.6 m 36.07 -101.69 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.163 0 C-N-CA 128.354 2.662 . . . . 0.0 116.485 172.856 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -76.48 -17.33 16.47 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.14 1.893 . . . . 0.0 115.124 -165.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.44 -1.83 14.54 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -162.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -20.81 53.55 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.421 1.488 . . . . 0.0 114.659 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.67 64.01 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.476 1.51 . . . . 0.0 109.199 -169.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -170.11 163.72 9.19 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.867 2.067 . . . . 0.0 111.041 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 81.3 m -131.5 173.41 11.13 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.644 1.577 . . . . 0.0 110.282 168.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -78.95 -42.52 26.66 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.009 1.724 . . . . 0.0 114.054 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.44 -27.78 22.51 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.876 1.27 . . . . 0.0 112.493 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 6.6 p -129.59 124.4 33.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.166 1.386 . . . . 0.0 110.995 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -84.39 149.69 25.84 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.226 1.41 . . . . 0.0 114.107 -168.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 62.32 9.8 3.5 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.4 m -134.82 137.29 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.851 1.26 . . . . 0.0 113.437 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.71 160.64 26.63 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.82 1.2 . . . . 0.0 112.474 170.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -75.08 81.05 2.25 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -174.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -136.31 160.3 39.14 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 127.48 2.312 . . . . 0.0 110.872 170.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 146.21 36.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.118 0.485 . . . . 0.0 110.256 169.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 21.2 m 61.67 -2.5 0.26 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -171.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -102.25 -53.51 2.9 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.383 1.073 . . . . 0.0 111.184 170.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.4 m . . . . . 0 CA--C 1.558 1.278 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -178.587 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.9 t . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -96.36 4.88 51.94 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.016 1.726 . . . . 0.0 113.13 -171.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 85.3 m -85.18 -16.21 41.1 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.256 7.1 t 56.8 -46.66 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 129.35 3.06 . . . . 0.0 117.809 -168.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -85.07 -22.62 28.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.455 1.502 . . . . 0.0 113.186 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 58.1 m -82.97 131.09 35.2 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.801 0.841 . . . . 0.0 110.799 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -115.19 2.01 13.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 83.8 p -78.94 169.68 17.84 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.441 1.496 . . . . 0.0 113.43 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -95.71 8.96 41.98 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.497 1.519 . . . . 0.0 114.425 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.05 -148.32 0.38 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.077 2.151 . . . . 0.0 109.783 177.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 44.8 t60 58.01 -123.39 1.49 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.025 1.33 . . . . 0.0 113.292 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t 59.32 -47.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.95 2.5 . . . . 0.0 115.936 -159.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.4 tptp 51.65 40.33 27.05 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.978 2.511 . . . . 0.0 113.86 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 57.08 61.31 2.62 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.958 1.303 . . . . 0.0 113.222 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 61.0 56.08 2.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.192 2.197 . . . . 0.0 114.593 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t . . . . . 0 CA--C 1.556 1.193 0 C-N-CA 126.529 1.932 . . . . 0.0 115.816 164.574 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.3 t70 . . . . . 0 N--CA 1.475 0.785 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.7 t30 61.09 6.66 1.32 Allowed 'General case' 0 CA--C 1.56 1.356 0 N-CA-C 118.008 2.596 . . . . 0.0 118.008 175.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -131.44 -23.22 2.39 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -176.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 85.7 mttt 66.12 149.53 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 130.041 3.336 . . . . 0.0 115.634 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -88.82 156.65 18.82 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.413 1.085 . . . . 0.0 113.11 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -150.98 152.67 31.98 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.487 1.915 . . . . 0.0 111.83 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.87 -15.06 12.14 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.35 2.7 . . . . 0.0 114.358 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt 60.53 -5.52 0.1 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.093 2.557 . . . . 0.0 116.688 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 20.2 m -133.72 145.63 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 127.045 2.138 . . . . 0.0 109.86 166.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -147.6 99.78 3.81 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 123.815 0.846 . . . . 0.0 112.233 -173.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -65.74 148.06 86.34 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.495 2.797 . . . . 0.0 112.295 167.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.5 p90 . . . . . 0 N--CA 1.477 0.882 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 177.734 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 25.1 p . . . . . 0 CA--C 1.545 0.77 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -40.26 -37.16 0.61 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 127.984 2.514 . . . . 0.0 116.31 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -92.81 -12.5 31.01 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -166.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 12.1 p -131.28 179.33 6.09 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.331 1.052 . . . . 0.0 113.245 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -58.84 154.22 28.21 Favored Glycine 0 CA--C 1.538 1.523 0 C-N-CA 124.155 0.883 . . . . 0.0 114.054 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.57 -36.15 1.82 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 125.096 1.332 . . . . 0.0 114.701 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt 45.88 48.56 12.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.571 2.348 . . . . 0.0 113.69 171.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 174.0 17.5 0.02 OUTLIER Glycine 0 CA--C 1.536 1.385 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 -174.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -141.13 144.31 34.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.54 1.67 . . . . 0.0 113.106 -176.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 35.08 40.55 0.06 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 128.202 2.601 . . . . 0.0 116.571 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.23 -19.9 41.23 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 116.225 1.25 . . . . 0.0 116.225 -165.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -78.63 -44.18 24.5 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.097 1.359 . . . . 0.0 113.438 173.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -103.43 -20.75 13.95 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.898 1.679 . . . . 0.0 113.883 -165.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 15.9 p . . . . . 0 CA--C 1.545 0.766 0 C-N-CA 124.742 1.217 . . . . 0.0 114.243 178.667 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.667 0 N-CA-C 112.993 0.738 . . . . 0.0 112.993 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.8 -47.24 62.76 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.436 1.094 . . . . 0.0 113.553 164.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -77.88 -31.44 3.13 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.667 2.245 . . . . 0.0 114.033 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 59.83 -65.99 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 128.278 2.631 . . . . 0.0 114.488 -169.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -160.68 170.15 21.39 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 128.078 2.551 . . . . 0.0 110.746 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -73.82 -31.98 63.5 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.808 -1.183 . . . . 0.0 114.15 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -157.58 -58.72 0.08 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.768 1.227 . . . . 0.0 112.201 -177.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.1 p -77.3 130.7 37.53 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.468 0.707 . . . . 0.0 111.657 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.4 m -81.15 42.37 0.65 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.632 1.716 . . . . 0.0 115.632 -165.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -95.22 150.89 19.73 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.954 1.702 . . . . 0.0 111.45 176.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 ptm85 -76.01 171.56 14.24 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 113.871 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.8 -78.72 1.98 Allowed Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.839 1.209 . . . . 0.0 112.692 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -79.93 85.9 5.51 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -54.69 176.71 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.047 1.739 . . . . 0.0 113.669 168.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.58 -66.19 0.21 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.945 2.098 . . . . 0.0 114.444 -174.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -78.07 -5.46 51.56 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -89.94 -37.4 14.4 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.127 1.371 . . . . 0.0 111.939 175.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.8 t -56.13 -47.58 98.55 Favored Pre-proline 0 CA--C 1.549 0.914 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo . . . . . 0 C--N 1.354 0.859 0 C-N-CA 122.294 1.996 . . . . 0.0 115.473 -164.773 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.6 pp . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.88 148.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 125.204 1.402 . . . . 0.0 110.757 172.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.8 m -68.54 158.58 33.59 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.64 -0.662 . . . . 0.0 112.033 163.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -67.19 105.29 1.67 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.26 1.024 . . . . 0.0 112.492 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.5 t80 61.15 5.2 1.0 Allowed 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 117.999 2.592 . . . . 0.0 117.999 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 20.3 p -106.1 1.14 26.06 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -150.41 154.35 25.59 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.43 1.014 . . . . 0.0 114.937 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -113.44 20.44 16.07 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.887 1.675 . . . . 0.0 113.896 -174.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.277 2.8 t 60.44 -29.46 0.05 Allowed 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 129.608 3.163 . . . . 0.0 118.036 174.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.22 -24.81 27.69 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.506 1.522 . . . . 0.0 113.796 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -132.39 5.67 4.08 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.954 1.302 . . . . 0.0 114.049 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -89.86 148.5 23.13 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.139 -0.975 . . . . 0.0 113.383 -171.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -147.46 132.51 18.24 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.117 0.967 . . . . 0.0 111.725 170.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.9 m -58.7 -26.04 63.49 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.161 1.784 . . . . 0.0 114.677 -173.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -70.7 -21.32 62.58 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.068 1.347 . . . . 0.0 113.744 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -125.14 -19.8 5.05 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.809 1.244 . . . . 0.0 114.313 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.383 63.3 m 47.77 -106.92 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 127.822 2.449 . . . . 0.0 115.602 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -62.33 102.41 0.27 Allowed 'Trans proline' 0 C--N 1.356 0.962 0 CA-C-N 123.503 2.287 . . . . 0.0 113.771 -164.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -135.67 -15.37 1.84 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.662 1.985 . . . . 0.0 113.181 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -133.52 177.52 7.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.891 1.676 . . . . 0.0 111.409 -178.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 76.6 mt 65.1 -76.25 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 127.219 2.208 . . . . 0.0 111.687 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -59.54 162.82 4.63 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.643 0.777 . . . . 0.0 112.519 162.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 7.8 t -109.08 123.9 49.9 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.332 1.053 . . . . 0.0 109.284 163.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m 41.91 37.55 0.83 Allowed 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 165.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt 55.08 26.17 7.88 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.95 2.5 . . . . 0.0 115.221 -175.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.7 p -81.32 -61.73 1.86 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.154 0.888 . . . . 0.0 111.687 170.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -153.68 168.79 25.08 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.301 1.84 . . . . 0.0 111.329 172.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -56.61 4.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 130.89 3.676 . . . . 0.0 117.337 -175.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 m -164.82 -30.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.859 1 C-N-CA 132.04 4.136 . . . . 0.0 108.807 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.49 -157.95 19.37 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 127.181 2.324 . . . . 0.0 113.526 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -75.44 64.24 1.56 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.781 2.033 . . . . 0.0 112.609 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.6 t80 49.15 -128.53 2.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.96 2.904 . . . . 0.0 112.851 178.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 52.47 43.63 30.8 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.854 1.661 . . . . 0.0 113.06 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.5 m 52.03 63.44 2.24 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.916 1.686 . . . . 0.0 113.836 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 58.5 41.38 22.7 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.796 1.639 . . . . 0.0 113.172 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 79.2 m . . . . . 0 CA--C 1.551 0.998 0 C-N-CA 129.202 3.001 . . . . 0.0 116.533 -179.937 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m . . . . . 0 N--CA 1.48 1.047 0 CA-C-O 120.887 0.375 . . . . 0.0 111.539 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.98 -21.43 66.49 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 24.9 m -87.18 134.59 33.51 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.155 0.982 . . . . 0.0 111.697 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.2 t -63.31 -31.06 72.11 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . 0.537 HD23 ' H ' ' A' ' 69' ' ' LEU . 2.6 pt? -104.55 18.78 21.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.889 1.676 . . . . 0.0 115.24 -172.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 61.9 m -127.98 158.96 36.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.132 1.373 . . . . 0.0 111.25 176.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -151.23 112.82 4.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.436 1.094 . . . . 0.0 110.899 169.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m 57.24 12.22 1.3 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 118.028 2.603 . . . . 0.0 118.028 168.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -141.89 152.59 43.72 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.496 1.918 . . . . 0.0 110.754 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -84.29 157.56 21.5 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.244 1.018 . . . . 0.0 112.2 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 33.8 p80 -135.81 178.78 6.78 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.095 2.158 . . . . 0.0 111.028 -172.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.2 t -114.7 166.33 11.86 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.779 1.232 . . . . 0.0 112.841 173.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -61.66 -17.88 57.25 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 127.732 2.413 . . . . 0.0 114.159 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -67.99 -25.77 65.58 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 169.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -92.72 -57.83 2.54 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.762 1.625 . . . . 0.0 110.873 172.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 24.2 p . . . . . 0 CA--C 1.549 0.932 0 C-N-CA 124.986 1.315 . . . . 0.0 112.136 169.717 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 . . . . . 0 CA--C 1.542 0.639 0 N-CA-C 112.217 0.451 . . . . 0.0 112.217 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -85.76 -14.97 43.61 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.45 55.53 3.22 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.046 1.338 . . . . 0.0 112.467 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -66.47 155.25 38.08 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.693 1.597 . . . . 0.0 113.441 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.05 164.27 30.49 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.634 1.574 . . . . 0.0 111.739 178.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -67.57 158.48 82.47 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 124.36 1.064 . . . . 0.0 112.199 178.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -64.77 -16.03 53.27 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.367 2.712 . . . . 0.0 116.659 -174.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.302 21.8 ptmt 52.72 -1.81 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 129.479 3.112 . . . . 0.0 118.679 179.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 70.0 t -83.32 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.979 1.312 . . . . 0.0 109.709 168.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . 0.562 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 3.2 tm? -124.06 -46.83 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.37 1.468 . . . . 0.0 114.364 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . 0.562 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 85.6 Cg_endo -73.45 158.77 47.58 Favored 'Trans proline' 0 C--N 1.355 0.906 0 CA-C-N 122.097 1.785 . . . . 0.0 113.347 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 . . . . . 0 CA--C 1.544 0.72 0 C-N-CA 125.671 1.588 . . . . 0.0 112.758 -175.422 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 17.6 t . . . . . 0 CA--C 1.55 0.948 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -136.52 24.32 3.17 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.802 1.641 . . . . 0.0 112.488 172.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -139.3 167.61 21.69 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.22 1.808 . . . . 0.0 111.725 -171.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.285 18.6 p 47.25 23.65 0.35 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.999 2.52 . . . . 0.0 117.341 173.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.54 -31.64 2.01 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.707 1.622 . . . . 0.0 114.283 178.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 138.24 -161.33 25.61 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.977 1.275 . . . . 0.0 114.719 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -77.39 -176.74 4.32 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.222 1.809 . . . . 0.0 114.377 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.14 -53.53 4.87 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.153 1.358 . . . . 0.0 114.742 173.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -77.69 142.28 38.88 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 40.79 22.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 129.767 3.227 . . . . 0.0 117.877 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.25 -23.31 52.76 Favored Glycine 0 CA--C 1.536 1.353 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 -161.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -61.18 -44.6 97.05 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.054 1.342 . . . . 0.0 112.963 173.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -105.76 -30.73 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.259 1.824 . . . . 0.0 113.031 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 53.6 t . . . . . 0 CA--C 1.538 0.487 0 C-N-CA 124.728 1.211 . . . . 0.0 110.445 179.697 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.542 0.657 0 N-CA-C 113.202 0.816 . . . . 0.0 113.202 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.29 -55.63 0.88 Allowed Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.304 1.041 . . . . 0.0 112.421 162.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.16 -37.03 3.68 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.949 2.432 . . . . 0.0 113.927 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.336 0.0 OUTLIER 53.12 -31.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 131.51 3.924 . . . . 0.0 118.271 -171.235 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.58 -179.79 8.53 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.488 1.915 . . . . 0.0 111.522 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -101.47 146.41 27.67 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.692 -0.63 . . . . 0.0 109.33 144.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.4 t30 59.45 -69.88 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 165.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.1 p -86.13 -15.35 41.38 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.611 1.565 . . . . 0.0 115.167 -170.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 m 55.92 30.73 16.53 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 160.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -142.62 19.79 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 175.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -144.59 143.08 30.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.166 1.386 . . . . 0.0 111.202 -177.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.98 -12.98 61.02 Favored Glycine 0 N--CA 1.475 1.244 0 N-CA-C 116.826 1.49 . . . . 0.0 116.826 -162.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -68.97 93.38 0.56 Allowed 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.576 1.188 . . . . 0.0 112.37 171.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -53.49 175.62 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.987 1.715 . . . . 0.0 113.595 172.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -62.01 0.94 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.943 1.297 . . . . 0.0 114.061 -165.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.48 -9.18 59.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -84.56 -31.55 24.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.075 1.35 . . . . 0.0 111.974 173.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.4 t -64.64 136.81 96.92 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.843 1.657 . . . . 0.0 111.073 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo . . . . . 0 CA--C 1.537 0.667 0 C-N-CA 123.797 2.998 . . . . 0.0 114.713 -170.851 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.9 pp . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.0 mt -125.14 137.15 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 111.027 -167.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 32.8 t -61.35 109.37 1.13 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.17 1.388 . . . . 0.0 111.708 170.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.6 m 47.38 16.97 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 127.722 2.409 . . . . 0.0 116.724 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 48.45 34.18 4.58 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.98 1.312 . . . . 0.0 113.347 -168.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.7 p -96.93 -22.77 16.67 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -164.61 157.69 30.16 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.851 1.215 . . . . 0.0 112.151 177.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.56 121.89 14.97 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.318 1.059 . . . . 0.0 112.631 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.5 t -59.13 -26.89 65.11 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -75.27 -22.16 57.99 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -141.41 -18.25 0.79 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 -168.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 149.92 45.74 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.077 1.308 . . . . 0.0 112.85 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -147.08 167.74 23.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.589 1.556 . . . . 0.0 110.029 176.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.7 t -38.81 -45.64 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.986 2.115 . . . . 0.0 115.899 -172.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -73.59 -15.89 61.26 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -127.38 0.55 6.32 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.104 1.762 . . . . 0.0 113.539 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.8 t -40.3 -50.99 6.41 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 128.005 2.522 . . . . 0.0 115.81 -172.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -79.33 -2.83 12.61 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 123.192 2.595 . . . . 0.0 116.483 -176.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -128.83 11.29 6.1 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -162.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.27 24.14 4.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.2 mt -128.77 62.96 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 126.578 1.951 . . . . 0.0 108.742 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -145.4 150.26 36.22 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.265 -1.522 . . . . 0.0 113.99 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -76.25 168.0 20.84 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.258 1.023 . . . . 0.0 112.042 174.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 21.2 m -85.1 -18.95 32.69 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.2 tppt? -127.95 -9.01 5.46 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.043 1.337 . . . . 0.0 114.37 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 p -145.55 167.33 23.28 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.033 1.333 . . . . 0.0 111.776 174.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -76.89 132.19 38.98 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.43 -0.794 . . . . 0.0 112.566 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.63 141.85 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.836 2.454 . . . . 0.0 116.186 179.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.2 m -80.33 -21.41 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 O-C-N 120.451 -1.405 . . . . 0.0 110.797 157.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.92 -6.48 24.85 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.949 1.738 . . . . 0.0 116.399 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . 0.263 0.7 OUTLIER -87.64 -132.49 0.07 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.746 1.273 . . . . 0.0 113.122 172.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -61.6 126.42 27.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -157.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 45.85 30.84 0.93 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.647 2.379 . . . . 0.0 113.761 -175.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.1 p 49.8 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.805 3.642 . . . . 0.0 119.061 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -147.34 8.55 0.92 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.696 1.998 . . . . 0.0 112.982 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.8 m . . . . . 0 CA--C 1.563 1.48 0 N-CA-C 117.306 2.335 . . . . 0.0 117.306 -170.928 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.5 p . . . . . 0 N--CA 1.474 0.751 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 -70.26 -12.66 61.74 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.412 1.485 . . . . 0.0 113.238 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.3 m -111.8 166.83 10.85 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.22 1.408 . . . . 0.0 112.131 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 57.1 p -116.09 -3.43 12.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.894 1.677 . . . . 0.0 112.882 -158.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 pp -132.15 -3.42 3.52 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.063 2.145 . . . . 0.0 113.252 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 67.3 m -86.7 157.15 19.71 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.575 1.15 . . . . 0.0 112.191 -177.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptt -133.99 7.23 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.7 t -149.27 154.4 38.98 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.676 1.19 . . . . 0.0 112.138 175.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -83.3 -28.05 29.37 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.283 1.433 . . . . 0.0 114.454 -174.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -88.82 70.22 8.67 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.517 1.127 . . . . 0.0 111.942 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.9 p-80 -139.55 175.56 9.46 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.083 1.353 . . . . 0.0 112.322 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -133.49 165.34 25.1 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.691 1.597 . . . . 0.0 111.336 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -58.56 -32.61 69.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.204 1.402 . . . . 0.0 112.981 175.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -74.47 -23.06 58.83 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.646 1.178 . . . . 0.0 112.985 173.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -103.85 -12.24 17.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.388 1.875 . . . . 0.0 114.059 -173.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 46.3 m . . . . . 0 CA--C 1.55 0.961 0 C-N-CA 125.346 1.458 . . . . 0.0 111.55 176.96 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 . . . . . 0 CA--C 1.547 0.86 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -75.93 172.8 12.1 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.314 1.046 . . . . 0.0 111.844 176.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -61.84 122.74 16.17 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.349 -0.845 . . . . 0.0 111.286 176.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -146.33 147.77 31.69 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.19 1.796 . . . . 0.0 111.567 -173.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 53.98 -176.66 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.397 1.479 . . . . 0.0 113.773 -165.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.15 161.8 33.04 Favored Pre-proline 0 N--CA 1.476 0.838 0 C-N-CA 125.354 1.461 . . . . 0.0 112.436 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.37 -172.66 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 124.296 3.331 . . . . 0.0 113.819 168.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -66.8 9.73 0.17 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 126.84 2.056 . . . . 0.0 115.278 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t 65.12 121.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 128.891 2.877 . . . . 0.0 113.489 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -72.05 151.75 92.71 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.003 0.921 . . . . 0.0 112.623 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -64.9 128.42 20.77 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.401 2.068 . . . . 0.0 113.025 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 . . . . . 0 N--CA 1.473 0.684 0 C-N-CA 124.071 0.948 . . . . 0.0 112.26 169.696 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 31.9 t . . . . . 0 CA--C 1.539 0.52 0 N-CA-C 112.058 0.392 . . . . 0.0 112.058 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -138.54 -10.11 1.41 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -176.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -90.11 -44.82 9.54 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -161.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.8 p -119.06 5.11 11.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.266 1.826 . . . . 0.0 113.558 177.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 170.8 -172.28 44.18 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.428 1.966 . . . . 0.0 111.44 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -75.92 177.3 50.24 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 123.545 0.593 . . . . 0.0 113.341 170.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -54.27 140.19 33.81 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.378 1.471 . . . . 0.0 111.908 173.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 156.83 -9.34 0.25 Allowed Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.776 1.87 . . . . 0.0 117.776 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -137.49 -167.26 2.09 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.955 1.877 . . . . 0.0 112.942 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -69.42 45.39 0.06 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.313 1.845 . . . . 0.0 113.236 173.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -53.46 -21.14 12.64 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 128.188 2.804 . . . . 0.0 115.573 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -75.57 -44.56 42.6 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.304 1.052 . . . . 0.0 112.825 171.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -88.3 -11.42 46.5 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.511 1.524 . . . . 0.0 113.167 -177.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 2.1 p . . . . . 0 CA--C 1.548 0.892 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -176.308 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.543 0.71 0 N-CA-C 113.123 0.786 . . . . 0.0 113.123 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -84.16 -49.18 0.66 Allowed Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 125.092 1.357 . . . . 0.0 113.19 159.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.2 -29.83 6.06 Favored 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.796 2.331 . . . . 0.0 114.857 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? 62.33 -63.45 0.1 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.968 2.507 . . . . 0.0 114.647 -172.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.4 t -156.82 172.3 18.88 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.758 2.423 . . . . 0.0 111.245 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -73.51 -39.62 64.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.13 -0.981 . . . . 0.0 113.417 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -155.97 -58.34 0.1 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.9 1.28 . . . . 0.0 113.105 -171.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.9 p -79.01 -9.74 59.62 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 46.62 51.76 11.77 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 159.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -143.84 6.12 1.38 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -175.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -150.41 157.52 43.13 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.295 1.838 . . . . 0.0 110.273 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.14 -9.52 42.1 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.267 1.267 . . . . 0.0 116.267 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -72.97 94.49 1.87 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.962 1.381 . . . . 0.0 113.098 175.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -54.75 175.75 0.05 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.857 2.063 . . . . 0.0 113.79 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.01 -63.66 0.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.827 2.051 . . . . 0.0 114.433 -172.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -82.6 -12.47 57.67 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.324 1.85 . . . . 0.0 115.382 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -83.47 -23.42 32.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.619 1.168 . . . . 0.0 111.992 171.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.9 t -61.25 -52.8 68.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 120.908 -1.12 . . . . 0.0 113.386 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo . . . . . 0 CA--C 1.542 0.922 0 C-N-CA 122.849 2.366 . . . . 0.0 111.936 168.222 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.4 mt . . . . . 0 CA--C 1.543 0.679 0 CA-C-O 121.165 0.507 . . . . 0.0 110.095 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.4 pt -54.69 128.68 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.877 1.271 . . . . 0.0 112.623 178.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 17.3 p -78.99 -21.98 46.21 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 t -157.39 -162.63 1.23 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.125 2.17 . . . . 0.0 110.014 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.18 49.29 0.67 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.285 1.834 . . . . 0.0 112.253 174.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.3 p -147.85 150.51 34.3 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.636 1.974 . . . . 0.0 110.954 177.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.11 -179.12 28.75 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 124.958 1.266 . . . . 0.0 113.363 -167.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -107.3 145.95 32.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.426 1.49 . . . . 0.0 110.662 172.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.1 t -66.88 -5.28 11.82 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -114.03 -11.17 12.78 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 126.267 1.827 . . . . 0.0 114.178 170.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -157.27 105.7 2.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.532 1.533 . . . . 0.0 111.205 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -130.83 -21.34 2.74 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -64.23 -40.31 95.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.691 1.132 . . . . 0.0 112.143 173.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t 50.03 -152.78 0.15 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.673 1.189 . . . . 0.0 111.878 -170.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.8 mmp_? -80.43 -38.59 29.86 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.592 -1.318 . . . . 0.0 110.283 150.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -136.92 87.67 2.3 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.324 1.45 . . . . 0.0 111.784 177.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t 17.04 -74.1 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 129.572 3.149 . . . . 0.0 117.654 157.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -71.09 72.89 2.06 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 124.612 3.541 . . . . 0.0 112.995 177.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 tptm -134.33 -173.34 3.25 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.526 2.33 . . . . 0.0 110.958 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.09 -41.36 0.19 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 128.481 2.713 . . . . 0.0 116.956 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.1 mt -133.61 93.7 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.68 1.592 . . . . 0.0 109.285 -174.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -139.59 167.45 22.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.661 1.584 . . . . 0.0 111.86 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 94.5 m -70.34 161.49 30.32 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.292 1.044 . . . . 0.0 111.996 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.4 m -71.41 -20.78 62.08 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -134.41 2.35 3.24 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -175.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.8 p -152.37 165.95 33.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.769 1.227 . . . . 0.0 112.288 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.7 134.1 39.32 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.557 1.543 . . . . 0.0 113.807 -172.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 59.23 156.99 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 127.225 2.21 . . . . 0.0 115.296 -172.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.2 m -88.85 -22.76 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 120.222 -1.549 . . . . 0.0 110.196 153.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.83 -20.11 63.91 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 126.402 1.953 . . . . 0.0 115.512 -173.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -79.87 -14.35 58.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -169.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -150.77 124.4 9.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.974 0.91 . . . . 0.0 111.793 174.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 52.97 12.05 0.25 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 126.854 2.062 . . . . 0.0 115.138 -173.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.304 33.0 p 48.4 23.95 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.917 2.087 . . . . 0.0 115.183 -161.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -147.35 -36.11 0.23 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 25.4 t . . . . . 0 CA--C 1.556 1.178 0 C-N-CA 126.548 1.939 . . . . 0.0 114.2 -178.522 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.5 t . . . . . 0 N--CA 1.478 0.93 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 62.6 -36.37 0.13 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 128.226 2.61 . . . . 0.0 115.809 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.5 m -78.59 -1.11 32.55 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.519 1.927 . . . . 0.0 114.902 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 15.0 t 56.36 -51.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 129.657 3.183 . . . . 0.0 118.59 -177.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 pp -86.37 -13.94 44.95 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.503 1.521 . . . . 0.0 113.828 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 96.7 m -79.67 168.79 18.88 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.308 1.043 . . . . 0.0 112.381 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -111.0 -30.33 7.55 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 177.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.2 p -87.27 172.89 9.54 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.388 1.475 . . . . 0.0 112.906 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 162.61 7.54 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.129 0.972 . . . . 0.0 113.376 174.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -52.82 147.05 9.51 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -173.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -148.19 17.34 1.07 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.564 1.545 . . . . 0.0 112.914 172.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.7 p -75.22 -38.77 60.5 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -152.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 47.89 34.78 4.24 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.657 1.583 . . . . 0.0 113.248 -169.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 56.73 18.04 3.51 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 126.546 1.938 . . . . 0.0 115.528 -172.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.3 tpt85 -125.08 -30.14 3.24 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.217 2.207 . . . . 0.0 114.136 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.8 t . . . . . 0 CA--C 1.553 1.081 0 C-N-CA 125.543 1.537 . . . . 0.0 112.441 -166.914 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 34.6 t0 . . . . . 0 CA--C 1.545 0.752 0 CA-C-O 120.929 0.395 . . . . 0.0 111.442 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -110.96 157.42 19.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.23 1.812 . . . . 0.0 112.236 -174.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.92 163.87 31.19 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.592 1.557 . . . . 0.0 112.51 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 56.19 23.96 7.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.54 1.936 . . . . 0.0 114.893 176.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.41 156.9 29.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.362 1.065 . . . . 0.0 112.949 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -139.47 136.7 17.98 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 126.563 1.945 . . . . 0.0 110.57 178.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.91 143.37 54.77 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.731 2.287 . . . . 0.0 111.734 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -126.54 113.33 16.65 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.942 1.297 . . . . 0.0 110.824 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.12 19.21 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 126.391 1.876 . . . . 0.0 112.267 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.9 mt -72.56 155.76 90.79 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 125.49 1.516 . . . . 0.0 112.409 -176.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -62.13 152.9 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.062 2.508 . . . . 0.0 112.397 172.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 . . . . . 0 N--CA 1.47 0.535 0 C-N-CA 124.045 0.938 . . . . 0.0 112.794 -177.19 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.4 t . . . . . 0 CA--C 1.548 0.891 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -56.66 -35.84 68.86 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.294 -1.504 . . . . 0.0 114.084 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.05 -13.76 62.37 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -86.34 -6.43 58.95 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.985 1.714 . . . . 0.0 112.743 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 114.99 -7.64 21.56 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.313 1.911 . . . . 0.0 114.384 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 165.14 149.65 5.92 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-N 118.614 1.207 . . . . 0.0 113.89 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -65.2 -17.91 64.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.491 1.917 . . . . 0.0 114.257 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -71.86 -5.4 61.18 Favored Glycine 0 CA--C 1.538 1.482 0 N-CA-C 118.602 2.201 . . . . 0.0 118.602 -164.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -147.35 150.68 35.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.897 2.349 . . . . 0.0 115.535 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 39.16 29.44 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 129.978 3.311 . . . . 0.0 117.658 164.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.34 -11.7 35.09 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.961 1.267 . . . . 0.0 115.025 -174.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -67.86 -33.51 74.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.499 1.519 . . . . 0.0 113.92 174.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -151.39 -26.66 0.2 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -166.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 14.9 p . . . . . 0 CA--C 1.544 0.734 0 CA-C-N 120.579 1.536 . . . . 0.0 113.535 -168.306 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.54 0.568 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -75.41 -51.4 3.3 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.001 0.92 . . . . 0.0 112.471 159.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -76.05 -41.39 0.51 Allowed 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.548 2.166 . . . . 0.0 114.74 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.295 0.1 OUTLIER 50.85 -33.95 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 131.343 3.857 . . . . 0.0 119.286 -171.98 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.9 t -157.79 164.49 36.97 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.416 1.886 . . . . 0.0 112.652 171.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -74.54 -40.21 61.86 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.515 1.126 . . . . 0.0 113.307 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -158.37 -31.3 0.07 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.741 1.617 . . . . 0.0 113.101 -171.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 m -73.21 -163.82 0.16 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.856 0.862 . . . . 0.0 110.654 169.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.1 p -135.87 155.69 49.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.893 -1.129 . . . . 0.0 112.9 170.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 56.51 -173.59 0.07 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.87 2.068 . . . . 0.0 114.716 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.265 9.1 ttp180 65.6 27.19 11.52 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.2 2.2 . . . . 0.0 115.659 172.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.48 -17.02 0.66 Allowed Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.907 1.923 . . . . 0.0 117.907 160.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -81.14 77.63 8.01 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.202 1.501 . . . . 0.0 111.142 -178.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -56.99 178.74 0.05 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 128.107 2.563 . . . . 0.0 113.693 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.21 -64.44 0.32 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.616 1.966 . . . . 0.0 114.252 -171.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -78.71 -13.97 59.54 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.083 1.753 . . . . 0.0 115.296 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.87 -14.78 31.08 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.336 1.454 . . . . 0.0 113.139 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.94 -53.91 45.12 Favored Pre-proline 0 CA--C 1.549 0.923 0 CA-C-O 118.08 -0.962 . . . . 0.0 113.018 171.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo . . . . . 0 CA--C 1.543 0.933 0 C-N-CA 122.199 1.932 . . . . 0.0 111.68 169.636 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 114.073 1.138 . . . . 0.0 114.073 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.8 mm -107.17 134.62 48.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.645 1.578 . . . . 0.0 110.631 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.7 p -87.59 141.61 28.48 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.323 1.059 . . . . 0.0 112.272 173.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.2 p -70.17 137.5 51.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.314 1.446 . . . . 0.0 114.119 -164.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 50.66 14.29 0.17 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.121 1.768 . . . . 0.0 115.217 -169.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -150.39 29.49 0.7 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.183 0.993 . . . . 0.0 112.159 -163.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.7 153.99 24.86 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 120.297 -1.502 . . . . 0.0 114.863 -176.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -142.58 140.72 31.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.557 1.543 . . . . 0.0 110.101 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -21.54 64.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -171.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -138.84 15.0 2.68 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -138.7 -1.06 1.87 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -172.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 37.0 t-80 -106.37 150.19 26.25 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.068 1.347 . . . . 0.0 113.226 -172.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -142.37 147.21 35.88 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.158 1.383 . . . . 0.0 111.188 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.5 t -54.62 -40.95 69.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.692 1.597 . . . . 0.0 114.47 -172.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -79.13 -13.38 59.77 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -104.49 -18.21 14.46 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.218 1.407 . . . . 0.0 113.42 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' CYS . . . . . 0.503 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.288 1.2 m 24.43 -88.63 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 129.989 3.316 . . . . 0.0 116.561 172.44 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.503 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 25.0 Cg_exo -70.17 -19.95 33.54 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.284 1.851 . . . . 0.0 116.709 -158.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.03 1.91 22.36 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -174.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.52 60.59 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -175.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 mt -130.21 141.22 46.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.813 1.645 . . . . 0.0 108.854 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -147.6 161.44 41.13 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.0 t -67.04 156.91 34.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.525 1.53 . . . . 0.0 112.036 168.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.4 m -65.71 -17.72 64.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.18 1.392 . . . . 0.0 114.63 174.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -129.63 -2.57 4.81 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.33 1.452 . . . . 0.0 114.696 -171.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 31.1 p -149.27 156.01 41.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.368 1.067 . . . . 0.0 111.835 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.39 151.52 45.11 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.647 -0.658 . . . . 0.0 112.163 174.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 59.18 175.06 0.07 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.739 1.216 . . . . 0.0 113.278 -170.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.8 m -75.94 71.14 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 O-C-N 119.813 -1.805 . . . . 0.0 109.66 167.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.39 -116.29 0.09 OUTLIER Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.458 1.98 . . . . 0.0 117.132 -159.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -67.9 -7.92 32.4 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 117.704 2.483 . . . . 0.0 117.704 -154.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -128.93 118.67 23.04 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.475 1.034 . . . . 0.0 112.24 176.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 43.98 26.16 0.13 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.724 2.81 . . . . 0.0 116.66 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.0 m 52.66 30.25 8.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.31 1.444 . . . . 0.0 114.786 -172.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -145.02 -34.34 0.35 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.127 1.371 . . . . 0.0 113.38 -174.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 86.7 m . . . . . 0 CA--C 1.555 1.17 0 C-N-CA 126.189 1.796 . . . . 0.0 114.813 -174.835 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.2 p . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 121.061 0.457 . . . . 0.0 112.044 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -103.69 6.7 37.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.285 1.434 . . . . 0.0 113.735 -173.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.4 m -74.11 -17.67 60.91 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 62.86 -47.76 0.2 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.212 2.605 . . . . 0.0 117.608 -166.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -86.36 0.07 54.8 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 91.8 m -111.37 156.28 21.83 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.866 1.266 . . . . 0.0 112.854 -178.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -114.48 160.95 18.62 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 126.027 1.731 . . . . 0.0 109.619 161.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.8 m -76.04 -20.83 57.44 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.638 1.347 . . . . 0.0 114.638 -172.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -66.84 134.13 51.47 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.521 0.728 . . . . 0.0 112.262 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.2 tttp 47.61 35.22 4.18 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.764 2.025 . . . . 0.0 114.221 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -82.51 131.61 35.21 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.824 0.85 . . . . 0.0 112.668 -171.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.8 m -94.3 110.96 22.68 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.914 0.886 . . . . 0.0 111.956 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.86 135.45 57.33 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.782 0.833 . . . . 0.0 111.578 -177.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 54.52 20.07 2.67 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.355 1.862 . . . . 0.0 115.669 -173.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -130.87 -40.04 1.2 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.43 1.492 . . . . 0.0 113.356 177.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.8 m . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 128.655 2.782 . . . . 0.0 115.667 -179.41 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 . . . . . 0 CA--C 1.545 0.752 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -150.4 170.91 17.93 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.101 1.761 . . . . 0.0 112.087 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -97.28 141.91 29.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.387 1.075 . . . . 0.0 112.296 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -137.15 -59.2 0.7 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 125.25 1.42 . . . . 0.0 112.869 -172.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.66 157.04 36.02 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.973 0.909 . . . . 0.0 112.945 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 7.9 ptpp? -148.58 146.43 22.36 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.624 1.57 . . . . 0.0 112.347 -178.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 97' ' ' LYS . 31.6 Cg_exo -70.69 -33.86 12.4 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.741 2.294 . . . . 0.0 114.822 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -138.17 158.35 44.48 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.414 1.885 . . . . 0.0 111.633 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -121.05 -4.65 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.375 1.47 . . . . 0.0 113.777 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 21.2 tp -68.71 124.41 90.08 Favored Pre-proline 0 CA--C 1.551 1.01 0 O-C-N 121.183 -0.948 . . . . 0.0 110.974 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -80.64 159.42 21.98 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.84 2.36 . . . . 0.0 113.774 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 10.5 p90 . . . . . 0 N--CA 1.469 0.513 0 C-N-CA 127.72 2.408 . . . . 0.0 109.607 173.797 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.481 1.078 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -70.87 -17.64 62.72 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -168.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -64.6 -32.09 73.59 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.159 0.89 . . . . 0.0 111.81 170.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 55.6 m -99.1 -3.64 34.15 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.393 1.877 . . . . 0.0 113.3 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.66 8.74 76.31 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.431 1.491 . . . . 0.0 115.801 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -106.94 -157.97 21.2 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 126.404 1.954 . . . . 0.0 113.606 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -140.49 150.99 44.45 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.051 2.14 . . . . 0.0 111.601 174.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 88.2 -152.18 23.37 Favored Glycine 0 CA--C 1.54 1.636 0 N-CA-C 116.271 1.268 . . . . 0.0 116.271 176.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.305 0.6 OUTLIER 47.52 -161.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 128.952 2.901 . . . . 0.0 115.661 -170.014 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -67.07 36.89 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.729 2.012 . . . . 0.0 113.736 171.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.17 -30.04 16.6 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 126.53 2.014 . . . . 0.0 113.877 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.1 -38.62 65.55 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.518 1.927 . . . . 0.0 114.189 172.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -97.68 -34.16 11.03 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.798 1.639 . . . . 0.0 111.798 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.3 t . . . . . 0 CA--C 1.549 0.94 0 C-N-CA 125.486 1.514 . . . . 0.0 113.839 -177.385 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 119.348 -0.358 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 57.32 28.51 15.36 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 125.751 1.621 . . . . 0.0 115.145 168.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -83.83 111.7 19.44 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 121.073 -1.017 . . . . 0.0 113.072 -171.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.68 -51.14 22.3 Favored Pre-proline 0 CA--C 1.552 1.058 0 C-N-CA 124.259 1.024 . . . . 0.0 113.289 165.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -77.44 -38.25 0.78 Allowed 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 122.616 2.211 . . . . 0.0 114.267 -177.202 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.403 0.0 OUTLIER 49.73 -42.13 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 130.843 3.657 . . . . 0.0 118.537 -169.526 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.7 t -159.66 160.57 34.37 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 126.685 1.994 . . . . 0.0 111.693 174.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -71.01 -29.25 65.14 Favored 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 173.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 21.5 t-20 -161.64 -35.67 0.04 OUTLIER 'General case' 0 CA--C 1.548 0.866 0 N-CA-C 114.299 1.222 . . . . 0.0 114.299 -175.779 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 32.9 m -76.19 -21.19 56.78 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -170.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 69.8 m 58.49 11.87 1.86 Allowed 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 119.012 2.967 . . . . 0.0 119.012 171.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 83.1 mt-30 -133.08 -3.25 3.15 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 115.47 1.656 . . . . 0.0 115.47 -175.082 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 79.3 mtp180 -126.14 160.39 30.33 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 125.383 1.473 . . . . 0.0 111.857 -172.556 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.01 -19.23 69.7 Favored Glycine 0 CA--C 1.534 1.269 0 N-CA-C 115.437 0.935 . . . . 0.0 115.437 -172.444 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.03 92.57 3.18 Favored 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 113.799 1.037 . . . . 0.0 113.799 179.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -57.38 179.21 0.06 Allowed 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 126.891 2.077 . . . . 0.0 114.049 170.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.51 -63.8 0.53 Allowed 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 126.489 1.916 . . . . 0.0 114.475 -170.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 66.0 pttt -79.22 -11.46 59.96 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.57 1.548 . . . . 0.0 114.887 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -81.04 -37.82 28.45 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 124.175 0.99 . . . . 0.0 111.475 176.301 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.2 t -58.34 -37.4 54.5 Favored Pre-proline 0 CA--C 1.55 0.96 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -174.405 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 35.5 Cg_exo -69.49 -17.2 38.93 Favored 'Trans proline' 0 C--N 1.353 0.813 0 C-N-CA 122.777 2.318 . . . . 0.0 114.754 174.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 71.7 m80 -96.15 150.31 20.66 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 125.485 1.514 . . . . 0.0 111.561 -179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm -86.19 59.35 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 CA-C-O 123.099 1.428 . . . . 0.0 110.403 -177.055 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 18.3 mm -87.88 133.87 29.38 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 127.442 2.297 . . . . 0.0 108.546 179.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 m -61.81 142.41 57.33 Favored 'General case' 0 CA--C 1.542 0.637 0 O-C-N 121.989 -0.444 . . . . 0.0 110.812 -179.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 73.5 m -51.1 -30.35 15.92 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 117.457 2.391 . . . . 0.0 117.457 -159.477 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -142.26 11.79 1.95 Allowed 'General case' 0 CA--C 1.545 0.777 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 174.657 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 44.3 m -64.59 -48.52 74.67 Favored 'General case' 0 N--CA 1.469 0.52 0 O-C-N 120.58 -1.325 . . . . 0.0 113.03 -179.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.473 ' HA2' ' H ' ' A' ' 43' ' ' ILE . . . -165.79 178.45 40.54 Favored Glycine 0 CA--C 1.527 0.822 0 N-CA-C 116.108 1.203 . . . . 0.0 116.108 -153.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.63 138.8 47.69 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.36 1.464 . . . . 0.0 109.915 172.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.0 t -56.37 -19.24 13.79 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.959 1.704 . . . . 0.0 114.361 176.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -65.65 -19.26 65.84 Favored 'General case' 0 CA--C 1.552 1.02 0 N-CA-C 114.19 1.181 . . . . 0.0 114.19 172.445 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -139.23 -34.87 0.57 Allowed 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 125.376 1.47 . . . . 0.0 114.485 -176.0 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -66.51 123.97 21.5 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.144 1.778 . . . . 0.0 112.053 -174.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 46.6 t80 -155.22 169.37 24.34 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 125.42 1.488 . . . . 0.0 110.673 -174.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.6 m -63.12 -13.15 33.09 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 126.003 1.721 . . . . 0.0 115.509 -179.246 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 4.1 mmp_? -109.35 2.55 20.78 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 126.295 1.838 . . . . 0.0 113.652 170.355 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -136.55 0.71 2.52 Favored 'General case' 0 CA--C 1.545 0.769 0 N-CA-C 115.316 1.599 . . . . 0.0 115.316 -172.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 17.3 t -37.29 -51.88 2.37 Favored Pre-proline 0 CA--C 1.556 1.179 0 C-N-CA 127.194 2.198 . . . . 0.0 114.93 173.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -75.87 -8.45 19.06 Favored 'Trans proline' 0 CA--C 1.545 1.037 0 C-N-CA 123.436 2.758 . . . . 0.0 116.066 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -102.1 5.99 40.7 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 126.362 1.865 . . . . 0.0 113.653 -173.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -86.81 -152.64 0.19 Allowed 'General case' 0 CA--C 1.555 1.162 0 C-N-CA 125.122 1.369 . . . . 0.0 113.355 -173.783 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.473 ' H ' ' HA2' ' A' ' 29' ' ' GLY . 95.3 mt -55.43 -40.37 57.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 125.621 1.569 . . . . 0.0 113.48 -169.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -118.74 154.33 32.96 Favored 'General case' 0 N--CA 1.475 0.815 0 N-CA-C 115.002 1.482 . . . . 0.0 115.002 -177.525 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 24.6 p -83.29 -34.29 25.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.855 1.262 . . . . 0.0 114.031 -175.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 9.0 t -159.37 -155.77 0.48 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 125.097 1.359 . . . . 0.0 111.322 -170.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -62.79 -24.99 68.01 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 127.013 2.125 . . . . 0.0 112.692 173.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 24.4 p -89.82 155.08 19.41 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.045 1.338 . . . . 0.0 112.467 172.373 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 p-10 -72.3 134.17 45.39 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -166.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 60.26 148.48 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.191 0 C-N-CA 128.827 2.851 . . . . 0.0 117.006 176.331 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.6 m -71.8 -15.66 18.33 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 O-C-N 119.783 -1.823 . . . . 0.0 110.714 161.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.91 18.87 1.32 Allowed Glycine 0 CA--C 1.535 1.285 0 C-N-CA 128.025 2.726 . . . . 0.0 116.457 -170.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -143.0 155.31 44.64 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 118.809 1.304 . . . . 0.0 112.171 174.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.9 t80 59.9 137.64 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 128.069 2.547 . . . . 0.0 115.722 -177.206 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -56.99 148.58 20.98 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 124.483 1.113 . . . . 0.0 112.486 -175.251 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.9 m 57.32 32.68 22.15 Favored 'General case' 0 N--CA 1.478 0.927 0 N-CA-C 114.182 1.179 . . . . 0.0 114.182 -168.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 54.96 45.88 25.51 Favored 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 126.625 1.97 . . . . 0.0 113.495 176.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 23.7 t 49.8 75.93 0.6 Allowed Pre-proline 0 CA--C 1.555 1.144 0 C-N-CA 126.881 2.072 . . . . 0.0 113.585 -175.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_endo -70.94 162.35 42.98 Favored 'Trans proline' 0 CA--C 1.542 0.896 0 C-N-CA 123.531 2.82 . . . . 0.0 112.664 179.081 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 82.9 t60 -66.81 139.89 57.8 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 123.385 0.674 . . . . 0.0 111.928 173.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 40.4 ttpt -98.81 104.21 16.23 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.864 1.266 . . . . 0.0 111.539 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.3 m-90 -69.95 161.84 29.22 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.867 0.867 . . . . 0.0 111.695 168.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 46.8 mtmt -77.16 9.27 3.18 Favored 'General case' 0 N--CA 1.482 1.165 0 N-CA-C 114.925 1.454 . . . . 0.0 114.925 -178.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt 61.94 170.1 0.12 Allowed 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 127.831 2.453 . . . . 0.0 114.573 -178.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 98.5 t -85.91 147.72 5.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 C-N-CA 125.495 1.518 . . . . 0.0 110.985 -179.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 19.0 tp60 -69.98 -35.84 74.74 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.489 0.716 . . . . 0.0 112.019 179.064 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 22.2 m -76.55 156.74 32.62 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-O 123.688 1.709 . . . . 0.0 112.168 166.163 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 36.9 p -113.31 -15.26 12.71 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 127.673 2.389 . . . . 0.0 111.702 -161.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.6 mt -91.19 -21.46 21.13 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 126.078 1.751 . . . . 0.0 111.861 171.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 76.0 m -99.5 -22.35 15.53 Favored 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.715 1.206 . . . . 0.0 114.222 -164.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp 58.62 -55.48 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 129.617 3.167 . . . . 0.0 118.91 170.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 58.2 m -112.76 122.37 47.47 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 114.885 1.439 . . . . 0.0 114.885 -162.104 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 37.4 ttpt 56.54 -51.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 130.746 3.619 . . . . 0.0 119.24 168.18 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -80.33 151.03 29.69 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 115.109 1.522 . . . . 0.0 115.109 -160.158 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 4.5 p-80 54.84 177.68 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 119.241 3.052 . . . . 0.0 119.241 159.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 68.4 m -139.63 170.61 15.58 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 127.492 2.317 . . . . 0.0 111.39 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -56.87 -31.76 65.15 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 113.969 1.1 . . . . 0.0 113.969 -176.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -73.83 -19.31 60.78 Favored 'General case' 0 N--CA 1.475 0.821 0 N-CA-C 113.829 1.048 . . . . 0.0 113.829 176.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 tpt180 -102.01 -17.36 16.12 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.227 1.811 . . . . 0.0 112.97 174.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 43.8 t -114.75 88.96 17.47 Favored Pre-proline 0 CA--C 1.553 1.085 0 C-N-CA 125.851 1.66 . . . . 0.0 112.471 176.216 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_exo -59.58 -18.64 48.43 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 124.299 3.333 . . . . 0.0 115.606 172.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 3.1 m -72.22 35.38 0.06 Allowed 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 127.659 2.384 . . . . 0.0 115.916 -173.253 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.4 tt -137.73 136.96 45.64 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 C-N-CA 126.843 2.057 . . . . 0.0 109.327 174.632 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -70.13 -7.06 38.53 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 115.204 1.557 . . . . 0.0 115.204 -167.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 86.1 mtt85 -81.18 -16.04 54.02 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 125.007 1.323 . . . . 0.0 113.733 170.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -82.98 157.9 22.77 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.656 1.182 . . . . 0.0 112.53 175.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 70.0 m-85 -76.55 146.21 38.52 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.797 0.839 . . . . 0.0 112.625 179.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.464 HD13 ' H ' ' A' ' 88' ' ' ILE . 0.2 OUTLIER -91.01 155.54 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.716 0 C-N-CA 124.77 1.228 . . . . 0.0 112.338 176.419 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -95.75 27.16 3.62 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 125.376 1.47 . . . . 0.0 112.64 -177.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.9 m -137.53 159.12 34.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 126.311 1.844 . . . . 0.0 111.758 -177.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.1 t70 57.16 23.6 8.79 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 126.151 1.781 . . . . 0.0 115.573 177.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -75.57 153.89 37.09 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.377 1.471 . . . . 0.0 112.432 171.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -68.09 134.13 50.09 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 112.834 0.679 . . . . 0.0 112.834 -172.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 28.0 tt0 -150.68 161.75 42.0 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 125.776 1.63 . . . . 0.0 111.073 -175.372 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -59.51 156.47 13.18 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 125.006 1.322 . . . . 0.0 113.442 174.288 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -141.22 175.36 9.71 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 125.333 1.453 . . . . 0.0 112.433 -176.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? 43.89 59.49 12.45 Favored Pre-proline 0 N--CA 1.481 1.094 0 C-N-CA 127.497 2.319 . . . . 0.0 115.835 174.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -76.8 70.8 6.37 Favored 'Trans proline' 0 CA--C 1.546 1.11 0 C-N-CA 124.272 3.314 . . . . 0.0 112.62 -177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -137.16 161.19 36.83 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 128.302 2.641 . . . . 0.0 111.104 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 26.9 m -65.1 148.97 11.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.992 0 C-N-CA 124.141 0.976 . . . . 0.0 112.487 176.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.8 mt -84.92 156.6 60.81 Favored Pre-proline 0 CA--C 1.55 0.973 0 C-N-CA 124.281 1.032 . . . . 0.0 112.652 -177.597 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -61.25 159.6 30.17 Favored 'Trans proline' 0 CA--C 1.541 0.85 0 C-N-CA 123.798 2.999 . . . . 0.0 114.444 174.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.9 p90 -79.43 153.79 29.41 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.324 1.05 . . . . 0.0 112.931 176.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 68.9 t60 -86.32 152.89 22.37 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.431 1.092 . . . . 0.0 112.483 -179.494 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 11.9 t -87.07 136.95 32.74 Favored 'General case' 0 N--CA 1.47 0.569 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 178.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 12.6 tt -146.5 13.22 0.17 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.878 0 C-N-CA 124.655 1.182 . . . . 0.0 113.398 -169.211 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -94.31 50.82 1.4 Allowed 'General case' 0 CA--C 1.55 0.975 0 N-CA-C 115.177 1.547 . . . . 0.0 115.177 -153.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 16.6 p 41.72 31.73 0.22 Allowed 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 129.751 3.22 . . . . 0.0 119.397 166.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 22.3 t80 60.94 6.46 1.22 Allowed 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 127.619 2.367 . . . . 0.0 114.847 -177.182 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -106.96 -25.02 11.81 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.716 1.607 . . . . 0.0 112.168 -179.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 1.2 p -145.38 18.43 1.53 Allowed 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 125.77 1.628 . . . . 0.0 113.963 179.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 162.62 -133.94 3.27 Favored Glycine 0 CA--C 1.537 1.465 0 C-N-CA 125.016 1.293 . . . . 0.0 113.292 175.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.31 -159.64 1.07 Allowed Glycine 0 CA--C 1.535 1.317 0 C-N-CA 125.908 1.718 . . . . 0.0 113.014 171.034 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -109.65 150.71 27.86 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-N 119.46 1.63 . . . . 0.0 112.941 -177.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 154.57 -103.46 0.24 Allowed Glycine 0 CA--C 1.537 1.43 0 N-CA-C 115.265 0.866 . . . . 0.0 115.265 -177.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -70.67 151.31 45.07 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 116.885 2.18 . . . . 0.0 116.885 -153.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.2 m-30 45.89 28.14 0.56 Allowed 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 127.409 2.283 . . . . 0.0 116.835 164.039 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.21 -16.47 34.29 Favored Glycine 0 CA--C 1.538 1.489 0 C-N-CA 124.725 1.155 . . . . 0.0 115.669 -170.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.43 -33.64 76.0 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.754 1.621 . . . . 0.0 113.958 173.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.6 t70 -138.6 -21.14 1.02 Allowed 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 124.951 1.301 . . . . 0.0 114.367 -171.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.6 t -79.54 55.91 2.07 Favored 'General case' 0 CA--C 1.55 0.944 0 C-N-CA 125.524 1.53 . . . . 0.0 111.135 172.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 87.4 tttt -149.64 146.29 27.2 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 128.356 2.662 . . . . 0.0 110.518 -171.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 95.3 mt-10 -123.13 -39.56 2.47 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 176.366 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 9.7 ptpp? . . . . . 0 C--O 1.252 1.209 0 C-N-CA 126.096 1.758 . . . . 0.0 112.785 -171.818 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp . . . . . 0 N--CA 1.49 1.542 0 CA-C-O 119.559 -0.258 . . . . 0.0 111.693 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 57.8 mm-40 -88.71 150.82 22.79 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.858 0.863 . . . . 0.0 112.147 175.373 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -82.92 61.54 6.01 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.38 1.072 . . . . 0.0 113.36 -177.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.5 -53.05 61.08 Favored Pre-proline 0 CA--C 1.55 0.966 0 C-N-CA 123.993 0.917 . . . . 0.0 112.061 164.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.5 Cg_endo -75.42 -46.02 0.23 Allowed 'Trans proline' 0 C--N 1.352 0.76 0 C-N-CA 122.551 2.167 . . . . 0.0 113.196 174.121 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.252 1.8 pttm 41.98 -165.72 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 125.324 1.45 . . . . 0.0 112.45 -149.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 30.4 m -56.2 155.38 6.75 Favored 'General case' 0 CA--C 1.55 0.946 0 O-C-N 120.077 -1.64 . . . . 0.0 114.442 178.614 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 42.1 p-10 -61.18 -44.33 97.47 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 125.439 1.496 . . . . 0.0 114.636 -173.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 58.5 t30 -157.57 -34.61 0.07 Allowed 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 128.335 2.654 . . . . 0.0 109.974 -172.55 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 44.9 t -55.61 168.48 0.41 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 125.486 1.514 . . . . 0.0 111.309 153.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 71.2 m -134.54 76.51 1.64 Allowed 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 114.006 1.113 . . . . 0.0 114.006 -175.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 32.8 mt-30 -132.92 161.01 35.38 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 125.268 1.427 . . . . 0.0 110.586 162.534 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 99.1 mtt180 -78.15 -32.82 50.47 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.933 1.293 . . . . 0.0 112.822 178.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -73.76 -177.64 35.85 Favored Glycine 0 CA--C 1.535 1.288 0 C-N-CA 124.666 1.127 . . . . 0.0 112.81 169.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.331 0.6 OUTLIER 21.62 64.92 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 128.006 2.523 . . . . 0.0 114.85 -176.181 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.596 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.47 -178.28 0.18 Allowed 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 126.438 1.895 . . . . 0.0 114.103 -174.718 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -22.72 -69.98 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 127.782 2.433 . . . . 0.0 115.068 -174.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.4 ptmt -77.06 -14.29 59.84 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 126.059 1.744 . . . . 0.0 115.645 -178.043 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -94.33 -26.34 16.61 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 126.567 1.947 . . . . 0.0 113.219 177.72 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.5 t -56.94 -46.7 99.84 Favored Pre-proline 0 CA--C 1.547 0.85 0 C-N-CA 125.057 1.343 . . . . 0.0 114.437 -173.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -93.34 -4.74 3.01 Favored 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 122.892 2.395 . . . . 0.0 113.822 178.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 16.8 t-80 -83.02 158.29 22.56 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 114.015 1.116 . . . . 0.0 114.015 -162.726 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 55.5 mt -122.46 133.5 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.765 0 C-N-CA 125.908 1.683 . . . . 0.0 109.972 -176.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.0 mt -118.98 58.95 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 125.426 1.49 . . . . 0.0 109.585 -178.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 64.5 m 49.3 50.92 17.26 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.702 1.601 . . . . 0.0 113.541 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.1 m 56.51 46.52 20.44 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.709 1.204 . . . . 0.0 113.667 -173.509 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 12.1 t80 56.64 56.01 5.91 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 126.574 1.95 . . . . 0.0 113.558 -177.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.5 p -72.04 -30.09 64.83 Favored 'General case' 0 CA--C 1.544 0.72 0 O-C-N 121.052 -1.03 . . . . 0.0 112.48 173.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -177.69 -159.44 22.62 Favored Glycine 0 CA--C 1.53 0.986 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 -169.005 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -76.16 174.22 10.36 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.364 1.066 . . . . 0.0 111.613 173.009 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.2 t -110.12 -18.87 13.23 Favored 'General case' 0 N--CA 1.482 1.133 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 -177.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -97.04 -39.2 9.45 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 120.862 -1.149 . . . . 0.0 113.829 -177.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -85.86 11.73 10.66 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.766 1.227 . . . . 0.0 112.433 169.38 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 53.9 t-80 -70.99 126.44 29.58 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 126.668 1.987 . . . . 0.0 112.681 -174.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 32.9 t80 -152.0 150.59 30.15 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.66 1.184 . . . . 0.0 111.031 171.786 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 20.1 m -61.35 -27.43 68.5 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 125.593 1.557 . . . . 0.0 114.616 -171.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 59.5 ttp180 -75.67 -29.96 59.23 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.797 1.239 . . . . 0.0 113.149 174.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.2 m170 -101.47 -28.39 12.59 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.09 1.144 . . . . 0.0 114.09 -170.281 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 22.3 m -5.03 -75.22 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.099 0 C-N-CA 129.833 3.253 . . . . 0.0 117.7 -174.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -76.87 -12.76 17.87 Favored 'Trans proline' 0 CA--C 1.543 0.951 0 C-N-CA 123.12 2.546 . . . . 0.0 115.574 -172.705 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 29.3 mtpp -92.52 33.03 1.14 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 126.478 1.911 . . . . 0.0 113.02 -172.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -110.51 -38.16 5.28 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 115.749 1.759 . . . . 0.0 115.749 -163.873 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 58.6 mt -128.19 126.73 66.6 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 123.87 0.868 . . . . 0.0 111.681 -167.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -142.89 158.09 43.95 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 127.135 2.174 . . . . 0.0 110.113 178.044 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.1 t -75.96 143.64 41.45 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.453 0.701 . . . . 0.0 110.96 173.311 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 20.1 p -61.13 -37.4 82.69 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 124.929 1.292 . . . . 0.0 114.034 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.0 mmmt -122.14 -7.7 8.81 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 125.742 1.617 . . . . 0.0 114.619 179.779 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 39.7 m -117.03 8.04 13.27 Favored 'General case' 0 CA--C 1.55 0.967 0 N-CA-C 114.039 1.126 . . . . 0.0 114.039 177.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 30.1 m-20 61.65 0.6 0.5 Allowed 'General case' 0 CA--C 1.551 0.982 0 N-CA-C 119.119 3.007 . . . . 0.0 119.119 166.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -141.64 148.5 39.26 Favored 'General case' 0 N--CA 1.479 1.017 0 CA-C-N 120.78 1.627 . . . . 0.0 112.73 176.332 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.292 11.2 m 53.55 -9.81 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.438 1 N-CA-C 121.847 4.017 . . . . 0.0 121.847 164.229 . . . . . . . . 3 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 117.02 -177.22 16.59 Favored Glycine 0 N--CA 1.48 1.567 0 CA-C-N 121.136 1.789 . . . . 0.0 114.308 171.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -117.98 0.04 11.78 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 115.779 1.77 . . . . 0.0 115.779 -170.292 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.5 t80 -83.44 153.32 24.54 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 120.581 -1.324 . . . . 0.0 111.908 171.814 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -60.65 -24.85 65.89 Favored 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 116.257 1.947 . . . . 0.0 116.257 -167.531 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 95.5 p -80.48 -12.4 59.55 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.101 1.148 . . . . 0.0 114.101 176.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -132.79 -19.02 2.35 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 115.325 1.602 . . . . 0.0 115.325 -172.832 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 13.4 t -69.6 137.26 88.22 Favored Pre-proline 0 CA--C 1.548 0.88 0 CA-C-N 119.992 1.269 . . . . 0.0 112.021 179.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -57.58 136.93 78.81 Favored 'Trans proline' 0 CA--C 1.539 0.769 0 C-N-CA 123.037 2.491 . . . . 0.0 113.229 177.18 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -95.19 147.13 23.79 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.982 1.313 . . . . 0.0 111.545 -179.963 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -120.6 -2.95 9.86 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 116.207 1.928 . . . . 0.0 116.207 179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.5 t90 -101.89 154.13 19.22 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.27 1.028 . . . . 0.0 111.317 174.212 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.4 mmtt -98.75 -3.91 34.65 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 115.479 1.659 . . . . 0.0 115.479 -158.238 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 8.7 ptpp? -119.06 153.05 35.37 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 125.709 1.604 . . . . 0.0 112.165 172.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -124.98 29.98 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.256 0 C-N-CA 125.142 1.377 . . . . 0.0 113.582 -168.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 61.92 6.62 1.74 Allowed 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 126.865 2.066 . . . . 0.0 115.753 177.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 71.0 m -88.37 0.8 55.81 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 124.594 1.158 . . . . 0.0 113.702 173.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.281 6.3 t 57.29 -42.94 0.04 OUTLIER 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 129.452 3.101 . . . . 0.0 117.768 -169.073 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.261 0.0 OUTLIER -101.35 7.9 42.52 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 115.101 1.519 . . . . 0.0 115.101 178.224 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 71.9 m -112.26 147.4 36.34 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.186 0.994 . . . . 0.0 112.229 173.189 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -106.92 178.9 4.42 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.913 1.685 . . . . 0.0 110.371 172.042 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 31.1 p -66.29 -29.48 69.7 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.794 1.238 . . . . 0.0 113.741 172.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 35.3 mttm -80.79 160.03 24.97 Favored 'General case' 0 N--CA 1.478 0.945 0 C-N-CA 125.273 1.429 . . . . 0.0 112.77 171.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . 0.265 22.5 pttp 49.52 30.29 3.39 Favored 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.962 2.505 . . . . 0.0 116.202 174.173 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 35.5 t-80 -109.16 120.17 41.74 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 124.076 0.95 . . . . 0.0 112.529 -174.248 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 66.3 m -144.05 139.85 29.19 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 125.229 1.412 . . . . 0.0 111.78 -179.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 1.1 mptm? -61.64 -38.93 89.5 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.121 0.968 . . . . 0.0 112.871 -169.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -80.98 -10.03 59.77 Favored 'General case' 0 N--CA 1.474 0.73 0 C-N-CA 124.365 1.066 . . . . 0.0 113.775 179.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 25.3 mmm180 -108.49 -24.58 11.34 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 125.429 1.491 . . . . 0.0 113.716 -177.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.9 t -48.76 -48.99 69.0 Favored Pre-proline 0 CA--C 1.551 1.018 0 C-N-CA 125.139 1.376 . . . . 0.0 114.383 179.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -76.73 -29.02 5.93 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 121.999 1.799 . . . . 0.0 113.354 174.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 20.3 m -88.83 5.67 42.6 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 125.856 1.662 . . . . 0.0 114.966 -172.267 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.0 tt -71.6 -20.17 20.75 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 C-N-CA 125.012 1.325 . . . . 0.0 114.086 -170.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 9.3 t90 -113.53 154.18 27.52 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 124.808 1.243 . . . . 0.0 113.465 -170.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 37.0 ttm180 -111.63 -10.22 14.11 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.804 1.641 . . . . 0.0 114.462 -167.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -108.29 161.99 14.49 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -174.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 64.3 t80 -146.42 159.19 43.71 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 126.828 2.051 . . . . 0.0 110.198 172.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 21.2 tt -129.47 136.9 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.706 0 C-N-CA 124.913 1.285 . . . . 0.0 111.97 -175.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.54 160.6 14.31 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 125.311 1.444 . . . . 0.0 111.172 -179.442 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -124.53 139.01 52.07 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.774 0 C-N-CA 125.251 1.42 . . . . 0.0 111.214 176.478 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 19.3 t0 -149.81 128.56 12.45 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 125.243 1.417 . . . . 0.0 111.048 -177.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -81.71 -12.97 58.41 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.232 1.013 . . . . 0.0 112.917 173.234 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 60.41 14.54 4.83 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 129.039 2.936 . . . . 0.0 115.494 176.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 66.1 mm-40 -137.61 152.42 49.35 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 126.096 1.758 . . . . 0.0 111.726 176.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -134.88 4.13 3.26 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.583 1.553 . . . . 0.0 114.75 -179.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -110.21 154.44 23.37 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 125.028 1.331 . . . . 0.0 112.411 -179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.7 pttp -79.25 161.65 66.99 Favored Pre-proline 0 N--CA 1.476 0.836 0 C-N-CA 124.604 1.162 . . . . 0.0 112.665 176.511 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -61.46 162.98 19.0 Favored 'Trans proline' 0 CA--C 1.541 0.861 0 C-N-CA 123.312 2.675 . . . . 0.0 114.173 171.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -118.3 155.18 31.07 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 126.164 1.786 . . . . 0.0 111.172 174.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 40.2 t -128.17 138.03 55.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 C-N-CA 125.145 1.378 . . . . 0.0 110.743 -176.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.598 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 60.5 tp -126.33 -49.26 0.03 OUTLIER Pre-proline 0 CA--C 1.549 0.905 0 C-N-CA 125.743 1.617 . . . . 0.0 113.686 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.598 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 90.7 Cg_endo -73.15 162.36 40.89 Favored 'Trans proline' 0 C--N 1.354 0.831 0 C-N-CA 122.064 1.842 . . . . 0.0 112.629 176.758 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 59.7 t80 -143.13 150.48 39.51 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 125.206 1.402 . . . . 0.0 111.721 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 5.5 t-80 -136.55 12.26 3.21 Favored 'General case' 0 CA--C 1.551 0.994 0 N-CA-C 114.401 1.26 . . . . 0.0 114.401 -172.74 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 5.2 m 54.06 58.31 5.15 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 125.468 1.507 . . . . 0.0 113.303 172.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.3 tt -136.35 137.28 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 C-N-CA 125.088 1.355 . . . . 0.0 111.888 -176.393 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 35.6 p90 -156.01 160.52 40.1 Favored 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 127.029 2.132 . . . . 0.0 110.477 177.305 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 40.4 t -89.13 139.83 30.07 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.646 0.779 . . . . 0.0 110.526 170.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -69.85 -37.34 76.11 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 114.636 1.347 . . . . 0.0 114.636 -169.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 37.7 t30 -100.02 -33.77 10.36 Favored 'General case' 0 N--CA 1.471 0.597 0 N-CA-C 114.242 1.201 . . . . 0.0 114.242 -168.035 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 68.4 m -95.05 -11.71 27.86 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 114.699 1.37 . . . . 0.0 114.699 -161.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 75.65 -20.64 2.19 Favored Glycine 0 CA--C 1.538 1.495 0 C-N-CA 125.056 1.312 . . . . 0.0 114.367 -169.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -76.15 177.56 50.37 Favored Glycine 0 CA--C 1.535 1.322 0 C-N-CA 125.2 1.381 . . . . 0.0 113.95 170.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.4 mttt -141.93 147.7 37.48 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.585 1.554 . . . . 0.0 111.609 -172.487 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.29 9.83 55.55 Favored Glycine 0 CA--C 1.538 1.525 0 N-CA-C 117.545 1.778 . . . . 0.0 117.545 162.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.409 ' C ' ' H ' ' A' ' 118' ' ' GLY . 3.0 p80 -83.05 -154.35 0.14 Allowed 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.489 1.644 . . . . 0.0 112.103 178.858 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 46.6 p90 -65.05 25.96 0.02 OUTLIER 'General case' 0 CA--C 1.556 1.193 0 C-N-CA 126.572 1.949 . . . . 0.0 114.556 167.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . 0.409 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -43.13 -29.43 0.94 Allowed Glycine 0 CA--C 1.538 1.482 0 C-N-CA 129.083 3.23 . . . . 0.0 115.044 168.792 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -60.83 -38.06 84.18 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 125.745 1.618 . . . . 0.0 114.08 176.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -102.85 -21.47 14.01 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.49 1.516 . . . . 0.0 112.36 176.449 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 24.9 t -76.88 51.53 0.79 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 126.721 2.008 . . . . 0.0 111.097 169.762 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -104.36 -30.85 9.84 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.479 1.912 . . . . 0.0 114.592 -159.547 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -136.59 157.65 46.28 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.607 1.163 . . . . 0.0 112.918 -170.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 64.4 tttm . . . . . 0 C--O 1.251 1.167 0 C-N-CA 126.077 1.751 . . . . 0.0 112.012 177.384 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 19.9 ttpp . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 111.351 0.13 . . . . 0.0 111.351 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 -123.67 151.39 43.15 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.775 1.63 . . . . 0.0 111.28 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -84.59 112.9 20.84 Favored 'General case' 0 CA--C 1.542 0.652 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 -166.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -80.95 -54.35 0.74 Allowed Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 123.824 0.849 . . . . 0.0 112.076 155.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo -76.7 -48.32 0.13 Allowed 'Trans proline' 0 C--N 1.354 0.855 0 C-N-CA 122.382 2.055 . . . . 0.0 114.313 -177.413 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.262 7.0 pttm 42.17 -165.14 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.187 0 C-N-CA 125.571 1.549 . . . . 0.0 112.587 -148.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 16.8 m -54.13 148.74 10.56 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 119.848 -1.782 . . . . 0.0 113.8 -178.124 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.416 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 56.0 t30 -60.33 -39.69 87.98 Favored 'General case' 0 CA--C 1.544 0.745 0 C-N-CA 123.558 0.743 . . . . 0.0 112.0 174.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.8 t-20 -136.81 -48.31 0.62 Allowed 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 114.521 1.304 . . . . 0.0 114.521 -169.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 29.5 p -97.95 16.78 19.92 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 115.93 1.826 . . . . 0.0 115.93 -167.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.0 m 52.23 59.1 4.76 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 118.054 2.612 . . . . 0.0 118.054 164.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -129.67 164.76 23.22 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.897 1.279 . . . . 0.0 111.899 165.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.2 ttt180 -94.31 155.59 16.93 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 126.256 1.822 . . . . 0.0 111.828 176.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 86.77 -19.37 29.62 Favored Glycine 0 N--CA 1.474 1.181 0 C-N-CA 125.087 1.327 . . . . 0.0 115.958 170.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.279 11.8 p-80 -126.73 55.95 1.51 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 123.756 1.741 . . . . 0.0 109.925 170.61 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.659 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -61.67 -179.4 0.18 Allowed 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 127.528 2.331 . . . . 0.0 114.808 -173.878 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.416 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -14.81 -71.52 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 128.788 2.835 . . . . 0.0 115.74 -177.845 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -77.01 -20.56 55.87 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 115.878 1.807 . . . . 0.0 115.878 -178.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -94.34 -2.97 51.26 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 127.217 2.207 . . . . 0.0 113.243 175.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 3.9 t -61.76 -41.12 75.69 Favored Pre-proline 0 CA--C 1.557 1.223 0 C-N-CA 126.491 1.917 . . . . 0.0 114.329 176.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -70.61 163.41 39.03 Favored 'Trans proline' 0 C--N 1.359 1.097 0 C-N-CA 122.542 2.161 . . . . 0.0 112.926 171.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 12.4 p-80 -71.22 137.04 48.34 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 -177.082 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -140.41 7.01 0.54 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 -170.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 10.4 pt -60.42 147.23 9.97 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 CA-C-N 119.947 1.249 . . . . 0.0 112.876 177.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 77.0 m -73.08 -65.09 0.85 Allowed 'General case' 0 N--CA 1.471 0.594 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -177.198 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 4.6 m -149.2 -61.54 0.22 Allowed 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 124.274 1.03 . . . . 0.0 112.215 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.4 t80 -146.55 59.16 1.21 Allowed 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 125.72 1.608 . . . . 0.0 110.267 -178.079 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.4 p -151.99 168.18 26.04 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 125.976 1.711 . . . . 0.0 111.112 179.569 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 52.09 -152.93 6.16 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 125.792 1.663 . . . . 0.0 113.454 -175.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -127.89 146.41 50.64 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 125.202 1.401 . . . . 0.0 108.946 164.449 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.1 t -60.41 -23.77 64.63 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 113.46 0.911 . . . . 0.0 113.46 178.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -92.85 -11.32 33.88 Favored 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 125.537 1.535 . . . . 0.0 113.991 175.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 25.1 t0 -156.26 100.03 1.97 Allowed 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 125.268 1.427 . . . . 0.0 111.622 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 24.4 t-80 -150.26 143.54 25.01 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.008 0.923 . . . . 0.0 112.857 -176.314 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 37.3 t80 -165.57 170.9 13.77 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 128.668 2.787 . . . . 0.0 108.472 178.524 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 42.8 m -57.36 -32.41 66.73 Favored 'General case' 0 N--CA 1.474 0.76 0 O-C-N 120.343 -1.473 . . . . 0.0 114.545 177.947 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.3 mtm180 -96.5 3.83 52.47 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.86 1.264 . . . . 0.0 114.288 171.643 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.0 m-70 -116.92 0.55 12.48 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.348 1.459 . . . . 0.0 113.354 173.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.3 m -37.28 -50.64 2.41 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.253 1.421 . . . . 0.0 112.445 155.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 95.6 Cg_endo -82.1 23.57 0.77 Allowed 'Trans proline' 0 CA--C 1.552 1.376 0 C-N-CA 124.639 3.559 . . . . 0.0 116.437 176.481 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.6 tppt? -75.19 -84.73 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 120.196 -1.565 . . . . 0.0 112.643 -178.68 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -93.22 -12.22 30.75 Favored 'General case' 0 CA--C 1.541 0.627 0 N-CA-C 114.31 1.226 . . . . 0.0 114.31 -167.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 31.0 mt -141.46 112.9 3.62 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.538 0 C-N-CA 125.756 1.622 . . . . 0.0 107.09 -169.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . 0.271 3.8 pm0 47.48 174.1 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 125.891 1.676 . . . . 0.0 115.072 -159.219 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 59.3 m -140.48 151.63 44.98 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 127.112 2.165 . . . . 0.0 109.483 -177.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.5 p -71.76 -32.11 67.34 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 125.258 1.423 . . . . 0.0 113.192 173.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -99.81 -34.14 10.28 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 126.052 1.741 . . . . 0.0 113.004 177.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 3.1 m -103.67 -1.43 28.12 Favored 'General case' 0 CA--C 1.548 0.886 0 N-CA-C 114.928 1.455 . . . . 0.0 114.928 -170.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.4 t0 58.45 -155.96 0.34 Allowed 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 125.402 1.481 . . . . 0.0 113.19 -171.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -42.51 8.27 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.275 1 C-N-CA 134.139 4.976 . . . . 0.0 121.123 -169.709 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 4.8 m -101.75 -36.01 4.44 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 C-N-CA 125.527 1.531 . . . . 0.0 114.498 -161.064 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 71.44 164.83 6.45 Favored Glycine 0 CA--C 1.541 1.672 0 C-N-CA 124.351 0.977 . . . . 0.0 114.462 -174.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 77.3 m80 -87.12 28.61 0.91 Allowed 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.899 1.28 . . . . 0.0 114.078 -178.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 60.7 t80 -65.68 154.04 40.0 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 121.122 -0.986 . . . . 0.0 112.126 171.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.73 -23.68 44.29 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 126.612 1.965 . . . . 0.0 114.946 -172.159 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.7 m -104.37 4.18 33.17 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 179.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 56.0 mm-40 -119.47 -37.92 3.09 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 125.992 1.717 . . . . 0.0 111.847 -177.262 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 91.0 m -129.65 159.38 69.9 Favored Pre-proline 0 CA--C 1.55 0.946 0 C-N-CA 126.582 1.953 . . . . 0.0 110.97 169.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_exo -60.51 143.92 99.48 Favored 'Trans proline' 0 CA--C 1.538 0.71 0 C-N-CA 123.064 2.509 . . . . 0.0 113.009 174.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 22.0 p80 -85.03 -36.79 21.03 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.33 0.863 . . . . 0.0 113.33 -177.45 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -143.58 158.54 43.58 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 127.179 2.192 . . . . 0.0 110.705 175.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.2 m-90 -123.83 3.21 8.81 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.63 1.344 . . . . 0.0 114.63 -172.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -144.21 141.18 29.74 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 125.855 1.662 . . . . 0.0 111.244 -173.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -76.17 -39.75 54.13 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 124.537 1.135 . . . . 0.0 113.231 -178.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.8 p -146.05 133.08 14.75 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 126.952 2.101 . . . . 0.0 108.197 174.711 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 35.1 tp60 -66.19 -30.58 71.07 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 122.729 0.412 . . . . 0.0 111.807 -175.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 5.3 m -74.32 170.24 16.01 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-O 123.764 1.745 . . . . 0.0 113.109 175.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 19.2 p -135.16 -23.29 1.51 Allowed 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 127.796 2.438 . . . . 0.0 111.209 -162.618 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 7.0 mp -78.39 -23.78 46.64 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 126.373 1.869 . . . . 0.0 111.441 165.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.2 m -104.28 155.51 18.69 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.708 1.203 . . . . 0.0 113.568 -163.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -81.86 164.77 21.37 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 124.736 1.215 . . . . 0.0 109.904 164.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 12.7 p -73.25 41.29 0.11 Allowed 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 128.604 2.762 . . . . 0.0 114.501 179.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -98.08 163.13 12.88 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 127.424 2.29 . . . . 0.0 110.983 177.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -55.31 146.35 19.54 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.081 1.352 . . . . 0.0 112.643 179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 2.0 m-70 -133.77 160.73 36.72 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 126.079 1.752 . . . . 0.0 111.167 178.531 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.7 t -100.68 146.04 27.68 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.055 0.942 . . . . 0.0 112.565 164.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -62.2 -40.55 96.43 Favored 'General case' 0 N--CA 1.473 0.704 0 C-N-CA 125.128 1.371 . . . . 0.0 113.499 -177.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -95.83 -19.81 19.31 Favored 'General case' 0 N--CA 1.475 0.803 0 N-CA-C 113.985 1.105 . . . . 0.0 113.985 -178.638 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 26.4 mmt180 -124.89 -2.34 7.77 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 115.343 1.609 . . . . 0.0 115.343 -167.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.422 ' HB3' ' HD3' ' A' ' 81' ' ' PRO 0.417 21.7 t 49.02 -99.26 0.0 OUTLIER Pre-proline 0 CA--C 1.556 1.208 0 CA-C-O 115.165 -2.35 . . . . 0.0 114.745 175.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . 0.422 ' HD3' ' HB3' ' A' ' 80' ' ' CYS . 32.0 Cg_exo -63.01 -31.48 76.61 Favored 'Trans proline' 0 C--N 1.36 1.153 0 CA-C-N 124.693 2.712 . . . . 0.0 114.218 176.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 75.3 m -87.46 151.72 22.82 Favored 'General case' 0 N--CA 1.466 0.353 0 C-N-CA 124.604 1.162 . . . . 0.0 112.576 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.8 tt -149.8 157.22 6.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.445 0 C-N-CA 124.859 1.263 . . . . 0.0 111.043 -171.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 29.2 t-105 -68.42 132.62 47.34 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 123.244 0.618 . . . . 0.0 112.281 178.916 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 94.8 mtt180 -137.36 3.66 2.6 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 125.742 1.617 . . . . 0.0 113.797 179.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -89.75 154.07 20.21 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 114.427 1.269 . . . . 0.0 114.427 -168.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.1 t80 -150.44 159.26 44.6 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 126.152 1.781 . . . . 0.0 111.302 178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -132.19 149.63 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 125.791 1.636 . . . . 0.0 112.726 -175.129 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.9 tp -74.92 -28.22 60.52 Favored 'General case' 0 N--CA 1.474 0.767 0 N-CA-C 114.152 1.167 . . . . 0.0 114.152 -172.963 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.305 9.8 p 46.91 37.74 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 C-N-CA 126.59 1.956 . . . . 0.0 114.715 175.203 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 55.08 22.22 4.37 Favored 'General case' 0 CA--C 1.555 1.164 0 C-N-CA 126.746 2.019 . . . . 0.0 115.338 -177.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -84.9 155.73 21.56 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 125.307 1.443 . . . . 0.0 113.663 -176.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 56.1 t-20 -131.82 132.78 44.02 Favored 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 126.07 1.748 . . . . 0.0 110.954 178.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.6 tp10 -78.56 -30.32 46.79 Favored 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 124.998 1.319 . . . . 0.0 113.465 -178.055 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 19.7 ptpt -108.87 157.38 18.66 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 125.409 1.483 . . . . 0.0 114.098 -171.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.28 160.61 41.78 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.952 1.701 . . . . 0.0 111.472 178.07 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 98.5 mttt -70.81 134.17 86.05 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 124.112 0.965 . . . . 0.0 111.171 178.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_exo -66.76 -28.46 43.56 Favored 'Trans proline' 0 CA--C 1.54 0.793 0 C-N-CA 122.853 2.369 . . . . 0.0 114.748 177.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -150.27 161.94 41.47 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 126.449 1.9 . . . . 0.0 112.126 -173.291 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 33.2 m -89.03 -5.97 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.098 0 C-N-CA 124.481 1.112 . . . . 0.0 113.588 175.083 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -90.07 149.07 40.88 Favored Pre-proline 0 CA--C 1.549 0.921 0 C-N-CA 124.451 1.101 . . . . 0.0 111.8 -179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_exo -63.42 175.29 2.81 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 123.937 3.091 . . . . 0.0 114.616 172.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -108.66 -11.13 15.13 Favored 'General case' 0 CA--C 1.548 0.866 0 C-N-CA 125.382 1.473 . . . . 0.0 113.935 173.499 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 19.8 t-80 -92.87 17.47 10.51 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 125.406 1.482 . . . . 0.0 113.403 -176.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 p -70.23 -13.82 62.34 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 126.687 1.995 . . . . 0.0 115.272 -167.466 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 40.1 pt -106.51 6.56 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 C-N-CA 125.306 1.443 . . . . 0.0 113.615 178.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -119.51 154.82 33.23 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.335 1.454 . . . . 0.0 113.492 -174.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 1.8 t -82.38 157.81 23.58 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 127.835 2.454 . . . . 0.0 111.563 176.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 53.5 t80 -141.0 -23.27 0.77 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.932 1.693 . . . . 0.0 114.471 179.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -114.36 172.94 6.71 Favored 'General case' 0 CA--C 1.554 1.127 0 C-N-CA 126.899 2.08 . . . . 0.0 111.827 177.886 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.326 14.5 p 51.65 12.36 0.17 Allowed 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 128.809 2.844 . . . . 0.0 118.6 170.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 163.6 -165.79 36.99 Favored Glycine 0 CA--C 1.534 1.275 0 C-N-CA 125.45 1.5 . . . . 0.0 112.942 -179.839 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -72.86 149.58 43.22 Favored Glycine 0 CA--C 1.537 1.419 0 C-N-CA 123.938 0.78 . . . . 0.0 112.823 172.544 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 6.2 ptpp? -62.43 -15.49 49.73 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 115.936 1.828 . . . . 0.0 115.936 -170.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -78.9 -22.0 67.1 Favored Glycine 0 CA--C 1.536 1.4 0 CA-C-O 118.563 -1.132 . . . . 0.0 115.83 -179.151 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.1 p80 -79.67 134.74 36.43 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 120.13 1.965 . . . . 0.0 114.761 -162.127 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 31.62 36.25 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 130.378 3.471 . . . . 0.0 117.388 169.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.76 -17.67 43.13 Favored Glycine 0 CA--C 1.537 1.41 0 C-N-CA 124.859 1.219 . . . . 0.0 115.153 -170.403 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 18.2 m-20 -63.39 -35.24 79.75 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.247 1.819 . . . . 0.0 113.799 172.701 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 38.0 t70 -131.51 -12.38 3.47 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 125.822 1.649 . . . . 0.0 113.816 -170.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 26.8 t -60.32 132.78 54.98 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.474 1.11 . . . . 0.0 111.454 177.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm -88.44 3.78 48.82 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 115.584 1.698 . . . . 0.0 115.584 -159.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -68.38 157.79 34.98 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 177.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt . . . . . 0 C--O 1.253 1.267 0 C-N-CA 125.008 1.323 . . . . 0.0 114.483 -175.202 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 46.1 mmtm . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 120.286 0.089 . . . . 0.0 110.771 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -92.23 -16.58 25.98 Favored 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 113.742 1.016 . . . . 0.0 113.742 -177.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -150.18 141.96 23.7 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 125.057 1.343 . . . . 0.0 111.882 178.903 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.29 -50.52 28.6 Favored Pre-proline 0 CA--C 1.552 1.056 0 C-N-CA 124.01 0.924 . . . . 0.0 113.229 164.334 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -75.78 -39.34 0.99 Allowed 'Trans proline' 0 C--N 1.354 0.867 0 C-N-CA 122.707 2.271 . . . . 0.0 114.988 -175.826 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.4 tmmm? 58.37 -57.77 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 C-N-CA 128.441 2.696 . . . . 0.0 116.283 -170.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.6 t -155.22 159.47 40.11 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 127.257 2.223 . . . . 0.0 111.525 177.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 12.2 p-10 -72.99 -30.16 63.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 175.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 55.6 t30 -161.23 -42.2 0.04 OUTLIER 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 125.208 1.403 . . . . 0.0 112.74 -172.206 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 5.1 m -74.4 -12.75 60.6 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -168.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 66.2 m 54.31 26.34 6.78 Favored 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 115.956 1.836 . . . . 0.0 115.956 -173.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 mm-40 -98.12 161.32 13.77 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.041 1.336 . . . . 0.0 112.717 175.077 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.5 ptm180 -72.28 161.33 30.99 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.63 1.572 . . . . 0.0 113.882 -175.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 79.05 -71.4 2.62 Favored Glycine 0 CA--C 1.531 1.088 0 C-N-CA 125.177 1.37 . . . . 0.0 114.174 172.81 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.278 0.6 OUTLIER -83.51 77.46 9.82 Favored 'General case' 0 CA--C 1.546 0.81 0 CA-C-O 123.15 1.452 . . . . 0.0 112.9 -172.371 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -60.6 -179.4 0.12 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 127.261 2.225 . . . . 0.0 113.498 175.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.7 -62.84 0.57 Allowed 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 126.164 1.786 . . . . 0.0 114.062 -171.393 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.0 ptpt -80.41 -2.75 46.98 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.62 1.968 . . . . 0.0 115.419 179.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -108.31 -17.9 13.89 Favored 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.746 1.618 . . . . 0.0 113.664 -179.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 23.6 t -48.91 -48.66 71.17 Favored Pre-proline 0 CA--C 1.551 1.018 0 N-CA-C 115.275 1.583 . . . . 0.0 115.275 -172.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 64.0 Cg_endo -83.64 -2.08 10.3 Favored 'Trans proline' 0 CA--C 1.544 1.016 0 C-N-CA 122.461 2.108 . . . . 0.0 114.545 179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -94.47 155.5 16.91 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 125.361 1.464 . . . . 0.0 113.207 -174.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.7 pp -119.05 9.9 6.78 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 125.552 1.541 . . . . 0.0 114.26 -174.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 11.4 pt -81.56 152.03 4.25 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 124.556 1.143 . . . . 0.0 112.109 173.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 28.6 p -134.79 152.85 52.09 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 125.484 1.514 . . . . 0.0 111.109 174.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER 51.71 20.82 1.2 Allowed 'General case' 0 CA--C 1.552 1.056 0 C-N-CA 125.584 1.554 . . . . 0.0 115.028 176.504 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 20.2 t80 47.87 34.31 3.89 Favored 'General case' 0 CA--C 1.551 0.986 0 C-N-CA 126.863 2.065 . . . . 0.0 114.45 -169.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 14.0 p -93.56 2.38 56.41 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 115.143 1.535 . . . . 0.0 115.143 -172.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -157.63 167.31 34.09 Favored Glycine 0 CA--C 1.528 0.879 0 C-N-CA 123.833 0.73 . . . . 0.0 114.639 -177.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.09 135.15 34.52 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 123.807 0.843 . . . . 0.0 110.736 172.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 4.5 t -64.6 -14.63 58.71 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 113.837 1.051 . . . . 0.0 113.837 -176.937 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -85.76 -18.11 33.93 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 124.931 1.292 . . . . 0.0 114.275 176.46 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -140.76 -5.29 1.18 Allowed 'General case' 0 N--CA 1.479 1.018 0 N-CA-C 116.477 2.029 . . . . 0.0 116.477 -174.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -63.48 142.29 58.45 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.419 1.087 . . . . 0.0 112.288 174.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 18.4 t80 -136.08 111.77 9.38 Favored 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 125.289 1.435 . . . . 0.0 109.189 176.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 61.9 p -64.27 -20.59 66.16 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -168.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.3 tpt180 -69.14 -24.83 64.14 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 125.388 1.475 . . . . 0.0 112.973 173.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -132.83 -34.02 1.16 Allowed 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 114.911 1.449 . . . . 0.0 114.911 -167.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 46.9 m 60.78 166.51 0.09 OUTLIER Pre-proline 0 CA--C 1.559 1.326 0 C-N-CA 126.89 2.076 . . . . 0.0 114.059 -166.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -119.6 -170.57 0.01 OUTLIER 'Trans proline' 0 CA--C 1.548 1.19 0 C-N-CA 122.495 2.13 . . . . 0.0 114.365 -155.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.96 66.64 0.91 Allowed 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 126.817 2.047 . . . . 0.0 109.48 167.101 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -126.05 -36.64 2.33 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 114.529 1.307 . . . . 0.0 114.529 -163.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 12.3 mt -126.93 35.04 1.31 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 C-N-CA 126.832 2.053 . . . . 0.0 108.453 177.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 mp0 -145.57 154.76 42.52 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 129.287 3.035 . . . . 0.0 107.817 -179.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 31.3 p -70.46 170.32 12.26 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-O 122.027 0.918 . . . . 0.0 112.237 167.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -70.21 134.65 48.28 Favored 'General case' 0 N--CA 1.467 0.421 0 O-C-N 121.724 -0.61 . . . . 0.0 111.04 165.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.318 19.4 ptpt 53.65 136.94 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 129.62 3.168 . . . . 0.0 115.463 -165.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . 0.298 0.5 OUTLIER 55.55 179.55 0.03 OUTLIER 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 126.355 1.862 . . . . 0.0 114.874 -160.498 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -120.06 32.27 6.12 Favored 'General case' 0 CA--C 1.547 0.836 0 C-N-CA 126.301 1.841 . . . . 0.0 114.854 -158.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -133.24 162.19 32.46 Favored 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 125.379 1.472 . . . . 0.0 112.136 -176.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 12.7 t -69.06 129.88 33.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.353 1.461 . . . . 0.0 112.42 -174.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 59.98 -169.13 7.61 Favored Glycine 0 CA--C 1.539 1.588 0 C-N-CA 124.703 1.144 . . . . 0.0 115.046 174.471 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -130.79 2.36 4.43 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.382 1.253 . . . . 0.0 114.382 168.959 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 55.1 t80 -71.0 158.74 35.99 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 123.699 0.8 . . . . 0.0 111.802 173.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -64.26 149.96 46.97 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.664 0.786 . . . . 0.0 110.607 178.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 m 63.96 -18.61 0.07 Allowed 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 116.645 2.091 . . . . 0.0 116.645 -170.254 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.5 mt-30 -86.64 -47.13 9.44 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.476 1.11 . . . . 0.0 110.93 169.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 27.9 t -122.72 62.45 17.85 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 126.289 1.836 . . . . 0.0 110.86 176.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -68.94 -12.76 35.22 Favored 'Trans proline' 0 CA--C 1.542 0.903 0 C-N-CA 124.208 3.272 . . . . 0.0 115.063 -170.449 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 75.9 m80 -71.94 149.5 45.0 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.848 1.259 . . . . 0.0 112.722 179.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 62.2 mttp -124.48 -20.39 5.17 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 115.515 1.672 . . . . 0.0 115.515 -160.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 12.6 t90 -98.13 173.37 7.06 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 124.118 0.967 . . . . 0.0 112.9 -179.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 68.6 mttm -64.57 158.36 24.45 Favored 'General case' 0 N--CA 1.474 0.725 0 C-N-CA 125.629 1.571 . . . . 0.0 112.485 176.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . 0.253 0.0 OUTLIER -85.89 30.64 0.65 Allowed 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 115.83 1.789 . . . . 0.0 115.83 -168.487 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.4 t -65.1 114.07 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 123.776 0.83 . . . . 0.0 110.855 -176.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.8 tt0 -66.23 -25.21 66.79 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.491 1.117 . . . . 0.0 113.398 -169.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 60.6 m -76.49 -3.14 35.71 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.586 1.554 . . . . 0.0 114.906 176.803 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 10.8 t 58.64 -42.45 0.06 Allowed 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.865 3.266 . . . . 0.0 118.072 -172.719 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.3 pp -104.87 -9.41 18.02 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 125.994 1.717 . . . . 0.0 114.333 -176.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 27.4 t -74.07 138.9 44.29 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.403 0.62 . . . . 0.0 112.468 -172.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 58.7 tptt -155.19 142.26 19.25 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 126.509 1.924 . . . . 0.0 109.356 179.45 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 8.3 m 58.16 34.85 24.56 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 114.708 1.373 . . . . 0.0 114.708 177.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 29.0 ttmt 54.86 34.8 22.85 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 126.332 1.853 . . . . 0.0 114.53 174.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.0 mtmm -69.44 152.11 45.29 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.973 0.909 . . . . 0.0 111.342 170.583 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 5.7 p-80 49.77 6.84 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 127.827 2.451 . . . . 0.0 117.359 -173.851 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 30.0 m -80.4 -22.4 41.29 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 -155.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -57.79 117.5 4.32 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.86 0.864 . . . . 0.0 111.433 -172.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 55.76 20.9 4.31 Favored 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 126.093 1.757 . . . . 0.0 115.138 -175.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 74.6 mtt85 -115.33 -44.14 3.01 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.096 1.758 . . . . 0.0 112.541 171.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 67.8 m -94.57 -16.47 0.21 Allowed Pre-proline 0 CA--C 1.553 1.093 0 N-CA-C 117.915 2.561 . . . . 0.0 117.915 -176.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -53.85 -22.48 23.91 Favored 'Trans proline' 0 C--N 1.356 0.927 0 C-N-CA 123.065 2.51 . . . . 0.0 116.819 -179.284 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 21.9 m -62.4 -15.17 47.45 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 116.115 1.895 . . . . 0.0 116.115 -176.021 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 7.8 tp -110.51 3.02 8.96 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.833 0 C-N-CA 125.248 1.419 . . . . 0.0 113.21 175.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 35.8 m0 -101.15 153.27 19.73 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 125.246 1.418 . . . . 0.0 112.169 -179.718 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 39.2 mmt180 -135.47 141.61 45.39 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 125.977 1.711 . . . . 0.0 110.983 173.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -100.24 -9.18 22.67 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 114.411 1.263 . . . . 0.0 114.411 -175.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 96.2 m-85 -133.15 145.01 50.27 Favored 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.743 1.217 . . . . 0.0 113.257 -171.441 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 21.0 tt -146.39 134.26 15.4 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 C-N-CA 125.554 1.542 . . . . 0.0 108.983 155.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -113.68 132.61 55.73 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 124.577 1.151 . . . . 0.0 110.592 -178.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 29.4 m -108.65 3.27 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 125.805 1.642 . . . . 0.0 112.83 174.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.5 t70 -79.75 136.8 36.84 Favored 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 124.92 1.288 . . . . 0.0 112.243 179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.4 t0 -150.89 156.21 40.74 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 125.314 1.445 . . . . 0.0 111.846 179.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 24.8 t-20 61.72 164.73 0.09 Allowed 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 128.115 2.566 . . . . 0.0 114.409 -174.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 19.2 tt0 55.0 32.18 17.61 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 126.765 2.026 . . . . 0.0 113.63 -175.323 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 23.2 pttp -111.94 -3.79 14.73 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 126.31 1.844 . . . . 0.0 114.816 -171.228 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -68.9 149.6 48.71 Favored 'General case' 0 CA--C 1.545 0.765 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -171.048 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -139.49 152.56 69.2 Favored Pre-proline 0 N--CA 1.476 0.871 0 C-N-CA 127.15 2.18 . . . . 0.0 110.668 174.555 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 61.4 Cg_endo -68.68 -29.09 30.13 Favored 'Trans proline' 0 CA--C 1.542 0.875 0 C-N-CA 122.983 2.456 . . . . 0.0 113.073 176.436 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.274 60.8 pttt 52.52 174.9 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 129.773 3.229 . . . . 0.0 117.459 173.733 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -151.51 158.22 4.81 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 127.204 2.201 . . . . 0.0 109.556 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -107.38 109.19 62.59 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 124.734 1.214 . . . . 0.0 109.926 174.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -71.09 -12.42 30.31 Favored 'Trans proline' 0 CA--C 1.542 0.886 0 C-N-CA 123.5 2.8 . . . . 0.0 114.83 174.324 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -65.66 162.48 18.34 Favored 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 125.414 1.486 . . . . 0.0 113.591 -178.281 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 20.7 m80 -69.13 -21.28 64.03 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.273 1.429 . . . . 0.0 114.193 -177.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 6.3 m 55.38 45.45 25.36 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 126.217 1.807 . . . . 0.0 112.845 -178.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 45.9 pt -92.64 24.11 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.97 1.708 . . . . 0.0 112.401 174.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 31.0 t80 -109.52 164.22 12.71 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 126.314 1.846 . . . . 0.0 111.062 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 13.6 t -137.45 135.09 36.54 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 173.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -76.11 145.08 40.27 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.6 1.16 . . . . 0.0 111.287 171.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.3 t30 63.21 -53.32 0.19 Allowed 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 127.863 2.465 . . . . 0.0 115.341 -175.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 93.7 m -69.85 134.56 48.61 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.222 1.809 . . . . 0.0 112.874 -174.012 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -72.16 -14.54 76.53 Favored Glycine 0 CA--C 1.539 1.56 0 C-N-CA 123.849 0.738 . . . . 0.0 114.279 172.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -73.07 -11.69 79.12 Favored Glycine 0 CA--C 1.537 1.461 0 C-N-CA 125.132 1.349 . . . . 0.0 116.068 -177.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 35.7 ttpt 43.67 -85.22 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 128.795 2.838 . . . . 0.0 116.166 169.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -73.57 7.03 14.28 Favored Glycine 0 CA--C 1.538 1.515 0 C-N-CA 126.203 1.858 . . . . 0.0 116.546 -175.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -75.37 -158.07 0.08 Allowed 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 119.072 1.436 . . . . 0.0 112.442 175.458 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 88.7 m-85 -61.42 20.48 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.824 2.049 . . . . 0.0 115.056 169.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.14 -16.5 26.66 Favored Glycine 0 CA--C 1.537 1.458 0 C-N-CA 127.635 2.541 . . . . 0.0 116.378 -170.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -71.37 -35.79 71.22 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 125.195 1.398 . . . . 0.0 113.373 172.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -117.94 -16.97 9.84 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.936 2.094 . . . . 0.0 113.193 -167.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 21.2 p -58.91 145.41 41.44 Favored 'General case' 0 CA--C 1.544 0.745 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 -169.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 14.7 mmmm -76.89 156.71 31.91 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.682 1.193 . . . . 0.0 111.519 175.064 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -79.1 -9.52 59.57 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.665 1.357 . . . . 0.0 114.665 -179.472 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 87.1 tttt . . . . . 0 C--O 1.253 1.246 0 C-N-CA 126.228 1.811 . . . . 0.0 111.388 179.819 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 18.3 ttmm . . . . . 0 N--CA 1.491 1.581 0 N-CA-C 110.546 -0.168 . . . . 0.0 110.546 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 17.9 mm-40 -68.77 -22.25 64.3 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.502 1.297 . . . . 0.0 114.502 -174.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -139.99 136.95 34.28 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.734 1.214 . . . . 0.0 112.202 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.95 -50.66 21.31 Favored Pre-proline 0 CA--C 1.549 0.908 0 C-N-CA 123.966 0.906 . . . . 0.0 112.98 165.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 82.3 Cg_endo -79.55 -35.23 0.84 Allowed 'Trans proline' 0 C--N 1.355 0.91 0 C-N-CA 122.304 2.003 . . . . 0.0 113.942 -178.326 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 7.4 mmtt 48.04 -166.19 0.02 OUTLIER 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 124.211 1.005 . . . . 0.0 111.431 -151.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 60.9 m -57.93 158.09 7.0 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 120.513 -1.367 . . . . 0.0 111.926 163.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.405 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 42.7 t30 -66.38 97.0 0.39 Allowed 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.185 -0.947 . . . . 0.0 110.032 169.753 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 18.3 t-20 61.28 -33.86 0.09 Allowed 'General case' 0 CA--C 1.552 1.051 0 C-N-CA 128.529 2.732 . . . . 0.0 117.543 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 20.8 p -81.54 -2.6 50.5 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 115.112 1.523 . . . . 0.0 115.112 -172.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 93.4 p 49.34 0.27 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 120.003 3.334 . . . . 0.0 120.003 170.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.1 mt-30 -118.84 125.75 50.25 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 120.643 1.565 . . . . 0.0 113.695 -169.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.263 39.6 ptt180 50.22 122.47 0.0 OUTLIER 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 130.983 3.713 . . . . 0.0 118.744 167.72 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 66.85 -143.82 44.16 Favored Glycine 0 CA--C 1.534 1.233 0 C-N-CA 124.148 0.88 . . . . 0.0 114.107 173.66 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -6.3 97.22 0.01 OUTLIER 'General case' 0 CA--C 1.555 1.137 0 C-N-CA 129.318 3.047 . . . . 0.0 117.609 177.027 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -62.33 -176.64 0.11 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.23 1.412 . . . . 0.0 114.187 170.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.405 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.0 OUTLIER -39.3 -67.47 0.22 Allowed 'General case' 0 N--CA 1.484 1.248 0 C-N-CA 126.404 1.882 . . . . 0.0 114.377 -174.154 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 64.9 pttt -74.55 -1.13 20.08 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.807 1.643 . . . . 0.0 115.111 178.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -98.69 -33.21 11.03 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.665 1.586 . . . . 0.0 111.886 176.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.6 m -46.63 -39.98 18.03 Favored Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 115.758 1.762 . . . . 0.0 115.758 174.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -73.13 -5.01 16.43 Favored 'Trans proline' 0 CA--C 1.544 0.993 0 CA-C-N 122.372 1.883 . . . . 0.0 115.37 -178.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 33.6 m170 -65.79 153.0 43.06 Favored 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 120.046 1.293 . . . . 0.0 112.72 173.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.0 pp -111.44 164.94 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.406 1.482 . . . . 0.0 113.018 -175.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.2 pt -83.53 122.77 38.08 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 C-N-CA 124.578 1.151 . . . . 0.0 111.434 175.531 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.6 p -84.5 143.52 29.3 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.309 0.644 . . . . 0.0 111.054 172.269 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 93.7 p 44.35 23.25 0.06 Allowed 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 127.306 2.242 . . . . 0.0 116.752 178.43 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.5 t80 50.18 32.82 6.39 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 126.135 1.774 . . . . 0.0 114.724 -171.666 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 16.4 p -79.32 -25.9 42.28 Favored 'General case' 0 CA--C 1.542 0.647 0 O-C-N 120.425 -1.422 . . . . 0.0 113.766 -173.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -127.32 172.35 18.71 Favored Glycine 0 CA--C 1.53 0.986 0 C-N-CA 125.854 1.692 . . . . 0.0 111.879 175.186 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -81.52 148.28 29.26 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 123.531 0.732 . . . . 0.0 110.99 176.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.2 t -66.02 -17.8 64.92 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 121.006 -1.059 . . . . 0.0 113.723 178.503 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -100.21 -4.53 29.29 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.202 1.401 . . . . 0.0 113.882 172.135 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 51.0 t0 -153.62 89.84 1.36 Allowed 'General case' 0 CA--C 1.543 0.706 0 C-N-CA 125.335 1.454 . . . . 0.0 111.291 179.176 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 28.7 t-80 -155.33 126.23 7.04 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.467 1.507 . . . . 0.0 109.426 -178.739 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -149.7 152.9 36.08 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.473 0.709 . . . . 0.0 112.818 -173.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.6 m -63.88 -26.35 68.57 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 115.282 1.586 . . . . 0.0 115.282 -168.802 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 17.3 ptm180 -103.21 145.81 29.36 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.816 0.847 . . . . 0.0 110.507 156.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.5 m170 67.46 -12.93 0.25 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 127.328 2.251 . . . . 0.0 116.48 -173.456 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.491 ' HB3' ' HD3' ' A' ' 40' ' ' PRO 0.313 2.8 t 21.56 -75.6 0.0 OUTLIER Pre-proline 0 CA--C 1.56 1.351 0 C-N-CA 129.841 3.256 . . . . 0.0 118.409 152.809 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.491 ' HD3' ' HB3' ' A' ' 39' ' ' CYS . 68.1 Cg_endo -79.47 -9.07 14.96 Favored 'Trans proline' 0 CA--C 1.548 1.184 0 C-N-CA 123.872 3.048 . . . . 0.0 116.555 -178.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 93.3 mttt -86.04 22.63 1.68 Allowed 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 125.499 1.52 . . . . 0.0 114.921 -166.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -121.62 0.14 9.82 Favored 'General case' 0 CA--C 1.547 0.837 0 N-CA-C 116.34 1.978 . . . . 0.0 116.34 -168.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 38.4 mm -101.33 39.87 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.231 0 C-N-CA 125.009 1.324 . . . . 0.0 109.559 170.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -151.46 160.33 43.77 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.237 1.415 . . . . 0.0 112.176 179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 38.6 t -102.82 166.99 10.15 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.797 1.639 . . . . 0.0 110.602 170.28 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 45.7 m -50.97 135.01 25.36 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.328 1.051 . . . . 0.0 112.413 170.282 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . 0.302 22.2 ptmt 47.74 22.36 0.34 Allowed 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 127.127 2.171 . . . . 0.0 116.13 -170.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 58.0 m -118.61 154.82 32.01 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 126.226 1.811 . . . . 0.0 110.54 172.577 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -102.61 -6.05 23.19 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.762 1.225 . . . . 0.0 113.774 171.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -138.58 178.83 6.85 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.346 2.258 . . . . 0.0 109.187 170.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 11.8 m -75.54 58.71 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.33 0 O-C-N 120.423 -1.423 . . . . 0.0 110.686 165.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -82.76 -5.9 88.98 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 118.534 2.174 . . . . 0.0 118.534 -147.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 32.4 p80 -147.67 160.48 42.64 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 119.851 1.825 . . . . 0.0 112.4 177.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 38.1 t80 57.02 116.37 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 127.658 2.383 . . . . 0.0 115.459 -176.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 53.3 mtt180 48.65 22.84 0.56 Allowed 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 126.632 1.973 . . . . 0.0 114.329 -175.152 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.1 m 51.6 30.28 6.39 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.98 1.712 . . . . 0.0 114.962 -170.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 15.3 tp60 -143.17 -17.36 0.65 Allowed 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.039 1.335 . . . . 0.0 113.887 -170.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 60.7 m 58.18 -174.3 0.02 OUTLIER Pre-proline 0 CA--C 1.557 1.231 0 C-N-CA 124.43 1.092 . . . . 0.0 110.622 -161.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -66.76 17.08 0.11 Allowed 'Trans proline' 0 CA--C 1.549 1.263 0 C-N-CA 122.985 2.456 . . . . 0.0 116.339 177.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 48.7 t-80 -76.2 152.01 36.73 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.795 1.238 . . . . 0.0 112.761 179.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -67.57 169.39 9.37 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 126.814 2.046 . . . . 0.0 113.81 175.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 91.8 m95 -121.0 167.78 12.22 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 126.174 1.79 . . . . 0.0 112.77 -175.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -86.81 162.57 17.72 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 125.423 1.489 . . . . 0.0 114.012 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 17.3 tppt? -149.45 153.84 37.92 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 127.701 2.4 . . . . 0.0 109.779 174.113 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.304 7.5 p 56.7 154.32 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.488 1.427 0 C-N-CA 129.382 3.073 . . . . 0.0 116.189 179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 26.2 pt20 -69.66 -4.51 19.78 Favored 'General case' 0 CA--C 1.547 0.844 0 O-C-N 120.485 -1.384 . . . . 0.0 114.728 -179.264 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.1 m -146.72 131.52 18.0 Favored 'General case' 0 N--CA 1.468 0.452 0 C-N-CA 125.728 1.611 . . . . 0.0 111.974 179.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 8.6 t -52.22 -34.53 46.11 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.996 0.918 . . . . 0.0 112.924 163.325 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 8.6 mp -66.91 -18.41 65.37 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.275 1.43 . . . . 0.0 114.66 176.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 55.8 m -88.48 6.73 36.32 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 114.484 1.29 . . . . 0.0 114.484 -174.471 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 53.0 tptt -50.97 109.28 0.31 Allowed 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.902 1.281 . . . . 0.0 110.284 163.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 13.6 m 55.44 21.96 4.68 Favored 'General case' 0 N--CA 1.48 1.043 0 N-CA-C 116.584 2.068 . . . . 0.0 116.584 175.565 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 57.7 tttp -152.28 142.99 22.87 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 126.137 1.775 . . . . 0.0 110.667 -178.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 21.1 ttmm -128.01 134.88 49.28 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 124.585 1.154 . . . . 0.0 112.138 179.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -138.12 15.18 2.83 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 125.683 1.593 . . . . 0.0 113.548 177.762 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 19.9 m -66.75 -32.78 74.3 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -151.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -65.14 -23.68 67.19 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 124.152 0.981 . . . . 0.0 113.339 176.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -100.06 -17.53 17.43 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 125.044 1.338 . . . . 0.0 113.964 179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 13.1 mmm180 -133.87 -36.28 0.94 Allowed 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 116.668 2.099 . . . . 0.0 116.668 -167.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m -85.65 137.15 36.32 Favored Pre-proline 0 CA--C 1.543 0.698 0 CA-C-N 119.716 1.143 . . . . 0.0 112.342 -169.406 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -62.24 -31.65 82.31 Favored 'Trans proline' 0 CA--C 1.541 0.83 0 C-N-CA 122.919 2.412 . . . . 0.0 114.331 176.356 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 38.8 m -113.41 131.29 56.06 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 125.271 1.428 . . . . 0.0 111.191 173.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 8.1 tp -79.3 165.05 3.04 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.688 0 C-N-CA 125.261 1.424 . . . . 0.0 112.59 -178.041 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 39.9 t-105 -69.12 166.08 18.98 Favored 'General case' 0 CA--C 1.547 0.844 0 N-CA-C 114.221 1.193 . . . . 0.0 114.221 -175.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 76.6 mtp180 -77.94 -11.21 59.88 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 126.893 2.077 . . . . 0.0 115.462 -168.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -131.12 152.79 50.05 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 114.303 1.223 . . . . 0.0 114.303 -168.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 13.5 p90 -146.31 161.23 40.77 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.634 2.374 . . . . 0.0 111.213 -176.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 12.2 tt -121.0 -1.39 7.95 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 114.44 1.274 . . . . 0.0 114.44 -174.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -68.72 138.93 55.3 Favored 'General case' 0 CA--C 1.543 0.689 0 O-C-N 120.809 -1.182 . . . . 0.0 111.7 179.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.93 8.53 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.133 0 C-N-CA 124.952 1.301 . . . . 0.0 113.586 -171.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -81.51 42.64 0.69 Allowed 'General case' 0 CA--C 1.551 1.019 0 C-N-CA 125.244 1.418 . . . . 0.0 113.667 -174.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -79.53 144.87 33.54 Favored 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 125.586 1.554 . . . . 0.0 112.444 -179.692 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -116.83 7.69 13.41 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 124.885 1.274 . . . . 0.0 114.317 -171.39 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 8.8 tp10 -136.21 148.26 48.02 Favored 'General case' 0 N--CA 1.473 0.711 0 C-N-CA 125.101 1.36 . . . . 0.0 111.524 178.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -135.67 143.99 45.76 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 126.742 2.017 . . . . 0.0 112.224 -172.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -92.47 161.01 14.8 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 124.511 1.124 . . . . 0.0 111.71 169.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 55.8 tttm -132.96 59.27 41.53 Favored Pre-proline 0 N--CA 1.479 0.98 0 C-N-CA 125.009 1.324 . . . . 0.0 112.905 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -71.31 144.82 46.89 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.09 2.527 . . . . 0.0 112.483 179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -153.06 150.12 28.82 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 126.214 1.806 . . . . 0.0 111.163 173.765 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 44.4 t -131.86 136.35 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.017 0 C-N-CA 125.472 1.509 . . . . 0.0 110.374 178.746 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 96.5 mt -132.81 94.64 20.9 Favored Pre-proline 0 CA--C 1.55 0.972 0 C-N-CA 125.994 1.717 . . . . 0.0 109.855 178.393 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -65.62 140.38 62.18 Favored 'Trans proline' 0 CA--C 1.54 0.798 0 C-N-CA 123.476 2.784 . . . . 0.0 114.563 -174.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -155.51 160.69 40.75 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.826 1.65 . . . . 0.0 111.436 174.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 35.0 p80 -149.69 171.25 16.99 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 124.423 1.089 . . . . 0.0 113.687 -172.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 4.4 m 59.91 61.67 1.84 Allowed 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 126.22 1.808 . . . . 0.0 113.035 177.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.8 pp -122.84 16.23 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 C-N-CA 125.16 1.384 . . . . 0.0 114.593 -173.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 23.3 p90 -143.37 156.83 44.78 Favored 'General case' 0 N--CA 1.471 0.622 0 N-CA-C 113.437 0.903 . . . . 0.0 113.437 174.164 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 34.7 t -158.72 156.64 30.24 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 126.827 2.051 . . . . 0.0 109.612 172.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 29.1 p90 -154.85 -16.96 0.12 Allowed 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 116.277 1.954 . . . . 0.0 116.277 174.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 47.6 m-20 -67.69 -18.4 64.91 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.776 1.398 . . . . 0.0 114.776 -172.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 19.1 p -134.12 32.32 3.46 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.843 1.257 . . . . 0.0 114.383 -173.813 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 81.55 16.06 74.39 Favored Glycine 0 CA--C 1.537 1.44 0 N-CA-C 116.699 1.44 . . . . 0.0 116.699 164.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -154.87 151.31 22.96 Favored Glycine 0 CA--C 1.531 1.061 0 C-N-CA 124.96 1.267 . . . . 0.0 112.026 176.44 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -111.18 -35.61 5.84 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 114.784 1.401 . . . . 0.0 114.784 -168.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -104.58 11.96 50.48 Favored Glycine 0 CA--C 1.535 1.311 0 N-CA-C 116.011 1.164 . . . . 0.0 116.011 -171.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.267 1.2 p80 -99.89 -137.05 0.31 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.911 1.356 . . . . 0.0 114.078 -168.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -74.34 35.7 0.1 Allowed 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 127.669 2.388 . . . . 0.0 113.139 -169.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.0 -18.35 8.79 Favored Glycine 0 CA--C 1.536 1.393 0 C-N-CA 128.05 2.738 . . . . 0.0 115.79 -172.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -61.21 -40.51 94.24 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.529 1.532 . . . . 0.0 113.304 170.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -130.51 -22.73 2.69 Favored 'General case' 0 CA--C 1.543 0.7 0 N-CA-C 115.264 1.579 . . . . 0.0 115.264 -165.711 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 16.2 p -78.14 19.33 0.44 Allowed 'General case' 0 CA--C 1.55 0.944 0 N-CA-C 116.158 1.91 . . . . 0.0 116.158 -165.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -71.77 153.96 41.62 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 125.841 1.656 . . . . 0.0 112.455 -175.484 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.39 0.98 57.05 Favored 'General case' 0 N--CA 1.477 0.924 0 N-CA-C 115.167 1.543 . . . . 0.0 115.167 -178.023 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 42.0 ttmt . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.932 1.693 . . . . 0.0 111.326 171.988 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.2 pttm . . . . . 0 N--CA 1.489 1.502 0 CA-C-O 121.48 0.657 . . . . 0.0 111.346 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -152.89 155.35 36.87 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.05 1.34 . . . . 0.0 111.6 -177.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.62 54.16 11.49 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.521 2.328 . . . . 0.0 114.805 171.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.64 -46.54 60.79 Favored Pre-proline 0 CA--C 1.554 1.117 0 N-CA-C 113.667 0.988 . . . . 0.0 113.667 168.099 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 76.2 Cg_endo -79.25 -42.37 0.18 Allowed 'Trans proline' 0 C--N 1.356 0.931 0 C-N-CA 122.262 1.975 . . . . 0.0 114.093 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.0 tmmm? 57.69 -56.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 128.923 2.889 . . . . 0.0 116.285 -171.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.8 t -156.96 160.02 38.65 Favored 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 127.58 2.352 . . . . 0.0 110.925 174.063 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 5.4 p-10 -72.64 -24.57 61.07 Favored 'General case' 0 CA--C 1.548 0.882 0 O-C-N 121.026 -1.047 . . . . 0.0 113.703 176.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -159.28 -37.65 0.06 Allowed 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 125.256 1.423 . . . . 0.0 112.978 -174.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.9 m -77.3 -163.88 0.42 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.59 1.156 . . . . 0.0 111.489 178.246 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 78.2 p -136.73 19.31 3.06 Favored 'General case' 0 N--CA 1.476 0.87 0 N-CA-C 114.996 1.48 . . . . 0.0 114.996 -173.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.0 pt20 -115.56 143.57 45.13 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 124.318 1.047 . . . . 0.0 112.47 172.016 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 45.9 ptt85 -78.69 -3.18 42.85 Favored 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.251 1.945 . . . . 0.0 116.251 -166.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -67.43 -20.82 71.98 Favored Glycine 0 CA--C 1.537 1.463 0 N-CA-C 115.207 0.843 . . . . 0.0 115.207 -176.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -151.43 89.72 1.52 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.846 1.258 . . . . 0.0 112.14 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -60.96 -179.55 0.14 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 125.884 1.674 . . . . 0.0 113.445 173.22 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -38.31 -65.08 0.37 Allowed 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 126.354 1.862 . . . . 0.0 114.675 -171.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 ptmm? -76.21 -9.7 58.84 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 126.329 1.852 . . . . 0.0 115.303 177.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -98.17 -20.48 17.27 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 125.263 1.425 . . . . 0.0 112.723 -178.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 5.9 t -66.0 -51.06 49.01 Favored Pre-proline 0 CA--C 1.547 0.856 0 C-N-CA 124.644 1.178 . . . . 0.0 113.835 177.152 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -78.21 158.85 30.01 Favored 'Trans proline' 0 C--N 1.353 0.773 0 C-N-CA 122.282 1.988 . . . . 0.0 112.481 174.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 63.1 t-80 -75.42 126.11 30.35 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.782 0.801 . . . . 0.0 109.93 164.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 9.9 tp -74.45 150.2 7.31 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 125.855 1.662 . . . . 0.0 114.788 -163.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 5.5 pt -73.14 161.66 4.79 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 126.631 1.972 . . . . 0.0 112.908 172.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 59.5 m -77.77 7.05 6.3 Favored 'General case' 0 CA--C 1.547 0.855 0 N-CA-C 114.261 1.208 . . . . 0.0 114.261 179.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 42.1 m 64.24 130.64 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 127.453 2.301 . . . . 0.0 114.57 -164.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.3 m-85 52.18 25.76 3.5 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 125.707 1.603 . . . . 0.0 114.261 -172.288 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.2 t -153.93 113.01 3.71 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 126.444 1.897 . . . . 0.0 108.6 -174.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 89.55 174.19 45.89 Favored Glycine 0 CA--C 1.53 0.983 0 C-N-CA 124.917 1.246 . . . . 0.0 115.441 179.724 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -111.67 139.11 47.39 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.342 1.457 . . . . 0.0 109.55 166.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 11.5 t -64.01 -22.93 67.14 Favored 'General case' 0 N--CA 1.475 0.822 0 N-CA-C 114.216 1.191 . . . . 0.0 114.216 -175.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -89.07 -14.19 36.93 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 114.305 1.224 . . . . 0.0 114.305 174.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -151.01 95.07 2.14 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.386 1.475 . . . . 0.0 111.707 -172.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 22.3 t60 -155.47 134.67 12.28 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.261 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 43.4 t80 -158.12 160.96 37.87 Favored 'General case' 0 N--CA 1.47 0.542 0 C-N-CA 125.342 1.457 . . . . 0.0 110.6 172.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 22.8 m -58.47 -28.63 65.52 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.063 1.745 . . . . 0.0 115.055 -175.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -72.6 -24.89 61.15 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.794 1.238 . . . . 0.0 113.367 174.378 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -122.05 -0.58 9.45 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 125.524 1.529 . . . . 0.0 114.414 -171.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -25.03 -60.06 0.14 Allowed Pre-proline 0 CA--C 1.554 1.131 0 C-N-CA 129.034 2.934 . . . . 0.0 117.665 -177.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -80.49 54.51 5.26 Favored 'Trans proline' 0 CA--C 1.55 1.291 0 C-N-CA 123.571 2.847 . . . . 0.0 114.298 -168.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -120.41 171.53 8.46 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.608 1.963 . . . . 0.0 113.533 -177.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.67 -60.89 0.17 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 128.565 2.746 . . . . 0.0 116.622 -179.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.2 mt -106.93 49.2 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 CA-C-O 123.245 1.498 . . . . 0.0 110.261 -164.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 86.0 mm-40 -148.19 165.15 31.77 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 127.939 2.496 . . . . 0.0 109.725 -177.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 10.6 p -126.0 124.38 40.58 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 124.529 1.132 . . . . 0.0 111.405 178.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 23.4 p -71.32 -16.12 62.43 Favored 'General case' 0 N--CA 1.473 0.684 0 N-CA-C 116.391 1.997 . . . . 0.0 116.391 -165.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 3.2 mppt? -93.05 -13.02 29.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 124.578 1.151 . . . . 0.0 113.269 176.663 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 52.3 t -143.3 -20.79 0.62 Allowed 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 114.685 1.365 . . . . 0.0 114.685 -157.365 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.9 m-20 60.58 141.5 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 128.114 2.566 . . . . 0.0 114.666 -162.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . 0.284 10.5 pt-20 46.54 126.23 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.367 0 C-N-CA 131.298 3.839 . . . . 0.0 119.225 -175.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 27.5 m -76.47 -12.15 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.337 0 O-C-N 119.08 -2.262 . . . . 0.0 112.04 163.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -67.43 4.94 3.37 Favored Glycine 0 CA--C 1.541 1.715 0 C-N-CA 126.43 1.967 . . . . 0.0 116.986 -177.23 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -130.26 169.87 14.85 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.732 1.613 . . . . 0.0 112.075 173.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 53.42 88.21 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 126.055 1.742 . . . . 0.0 112.926 -172.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 71.0 mtm180 53.64 26.05 5.46 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 126.349 1.86 . . . . 0.0 114.099 -173.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.6 m 55.12 23.04 4.96 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 125.645 1.578 . . . . 0.0 114.733 -172.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -141.35 -17.05 0.81 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 125.288 1.435 . . . . 0.0 114.022 -169.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 35.4 m 57.41 168.11 0.06 OUTLIER Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 125.827 1.651 . . . . 0.0 114.09 -154.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -65.44 -177.27 0.64 Allowed 'Trans proline' 0 CA--C 1.543 0.972 0 C-N-CA 123.623 2.882 . . . . 0.0 115.116 -178.897 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 58.0 t60 -58.89 164.08 3.08 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 125.112 1.365 . . . . 0.0 113.725 178.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 1.4 mptm? -53.52 144.63 16.71 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 126.434 1.894 . . . . 0.0 114.428 -166.743 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.6 m-90 -72.88 168.93 17.9 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 125.908 1.683 . . . . 0.0 114.117 -177.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 60.5 mtpt -113.33 159.79 19.03 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 126.247 1.819 . . . . 0.0 112.8 179.267 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 64.6 pttt -77.79 168.25 20.23 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 126.142 1.777 . . . . 0.0 115.169 -171.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.4 m -69.45 148.36 11.46 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 125.803 1.641 . . . . 0.0 112.495 171.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 3.8 pp0? -68.17 -19.65 64.81 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 115.707 1.743 . . . . 0.0 115.707 -168.097 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 99.8 m -76.13 -20.23 57.79 Favored 'General case' 0 N--CA 1.47 0.553 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 172.727 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER 61.47 -28.47 0.06 Allowed 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 127.105 2.162 . . . . 0.0 115.155 -156.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 44.7 mt -89.72 -15.82 31.69 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 126.397 1.879 . . . . 0.0 114.533 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.06 -176.25 2.47 Favored 'General case' 0 CA--C 1.544 0.731 0 N-CA-C 113.449 0.907 . . . . 0.0 113.449 -174.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 34.7 tptt 66.7 -24.59 0.11 Allowed 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 128.217 2.607 . . . . 0.0 115.177 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 46.8 t -73.59 150.9 41.1 Favored 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.815 1.246 . . . . 0.0 113.312 168.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 58.2 tttp -70.23 -22.44 62.9 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 126.612 1.965 . . . . 0.0 114.178 177.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -75.95 -44.1 41.62 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 124.345 1.058 . . . . 0.0 113.136 -175.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 68.5 t60 -77.05 -42.95 36.32 Favored 'General case' 0 CA--C 1.542 0.651 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -165.531 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 40.1 m -76.42 -11.59 59.91 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 116.184 1.92 . . . . 0.0 116.184 -158.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -51.52 124.7 12.7 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.292 1.437 . . . . 0.0 112.029 -175.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . 0.285 10.0 pt-20 49.97 4.6 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 128.909 2.884 . . . . 0.0 118.486 -178.065 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 66.3 mtp85 -124.58 -24.23 4.24 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 125.198 1.399 . . . . 0.0 114.605 -177.005 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 86.5 m -128.81 68.77 79.57 Favored Pre-proline 0 CA--C 1.549 0.918 0 C-N-CA 124.921 1.288 . . . . 0.0 112.007 168.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -64.09 170.34 9.21 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.076 2.518 . . . . 0.0 113.967 172.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 37.0 m -95.17 2.03 54.91 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 114.257 1.206 . . . . 0.0 114.257 174.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 25.8 pt -75.46 155.43 6.13 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 CA-C-O 122.443 1.116 . . . . 0.0 112.861 -177.205 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 4.1 m-90 -72.69 -11.36 60.6 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 115.846 1.795 . . . . 0.0 115.846 -157.791 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 36.5 ttt-85 -129.92 16.84 5.71 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 125.472 1.509 . . . . 0.0 113.891 179.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -74.12 -33.7 63.66 Favored 'General case' 0 CA--C 1.544 0.723 0 O-C-N 121.625 -0.672 . . . . 0.0 112.772 177.535 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 45.1 t80 -96.82 160.72 14.21 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.84 1.256 . . . . 0.0 111.322 168.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 46.4 pt -65.63 147.79 12.41 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.62 0 C-N-CA 123.672 0.789 . . . . 0.0 113.128 -177.394 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 1.1 pp -99.84 16.43 23.77 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 125.928 1.691 . . . . 0.0 113.424 175.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . 0.253 33.2 m 47.53 30.28 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 127.425 2.29 . . . . 0.0 114.83 176.559 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . 0.307 3.9 p30 48.14 24.38 0.65 Allowed 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 127.353 2.261 . . . . 0.0 116.283 -173.289 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -142.61 -29.22 0.57 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 125.045 1.338 . . . . 0.0 114.33 -175.176 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -79.98 151.36 30.07 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.553 1.141 . . . . 0.0 112.251 178.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.8 tt0 -138.5 139.82 38.92 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.409 1.484 . . . . 0.0 111.716 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 13.6 mptt -108.58 150.12 27.94 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 125.817 1.647 . . . . 0.0 110.85 169.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -101.5 -16.18 16.89 Favored 'General case' 0 CA--C 1.546 0.818 0 N-CA-C 114.579 1.325 . . . . 0.0 114.579 177.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 23.0 ttpp -82.34 137.64 45.38 Favored Pre-proline 0 N--CA 1.476 0.835 0 C-N-CA 124.023 0.929 . . . . 0.0 111.204 176.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -69.32 160.35 50.19 Favored 'Trans proline' 0 CA--C 1.541 0.872 0 C-N-CA 122.871 2.381 . . . . 0.0 113.081 173.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 88.4 tttt -85.02 -26.53 27.0 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 126.179 1.791 . . . . 0.0 112.949 173.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 64.7 t -124.46 145.53 31.5 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 125.997 1.719 . . . . 0.0 110.543 -172.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -120.05 164.76 20.58 Favored Pre-proline 0 CA--C 1.553 1.08 0 C-N-CA 126.053 1.741 . . . . 0.0 111.739 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_exo -58.28 156.48 30.12 Favored 'Trans proline' 0 CA--C 1.541 0.841 0 C-N-CA 123.821 3.014 . . . . 0.0 115.787 -176.703 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 65.8 m-85 -101.08 165.29 11.38 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.768 1.627 . . . . 0.0 112.799 -179.446 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 19.6 m80 60.36 22.86 12.37 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 126.552 1.941 . . . . 0.0 116.143 174.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 32.4 p -85.65 -12.23 51.86 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 125.887 1.675 . . . . 0.0 113.631 176.625 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 96.1 mt -91.8 142.73 12.62 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.8 0 C-N-CA 125.891 1.676 . . . . 0.0 110.295 -177.092 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 37.9 p90 -142.41 157.5 44.71 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.715 1.206 . . . . 0.0 113.448 -174.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 4.5 t -145.3 39.81 1.2 Allowed 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 124.921 1.288 . . . . 0.0 112.511 173.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -61.49 -9.3 5.45 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -176.206 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -64.96 -22.06 66.94 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.398 1.079 . . . . 0.0 113.119 170.196 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 95.6 m -105.95 176.03 5.3 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 126.972 2.109 . . . . 0.0 112.354 179.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.05 -7.76 38.98 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 124.937 1.256 . . . . 0.0 115.712 178.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -159.54 154.13 25.18 Favored Glycine 0 CA--C 1.534 1.273 0 C-N-CA 125.427 1.489 . . . . 0.0 112.47 172.735 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.3 pttt -86.16 -22.08 27.2 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 114.732 1.382 . . . . 0.0 114.732 -174.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -77.99 33.16 1.71 Allowed Glycine 0 CA--C 1.537 1.422 0 C-N-CA 125.825 1.679 . . . . 0.0 117.149 -163.722 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -150.99 151.17 31.7 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 118.827 1.314 . . . . 0.0 113.108 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 31.2 m-85 44.39 28.74 0.32 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 127.359 2.264 . . . . 0.0 116.905 154.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.93 -18.45 59.88 Favored Glycine 0 CA--C 1.536 1.348 0 O-C-N 121.017 -1.052 . . . . 0.0 114.898 -167.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 36.2 m-20 -74.32 -46.42 41.09 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.37 1.468 . . . . 0.0 113.483 173.357 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 5.9 p-10 -111.44 -20.85 12.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 125.764 1.626 . . . . 0.0 114.463 -162.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 5.1 t -77.85 -5.61 51.48 Favored 'General case' 0 CA--C 1.549 0.912 0 N-CA-C 113.689 0.996 . . . . 0.0 113.689 -170.721 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -81.77 45.09 0.87 Allowed 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.648 1.979 . . . . 0.0 111.757 171.14 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -77.84 -13.39 59.9 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 115.571 1.693 . . . . 0.0 115.571 -164.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.6 tptp . . . . . 0 C--O 1.252 1.204 0 C-N-CA 125.791 1.637 . . . . 0.0 111.91 -179.325 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 56.2 mtmt . . . . . 0 N--CA 1.491 1.596 0 CA-C-O 120.603 0.239 . . . . 0.0 111.164 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -65.67 145.93 55.43 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.174 0.99 . . . . 0.0 112.097 175.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.6 82.43 6.89 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.382 1.473 . . . . 0.0 112.221 -171.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -59.97 -51.64 79.17 Favored Pre-proline 0 CA--C 1.55 0.971 0 N-CA-C 113.301 0.852 . . . . 0.0 113.301 171.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 96.6 Cg_endo -80.75 -35.44 0.53 Allowed 'Trans proline' 0 C--N 1.355 0.877 0 C-N-CA 122.482 2.122 . . . . 0.0 113.993 178.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.401 0.0 OUTLIER 51.87 -53.64 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.369 0 C-N-CA 130.138 3.375 . . . . 0.0 117.482 -168.608 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.43 ' HA ' ' HA ' ' A' ' 16' ' ' LEU . 4.5 m -163.56 165.82 23.17 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 131.564 3.946 . . . . 0.0 109.623 179.363 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 46.0 t30 -72.84 -94.8 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.127 0 O-C-N 120.901 -1.125 . . . . 0.0 112.502 179.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 64.9 t30 -90.22 -22.3 21.73 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.527 1.131 . . . . 0.0 111.476 171.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 42.5 t -67.17 166.77 13.39 Favored 'General case' 0 CA--C 1.551 1.016 0 C-N-CA 125.713 1.605 . . . . 0.0 110.792 165.032 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 74.5 p -134.52 15.56 3.71 Favored 'General case' 0 N--CA 1.479 1.02 0 N-CA-C 115.425 1.639 . . . . 0.0 115.425 -165.194 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -84.14 164.28 19.27 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.693 0.797 . . . . 0.0 112.312 174.336 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 51.6 mtt-85 -91.67 111.82 23.49 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 124.699 1.2 . . . . 0.0 110.778 170.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 108.25 152.33 16.34 Favored Glycine 0 CA--C 1.534 1.262 0 C-N-CA 125.522 1.534 . . . . 0.0 112.586 -177.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.363 13.3 p-80 51.53 62.87 2.49 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-O 123.438 1.589 . . . . 0.0 111.644 -161.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.531 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -64.13 -170.42 0.04 OUTLIER 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 126.387 1.875 . . . . 0.0 114.391 -175.407 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -34.94 -64.75 0.25 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 126.504 1.922 . . . . 0.0 114.522 -169.689 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.1 ptpt -74.68 -11.17 60.11 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 126.151 1.78 . . . . 0.0 115.437 -179.756 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -99.98 -13.63 19.01 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 126.376 1.87 . . . . 0.0 113.635 177.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 4.9 m -65.1 167.32 10.05 Favored Pre-proline 0 CA--C 1.554 1.117 0 C-N-CA 124.74 1.216 . . . . 0.0 112.274 159.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -58.82 162.71 12.58 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 124.147 3.231 . . . . 0.0 114.759 176.586 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 96.7 m-70 -65.84 149.74 49.7 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.342 1.057 . . . . 0.0 113.404 -178.29 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.8 pp -89.86 171.81 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 C-N-CA 125.251 1.42 . . . . 0.0 113.76 -175.662 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 6.1 mt -68.76 127.23 30.26 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.846 0 C-N-CA 125.121 1.369 . . . . 0.0 110.331 -176.539 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.0 p -62.43 128.37 35.7 Favored 'General case' 0 CA--C 1.545 0.764 0 CA-C-O 121.897 0.856 . . . . 0.0 112.204 -175.119 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 24.9 m 51.32 14.56 0.24 Allowed 'General case' 0 N--CA 1.48 1.067 0 N-CA-C 116.494 2.035 . . . . 0.0 116.494 -177.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 16.3 t80 45.65 35.89 2.37 Favored 'General case' 0 CA--C 1.553 1.077 0 C-N-CA 125.777 1.631 . . . . 0.0 113.359 -166.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.5 p -86.5 -14.44 43.07 Favored 'General case' 0 CA--C 1.541 0.624 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -171.591 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -147.96 -173.0 18.55 Favored Glycine 0 CA--C 1.53 1.021 0 N-CA-C 114.977 0.751 . . . . 0.0 114.977 -174.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.0 -176.89 1.2 Allowed 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 123.956 0.902 . . . . 0.0 111.731 170.6 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -119.69 -40.86 2.72 Favored 'General case' 0 N--CA 1.476 0.874 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 173.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -79.61 -24.84 41.69 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.593 0.96 . . . . 0.0 113.593 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 54.3 p30 -133.39 32.96 3.6 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.304 1.842 . . . . 0.0 112.652 174.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 23.1 t-160 -46.42 -55.14 7.84 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 128.48 2.712 . . . . 0.0 115.427 -171.968 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -74.23 -43.58 56.5 Favored 'General case' 0 CA--C 1.538 0.493 0 N-CA-C 113.058 0.762 . . . . 0.0 113.058 -169.121 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.9 m -70.12 -16.71 63.15 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 115.213 1.56 . . . . 0.0 115.213 -167.136 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -77.72 22.78 0.25 Allowed 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.682 1.593 . . . . 0.0 113.289 172.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.8 m80 50.99 58.2 5.82 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 124.83 1.252 . . . . 0.0 111.258 -163.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.411 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.348 32.2 t 34.38 -90.75 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.213 0 C-N-CA 129.379 3.072 . . . . 0.0 115.93 176.74 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.411 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 97.0 Cg_endo -73.13 -5.72 17.67 Favored 'Trans proline' 0 C--N 1.355 0.88 0 C-N-CA 123.327 2.685 . . . . 0.0 115.768 -175.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -90.5 36.05 0.88 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.471 1.508 . . . . 0.0 113.536 -176.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -131.14 -13.71 3.49 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 117.188 2.292 . . . . 0.0 117.188 -174.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 20.1 mm -120.18 45.86 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-N 120.49 1.496 . . . . 0.0 110.473 178.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -150.76 158.29 43.96 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 120.65 -1.281 . . . . 0.0 112.888 166.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 43.4 t -55.02 155.77 4.32 Favored 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 127.143 2.177 . . . . 0.0 112.064 169.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 88.1 p -62.22 -28.47 69.71 Favored 'General case' 0 N--CA 1.473 0.723 0 O-C-N 120.621 -1.3 . . . . 0.0 114.423 -174.633 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 34.3 mtmm -131.74 4.11 4.19 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 125.74 1.616 . . . . 0.0 113.987 -179.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 m -135.3 158.82 43.4 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.094 1.358 . . . . 0.0 111.333 -177.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -88.56 0.19 56.6 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.944 1.831 . . . . 0.0 115.944 -160.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -122.49 153.08 39.63 Favored 'General case' 0 N--CA 1.475 0.809 0 O-C-N 120.954 -1.091 . . . . 0.0 113.375 178.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 3.6 t -6.32 -60.74 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.241 1 C-N-CA 132.581 4.352 . . . . 0.0 119.021 -167.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 178.03 165.26 32.61 Favored Glycine 0 CA--C 1.531 1.043 0 C-N-CA 124.872 1.225 . . . . 0.0 112.238 -169.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -79.62 9.48 4.96 Favored 'General case' 0 CA--C 1.551 0.993 0 N-CA-C 116.717 2.118 . . . . 0.0 116.717 -159.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 83.9 m-85 -61.27 151.34 32.08 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 120.503 -1.373 . . . . 0.0 112.301 174.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -65.1 -0.02 1.48 Allowed 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 116.836 2.162 . . . . 0.0 116.836 -175.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 12.8 p -127.47 3.63 6.23 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.368 1.867 . . . . 0.0 113.289 173.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.2 mm-40 -119.4 -27.23 5.63 Favored 'General case' 0 N--CA 1.473 0.709 0 C-N-CA 126.266 1.826 . . . . 0.0 112.733 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 19.8 t -139.98 58.21 10.75 Favored Pre-proline 0 CA--C 1.555 1.157 0 C-N-CA 125.932 1.693 . . . . 0.0 111.569 169.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.33 156.99 54.25 Favored 'Trans proline' 0 CA--C 1.54 0.801 0 C-N-CA 123.024 2.483 . . . . 0.0 112.149 175.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 27.1 m170 -90.28 -8.78 50.07 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.671 0.989 . . . . 0.0 113.671 175.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 75.3 mmtt -111.96 137.48 49.91 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 126.439 1.896 . . . . 0.0 109.414 165.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 85.3 m95 -92.2 -53.46 4.23 Favored 'General case' 0 N--CA 1.472 0.658 0 N-CA-C 114.888 1.44 . . . . 0.0 114.888 -164.264 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt 48.87 32.22 3.62 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.947 1.699 . . . . 0.0 113.955 -174.825 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -106.83 123.12 47.69 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.593 1.557 . . . . 0.0 111.289 -172.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . 0.293 2.2 p 48.48 18.03 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 127.946 2.499 . . . . 0.0 115.359 -179.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 72.4 mt-30 54.36 0.85 0.03 OUTLIER 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 127.54 2.336 . . . . 0.0 116.264 -170.543 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.3 m -145.02 144.8 31.2 Favored 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 119.61 1.096 . . . . 0.0 112.662 -169.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 15.0 t -77.65 -24.62 49.38 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.674 0.79 . . . . 0.0 113.124 161.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 68.9 mt -74.55 -15.74 60.84 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.906 1.283 . . . . 0.0 113.966 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 87.4 m -112.51 159.39 18.83 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 124.671 1.189 . . . . 0.0 112.866 -169.171 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -126.27 154.09 43.87 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 126.086 1.754 . . . . 0.0 110.368 179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 19.5 p -51.93 137.01 27.58 Favored 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.379 1.071 . . . . 0.0 112.483 176.584 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . 0.304 8.8 ptpp? 48.23 20.23 0.26 Allowed 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 127.978 2.511 . . . . 0.0 116.775 -171.717 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -133.59 30.95 3.75 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 126.894 2.078 . . . . 0.0 112.698 -179.51 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -73.22 171.94 12.05 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.876 0.87 . . . . 0.0 112.809 177.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 17.2 m 66.59 -7.04 0.46 Allowed 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 127.989 2.516 . . . . 0.0 117.532 172.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 59.6 mtpt -53.66 151.21 6.29 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 125.587 1.555 . . . . 0.0 112.25 171.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 51.85 37.83 21.73 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 125.301 1.44 . . . . 0.0 113.135 -174.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 1.3 tmm_? 53.44 62.59 2.57 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 126.761 2.025 . . . . 0.0 112.256 -177.238 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 8.9 t -116.72 39.23 0.26 Allowed Pre-proline 0 CA--C 1.561 1.377 0 C-N-CA 125.762 1.625 . . . . 0.0 114.322 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 80.3 Cg_endo -74.92 -25.15 12.31 Favored 'Trans proline' 0 C--N 1.358 1.036 0 C-N-CA 122.03 1.82 . . . . 0.0 113.574 -177.562 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.5 m -67.26 154.9 40.19 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 126.268 1.827 . . . . 0.0 114.683 -172.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 2.0 pp -87.85 170.01 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.761 0 C-N-CA 125.077 1.351 . . . . 0.0 114.524 -174.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 1.1 t90 -62.88 -25.83 68.49 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 127.211 2.204 . . . . 0.0 114.68 -172.664 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 15.1 tpt180 62.82 -179.55 0.14 Allowed 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.205 2.202 . . . . 0.0 113.738 179.841 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . 63.77 -5.89 0.26 Allowed 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 118.461 2.763 . . . . 0.0 118.461 176.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 83.5 m-85 -84.76 150.61 24.96 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 119.995 1.27 . . . . 0.0 112.0 169.648 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 47.7 pt -68.76 142.78 15.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 C-N-CA 123.475 0.71 . . . . 0.0 112.413 -179.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 24.0 tp -138.54 -10.12 1.41 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.57 1.148 . . . . 0.0 113.979 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.04 -17.27 22.03 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.491 1.116 . . . . 0.0 113.748 -177.321 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -82.11 -9.22 59.6 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.74 1.216 . . . . 0.0 114.155 179.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -120.48 127.9 52.65 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.555 1.542 . . . . 0.0 112.417 -176.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 69.1 m-20 51.9 30.41 7.14 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 126.372 1.869 . . . . 0.0 114.726 175.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -144.27 152.11 40.34 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 126.068 1.747 . . . . 0.0 111.146 -175.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.6 pttt -143.68 153.5 42.54 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 126.439 1.896 . . . . 0.0 112.915 178.382 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -81.38 -15.04 56.46 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 114.835 1.42 . . . . 0.0 114.835 -176.88 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 64.0 mttp -106.92 126.58 29.88 Favored Pre-proline 0 N--CA 1.478 0.926 0 C-N-CA 124.924 1.289 . . . . 0.0 112.215 -174.634 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -80.41 166.71 19.91 Favored 'Trans proline' 0 CA--C 1.542 0.884 0 C-N-CA 123.646 2.897 . . . . 0.0 112.583 173.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -138.69 125.23 20.64 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 125.653 1.581 . . . . 0.0 109.863 167.411 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 41.0 t -104.01 -35.74 3.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 N-CA-C 113.125 0.787 . . . . 0.0 113.125 -162.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 25.1 tp -143.68 127.57 9.21 Favored Pre-proline 0 CA--C 1.548 0.877 0 C-N-CA 124.782 1.233 . . . . 0.0 110.757 -178.424 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -91.2 -13.92 1.87 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 123.118 2.546 . . . . 0.0 114.415 -177.362 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 41.9 t80 -115.76 151.36 35.3 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 125.028 1.331 . . . . 0.0 112.855 -171.741 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 8.8 m-70 -76.38 146.01 39.02 Favored 'General case' 0 N--CA 1.469 0.511 0 C-N-CA 123.785 0.834 . . . . 0.0 113.152 -176.026 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.2 t -154.16 159.81 41.6 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.154 1.382 . . . . 0.0 111.987 177.105 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 11.8 mm 52.93 54.83 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 126.769 2.028 . . . . 0.0 111.002 -176.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -121.79 157.21 31.53 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 126.131 1.773 . . . . 0.0 112.738 -171.251 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 73.9 m -81.08 155.72 26.16 Favored 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 109.835 -0.431 . . . . 0.0 109.835 152.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 32.3 p90 -77.35 -10.21 59.31 Favored 'General case' 0 CA--C 1.545 0.779 0 O-C-N 120.847 -1.158 . . . . 0.0 113.803 176.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 65.5 t30 -110.32 -20.63 12.56 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 114.551 1.315 . . . . 0.0 114.551 -178.918 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.0 p -154.79 164.89 38.15 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.239 1.016 . . . . 0.0 113.087 -174.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -67.92 123.3 18.22 Favored Glycine 0 CA--C 1.535 1.303 0 C-N-CA 124.013 0.815 . . . . 0.0 113.994 -176.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 75.78 142.26 1.08 Allowed Glycine 0 CA--C 1.538 1.483 0 C-N-CA 125.746 1.641 . . . . 0.0 114.514 178.031 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 15.7 ttmm -80.28 56.38 2.47 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 125.935 1.694 . . . . 0.0 112.614 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -76.11 -12.38 84.13 Favored Glycine 0 CA--C 1.537 1.433 0 C-N-CA 125.177 1.37 . . . . 0.0 116.434 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -144.6 -161.29 1.26 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-N 119.028 1.414 . . . . 0.0 112.452 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -70.24 44.37 0.07 Allowed 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 127.427 2.291 . . . . 0.0 113.023 178.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -43.84 -19.67 0.12 Allowed Glycine 0 CA--C 1.532 1.094 1 C-N-CA 131.359 4.314 . . . . 0.0 118.452 -170.161 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -61.78 -38.81 89.45 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 119.401 1.601 . . . . 0.0 112.352 169.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -112.44 -14.14 13.29 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 126.648 1.979 . . . . 0.0 113.007 171.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER 62.57 48.23 4.54 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 127.357 2.263 . . . . 0.0 114.78 166.145 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 61.0 mttp -126.9 168.09 14.97 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 126.211 1.805 . . . . 0.0 111.342 174.776 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -87.92 -14.67 38.68 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -174.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 C--O 1.252 1.228 0 C-N-CA 126.426 1.89 . . . . 0.0 111.496 -175.598 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 62.2 pttt . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 111.455 0.168 . . . . 0.0 111.455 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -79.02 -33.14 45.12 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 123.879 0.872 . . . . 0.0 112.585 -178.057 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -149.96 140.55 22.53 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 125.161 1.384 . . . . 0.0 111.731 174.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -77.96 -52.18 1.61 Allowed Pre-proline 0 CA--C 1.551 0.996 0 C-N-CA 124.328 1.051 . . . . 0.0 112.947 165.202 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -76.14 -36.49 1.88 Allowed 'Trans proline' 0 C--N 1.355 0.884 0 C-N-CA 122.763 2.308 . . . . 0.0 114.556 -177.326 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 60.92 -64.84 0.06 Allowed 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 127.91 2.484 . . . . 0.0 114.368 -169.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 25.5 t -159.55 161.29 35.21 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 128.416 2.686 . . . . 0.0 110.368 175.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 37.8 t30 -68.26 -35.45 77.91 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.063 -1.023 . . . . 0.0 112.933 172.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 47.1 t30 -145.4 -62.83 0.34 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 113.607 0.966 . . . . 0.0 113.607 -177.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 6.2 p -87.76 95.94 10.26 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.601 1.161 . . . . 0.0 111.934 -176.351 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 12.0 p -71.66 63.53 0.43 Allowed 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 128.373 2.669 . . . . 0.0 115.887 -168.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 1.8 pp0? -121.09 148.16 44.55 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 127.376 2.27 . . . . 0.0 110.545 165.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 81.8 mtm180 -73.07 136.26 44.94 Favored 'General case' 0 N--CA 1.474 0.741 0 C-N-CA 123.639 0.776 . . . . 0.0 111.727 -172.786 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 147.07 -37.67 1.15 Allowed Glycine 0 CA--C 1.531 1.073 0 C-N-CA 124.798 1.19 . . . . 0.0 113.79 176.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -139.72 101.06 4.11 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.179 0.991 . . . . 0.0 112.992 177.557 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -63.86 -178.69 0.33 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.557 1.143 . . . . 0.0 112.938 169.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -40.83 -66.21 0.35 Allowed 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 125.945 1.698 . . . . 0.0 113.802 -171.706 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.8 ptmt -74.34 -11.1 60.16 Favored 'General case' 0 N--CA 1.477 0.913 0 N-CA-C 114.865 1.431 . . . . 0.0 114.865 179.406 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -85.64 -26.76 25.83 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.347 1.059 . . . . 0.0 112.263 175.669 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.2 t -59.1 -42.34 93.06 Favored Pre-proline 0 CA--C 1.557 1.235 0 N-CA-C 115.955 1.835 . . . . 0.0 115.955 -179.359 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -77.03 162.7 31.65 Favored 'Trans proline' 0 C--N 1.357 0.988 0 C-N-CA 122.442 2.095 . . . . 0.0 114.389 -173.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 31.6 p80 -87.2 6.16 34.45 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 126.015 1.726 . . . . 0.0 115.629 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.4 pp -83.48 28.46 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 N-CA-C 115.59 1.7 . . . . 0.0 115.59 -165.02 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.8 mt -113.86 145.36 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 C-N-CA 125.163 1.385 . . . . 0.0 111.595 -170.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 41.7 t -43.22 117.47 1.11 Allowed 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.853 2.061 . . . . 0.0 114.136 -174.22 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 8.7 m 51.58 20.34 1.04 Allowed 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 126.661 1.984 . . . . 0.0 116.245 172.209 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.9 t80 52.15 26.38 3.85 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 125.298 1.439 . . . . 0.0 113.789 -167.709 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.4 p -115.48 -25.86 7.76 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 125.945 1.698 . . . . 0.0 113.627 -174.185 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -96.99 155.5 20.74 Favored Glycine 0 CA--C 1.532 1.148 0 C-N-CA 125.688 1.613 . . . . 0.0 113.779 178.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -109.92 142.54 41.12 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 124.437 1.095 . . . . 0.0 110.849 166.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.8 t -59.62 -26.18 65.26 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.413 1.485 . . . . 0.0 114.875 -168.587 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -105.16 1.27 28.15 Favored 'General case' 0 CA--C 1.549 0.935 0 N-CA-C 114.267 1.21 . . . . 0.0 114.267 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -140.91 -13.59 0.94 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 115.931 1.826 . . . . 0.0 115.931 -170.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 41.1 t-80 -64.24 138.57 58.5 Favored 'General case' 0 CA--C 1.543 0.702 0 O-C-N 120.868 -1.145 . . . . 0.0 113.409 -176.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 -130.46 133.75 46.56 Favored 'General case' 0 N--CA 1.463 0.208 0 C-N-CA 125.799 1.639 . . . . 0.0 110.227 171.375 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.9 t -58.67 -29.68 66.77 Favored 'General case' 0 CA--C 1.54 0.583 0 N-CA-C 113.023 0.749 . . . . 0.0 113.023 171.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -62.93 -25.19 68.22 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 125.627 1.571 . . . . 0.0 114.087 174.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 28.6 m170 -131.64 -16.29 3.01 Favored 'General case' 0 CA--C 1.547 0.827 0 N-CA-C 115.595 1.702 . . . . 0.0 115.595 -165.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.53 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.346 2.1 m 41.22 -98.18 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.299 0 C-N-CA 128.057 2.543 . . . . 0.0 115.927 178.59 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.53 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 19.9 Cg_exo -77.33 -3.38 13.61 Favored 'Trans proline' 0 C--N 1.36 1.146 0 CA-C-N 123.544 2.301 . . . . 0.0 117.626 -155.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -63.75 -3.96 2.75 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 115.307 1.595 . . . . 0.0 115.307 -171.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -95.3 -23.38 17.23 Favored 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 125.031 1.332 . . . . 0.0 114.148 -177.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 84.5 mt -128.51 -15.75 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 125.266 1.427 . . . . 0.0 112.623 -176.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -128.81 173.28 10.5 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 120.725 -1.234 . . . . 0.0 111.625 155.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 28.0 p -117.3 -176.67 3.05 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 125.51 1.524 . . . . 0.0 110.392 167.439 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.1 p -75.99 -17.93 59.5 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 114.788 1.403 . . . . 0.0 114.788 -176.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 31.2 mmmt -96.1 -31.81 12.83 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.571 1.148 . . . . 0.0 113.768 -174.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 25.8 p -156.09 167.56 30.03 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.795 1.238 . . . . 0.0 112.263 177.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -74.96 18.38 0.18 Allowed 'General case' 0 CA--C 1.553 1.061 0 C-N-CA 126.378 1.871 . . . . 0.0 114.853 -169.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -132.09 158.12 42.42 Favored 'General case' 0 CA--C 1.542 0.673 0 C-N-CA 125.86 1.664 . . . . 0.0 112.359 -170.965 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.6 t -62.99 121.75 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.763 0 C-N-CA 125.032 1.333 . . . . 0.0 113.465 -165.972 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 54.44 -150.77 15.58 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 124.786 1.184 . . . . 0.0 115.776 166.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 25.3 m80 -139.46 10.37 2.5 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.096 1.358 . . . . 0.0 113.705 170.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 74.4 m-85 -72.09 148.98 45.22 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 121.129 -0.982 . . . . 0.0 112.146 173.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 52.0 tpt85 -60.68 -23.21 64.65 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 125.715 1.606 . . . . 0.0 114.266 -178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 61.5 p -90.92 -8.09 50.32 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 126.287 1.835 . . . . 0.0 114.45 174.991 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -119.61 -42.14 2.65 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.966 1.306 . . . . 0.0 113.944 -171.716 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.3 t -109.7 112.69 58.32 Favored Pre-proline 0 CA--C 1.543 0.687 0 C-N-CA 123.891 0.876 . . . . 0.0 112.211 -171.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_exo -69.0 164.48 33.61 Favored 'Trans proline' 0 CA--C 1.539 0.743 0 C-N-CA 123.076 2.518 . . . . 0.0 113.973 175.463 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 90.4 m-70 -128.06 144.6 51.12 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 125.204 1.402 . . . . 0.0 110.617 167.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 61.6 tttm -78.3 -18.41 55.28 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.6 1.16 . . . . 0.0 113.75 -176.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 79.8 t90 -67.27 122.46 17.92 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.137 0.575 . . . . 0.0 112.454 179.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.8 mmmt -141.42 148.97 40.42 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 127.722 2.409 . . . . 0.0 109.048 169.795 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.7 tttp -125.32 145.69 49.91 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 125.028 1.331 . . . . 0.0 111.988 -177.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 32.6 m -113.48 152.03 15.24 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 125.614 1.565 . . . . 0.0 111.943 -177.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -92.08 -12.27 33.5 Favored 'General case' 0 N--CA 1.475 0.811 0 N-CA-C 114.043 1.127 . . . . 0.0 114.043 -179.369 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 7.4 m -87.15 99.91 12.28 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.428 0.691 . . . . 0.0 112.451 -172.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 65.4 p 33.23 -79.65 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.215 0 N-CA-C 117.483 2.401 . . . . 0.0 117.483 136.151 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.9 pp -109.65 -10.03 14.84 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 128.63 2.772 . . . . 0.0 114.729 -170.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.4 m -79.26 161.39 26.36 Favored 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.423 1.089 . . . . 0.0 113.1 -174.285 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 57.5 tptt -125.73 148.31 49.1 Favored 'General case' 0 N--CA 1.469 0.491 0 C-N-CA 126.157 1.783 . . . . 0.0 109.662 171.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 6.8 p -58.33 137.22 57.35 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.476 1.511 . . . . 0.0 112.197 175.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 59.4 tttt 53.45 23.55 3.47 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 126.294 1.837 . . . . 0.0 114.798 -174.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 28.3 ttmt -132.14 12.07 4.65 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.19 1.396 . . . . 0.0 114.386 -175.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.2 p-80 -147.83 171.1 16.25 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 123.904 0.882 . . . . 0.0 111.966 170.855 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 37.9 t -129.26 153.6 47.63 Favored 'General case' 0 CA--C 1.537 0.452 0 N-CA-C 115.287 1.588 . . . . 0.0 115.287 -171.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.438 ' C ' ' H ' ' A' ' 79' ' ' ARG . 56.7 mtmt -66.33 -4.23 7.56 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 126.851 2.06 . . . . 0.0 114.046 165.237 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -66.99 43.16 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.223 0 C-N-CA 126.54 1.936 . . . . 0.0 111.676 155.552 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . 0.438 ' H ' ' C ' ' A' ' 77' ' ' LYS . 62.9 mmt-85 48.94 50.4 17.81 Favored 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 129.829 3.252 . . . . 0.0 115.423 175.575 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 89.5 m 64.61 174.67 0.06 OUTLIER Pre-proline 0 CA--C 1.556 1.193 0 C-N-CA 126.118 1.767 . . . . 0.0 115.602 166.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_exo -62.59 -18.26 62.73 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 123.475 2.783 . . . . 0.0 116.35 -177.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 50.2 p -72.31 -0.78 13.16 Favored 'General case' 0 N--CA 1.473 0.714 0 N-CA-C 116.414 2.005 . . . . 0.0 116.414 -171.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 7.6 tp -86.54 119.62 34.85 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 CA-C-N 119.703 1.138 . . . . 0.0 110.768 168.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 51.8 t90 -140.64 -20.61 0.82 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 114.531 1.308 . . . . 0.0 114.531 -176.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.44 -22.55 63.65 Favored 'General case' 0 N--CA 1.48 1.071 0 N-CA-C 114.231 1.197 . . . . 0.0 114.231 -171.233 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -148.04 155.96 42.08 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 124.368 1.067 . . . . 0.0 112.949 179.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 78.7 m-85 -103.73 154.3 19.71 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 125.518 1.527 . . . . 0.0 111.825 171.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 3.5 mp -95.9 84.66 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.612 0 N-CA-C 106.502 -1.666 . . . . 0.0 106.502 163.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 16.3 tp -99.77 1.88 43.61 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.062 1.345 . . . . 0.0 113.877 -162.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 23.9 m -62.31 146.98 11.94 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 C-N-CA 124.322 1.049 . . . . 0.0 113.236 -177.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 9.2 p-10 -121.43 151.18 40.5 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 125.987 1.715 . . . . 0.0 113.613 -171.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -79.81 160.08 26.27 Favored 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 125.633 1.573 . . . . 0.0 113.795 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 66.7 m-80 -123.04 157.43 32.79 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.142 1.377 . . . . 0.0 112.944 -173.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 60.96 161.47 0.06 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 127.776 2.431 . . . . 0.0 116.305 -177.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -129.19 161.3 30.45 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 127.597 2.359 . . . . 0.0 110.574 178.35 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -136.01 152.91 51.41 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.316 1.046 . . . . 0.0 113.182 -176.507 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 44.5 mmtm -142.49 158.6 60.12 Favored Pre-proline 0 N--CA 1.474 0.764 0 C-N-CA 127.594 2.358 . . . . 0.0 110.435 170.247 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -61.45 154.58 58.11 Favored 'Trans proline' 0 CA--C 1.537 0.663 0 C-N-CA 123.129 2.553 . . . . 0.0 114.103 179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.0 mttt -87.44 22.49 2.16 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.804 1.642 . . . . 0.0 113.105 174.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 12.3 p -149.85 150.61 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 C-N-CA 127.218 2.207 . . . . 0.0 110.008 -177.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 97.0 mt -130.16 146.31 61.0 Favored Pre-proline 0 CA--C 1.546 0.821 0 C-N-CA 125.252 1.421 . . . . 0.0 111.214 177.637 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -76.03 -13.72 19.24 Favored 'Trans proline' 0 CA--C 1.543 0.95 0 C-N-CA 123.81 3.007 . . . . 0.0 114.127 -176.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 31.9 t80 -69.32 -12.19 61.45 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -172.913 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 12.2 t-160 -85.54 3.87 38.56 Favored 'General case' 0 CA--C 1.552 1.05 0 C-N-CA 125.032 1.333 . . . . 0.0 114.568 -173.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 96.9 m -105.85 141.56 37.05 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 125.151 1.38 . . . . 0.0 111.986 178.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.1 pt -114.6 158.65 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.796 0 C-N-CA 125.797 1.639 . . . . 0.0 111.926 173.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 90.3 m-85 -135.02 160.17 39.18 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 125.02 1.328 . . . . 0.0 112.239 -172.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 8.6 t -83.2 142.72 30.96 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.225 1.01 . . . . 0.0 111.972 176.2 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -137.46 11.54 2.98 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.898 1.279 . . . . 0.0 112.925 -179.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 25.6 m120 -142.88 158.18 43.87 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 126.415 1.886 . . . . 0.0 110.157 -177.346 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 p 52.64 -5.4 0.01 OUTLIER 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 119.684 3.216 . . . . 0.0 119.684 173.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 176.68 -167.94 39.66 Favored Glycine 0 CA--C 1.536 1.357 0 C-N-CA 125.29 1.424 . . . . 0.0 114.002 -178.001 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -67.77 161.78 48.79 Favored Glycine 0 CA--C 1.535 1.338 0 C-N-CA 124.648 1.118 . . . . 0.0 113.954 179.28 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 64.0 mttm -65.28 -19.0 65.76 Favored 'General case' 0 N--CA 1.479 1.001 0 N-CA-C 115.279 1.585 . . . . 0.0 115.279 -166.409 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -82.27 -37.22 15.45 Favored Glycine 0 CA--C 1.536 1.399 0 N-CA-C 116.293 1.277 . . . . 0.0 116.293 -173.073 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -84.28 141.77 30.71 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 119.382 1.591 . . . . 0.0 115.016 -164.747 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 13.8 m-85 37.71 31.78 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 129.486 3.114 . . . . 0.0 117.17 164.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -63.54 -11.41 41.51 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 125.302 1.43 . . . . 0.0 115.441 -165.132 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.9 t70 -70.16 -35.27 73.88 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.671 1.588 . . . . 0.0 113.747 173.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -143.99 -27.54 0.53 Allowed 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.472 1.656 . . . . 0.0 115.472 -159.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.0 p -70.27 -11.43 60.9 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 114.592 1.33 . . . . 0.0 114.592 -175.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 46.7 mtmt -80.07 51.88 1.44 Allowed 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.462 1.905 . . . . 0.0 112.653 -176.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -76.2 -7.67 55.36 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.254 1.422 . . . . 0.0 114.8 -176.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 45.5 mmtm . . . . . 0 C--O 1.252 1.19 0 C-N-CA 126.965 2.106 . . . . 0.0 111.16 178.619 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm . . . . . 0 N--CA 1.487 1.425 0 N-CA-C 109.708 -0.478 . . . . 0.0 109.708 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -158.13 174.26 15.47 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 125.452 1.501 . . . . 0.0 112.423 -168.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 53.61 56.23 7.53 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 126.288 1.835 . . . . 0.0 114.659 177.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -45.64 -47.44 38.15 Favored Pre-proline 0 CA--C 1.553 1.07 0 N-CA-C 115.031 1.493 . . . . 0.0 115.031 173.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -78.53 -40.36 0.33 Allowed 'Trans proline' 0 CA--C 1.541 0.86 0 C-N-CA 122.056 1.838 . . . . 0.0 114.067 -179.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.7 ttmm 40.63 -158.85 0.01 OUTLIER 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.693 1.197 . . . . 0.0 111.773 -146.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.1 t -59.77 157.7 11.69 Favored 'General case' 0 CA--C 1.545 0.763 0 O-C-N 120.408 -1.433 . . . . 0.0 112.834 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 62.9 t30 -63.58 -35.8 81.68 Favored 'General case' 0 CA--C 1.547 0.85 0 O-C-N 121.272 -0.892 . . . . 0.0 111.763 168.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.7 p-10 -150.15 -48.08 0.13 Allowed 'General case' 0 CA--C 1.55 0.961 0 N-CA-C 115.728 1.751 . . . . 0.0 115.728 -166.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 55.6 m -70.25 -40.24 74.52 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 119.743 1.156 . . . . 0.0 113.924 -170.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 63.8 m 56.8 21.71 6.28 Favored 'General case' 0 N--CA 1.48 1.032 0 N-CA-C 117.446 2.387 . . . . 0.0 117.446 176.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -129.26 8.55 5.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 125.313 1.445 . . . . 0.0 112.9 175.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -143.49 150.68 39.32 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 125.629 1.572 . . . . 0.0 111.707 -172.114 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -68.31 -10.83 60.65 Favored Glycine 0 CA--C 1.533 1.215 0 N-CA-C 116.19 1.236 . . . . 0.0 116.19 -170.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -74.58 92.81 2.44 Favored 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 119.124 1.462 . . . . 0.0 112.432 175.028 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.2 pp -59.02 175.57 0.27 Allowed 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.089 1.356 . . . . 0.0 113.169 173.262 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -32.79 -68.98 0.09 Allowed 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 126.751 2.02 . . . . 0.0 114.45 -173.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.0 ptmt -78.49 -8.03 58.1 Favored 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 115.143 1.534 . . . . 0.0 115.143 -179.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.12 -27.32 26.31 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 125.046 1.339 . . . . 0.0 111.821 171.658 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 48.8 t -62.09 139.49 95.99 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 125.257 1.423 . . . . 0.0 112.013 -179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 57.3 Cg_endo -67.94 -19.45 46.12 Favored 'Trans proline' 0 CA--C 1.541 0.844 0 C-N-CA 123.574 2.849 . . . . 0.0 114.995 178.107 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 23.8 t-160 -117.76 108.27 15.18 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.556 1.142 . . . . 0.0 110.94 179.275 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.0 pt -140.56 165.46 20.48 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 C-N-CA 125.878 1.671 . . . . 0.0 112.062 -178.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.9 mt 54.69 22.97 0.1 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.222 0 C-N-CA 126.678 1.991 . . . . 0.0 113.585 175.554 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 56.1 m 46.82 27.58 0.71 Allowed 'General case' 0 CA--C 1.552 1.024 0 C-N-CA 126.136 1.774 . . . . 0.0 114.616 -174.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . 0.299 5.7 p 42.07 79.58 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.977 0 C-N-CA 126.588 1.955 . . . . 0.0 113.315 -162.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 33.0 m-85 68.54 17.09 9.08 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 128.454 2.702 . . . . 0.0 116.984 -178.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 22.2 t -109.09 66.1 0.63 Allowed 'General case' 0 CA--C 1.544 0.731 0 C-N-CA 124.883 1.273 . . . . 0.0 108.434 164.492 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 164.29 -162.6 35.45 Favored Glycine 0 CA--C 1.524 0.631 0 O-C-N 121.195 -0.94 . . . . 0.0 114.0 173.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -136.41 158.03 45.39 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.617 1.567 . . . . 0.0 108.597 163.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 7.5 t -67.41 -24.76 65.69 Favored 'General case' 0 N--CA 1.472 0.662 0 N-CA-C 113.922 1.082 . . . . 0.0 113.922 -175.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.5 t70 -119.63 -39.09 2.9 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 114.24 1.2 . . . . 0.0 114.24 -179.253 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.2 t0 -107.82 61.95 0.61 Allowed 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.153 0.981 . . . . 0.0 112.959 -171.305 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 31.3 t-80 -153.76 134.95 14.05 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.241 1.416 . . . . 0.0 111.031 -176.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -156.12 171.22 20.53 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.227 1.011 . . . . 0.0 112.648 -172.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 2.7 m -53.69 -32.08 50.38 Favored 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 126.083 1.753 . . . . 0.0 114.564 179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.0 mmm180 -84.9 -8.96 58.56 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 126.015 1.726 . . . . 0.0 113.649 177.296 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 4.6 m-70 -131.78 -0.55 3.85 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 125.839 1.656 . . . . 0.0 114.699 -170.42 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 t -27.96 -52.84 0.24 Allowed Pre-proline 0 CA--C 1.557 1.222 0 C-N-CA 127.969 2.508 . . . . 0.0 117.25 -175.355 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -65.41 -18.49 60.17 Favored 'Trans proline' 0 CA--C 1.547 1.134 0 C-N-CA 122.701 2.267 . . . . 0.0 116.167 -178.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 62.7 mttp -73.16 128.08 34.46 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.782 1.233 . . . . 0.0 110.692 174.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.73 138.96 21.3 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -172.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 35.9 mm 58.38 139.75 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 130.51 3.524 . . . . 0.0 116.709 165.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -162.24 158.94 25.08 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.345 1.858 . . . . 0.0 112.858 179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 42.6 t -99.49 162.34 13.09 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 125.079 1.352 . . . . 0.0 110.14 159.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 41.5 p -56.2 140.46 44.39 Favored 'General case' 0 N--CA 1.479 1.006 0 O-C-N 120.938 -1.101 . . . . 0.0 111.692 177.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt 56.94 6.71 0.34 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.639 1.976 . . . . 0.0 115.687 -174.307 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 82.5 m -93.85 -36.44 12.24 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 124.225 1.01 . . . . 0.0 112.523 173.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 60.01 -20.64 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 128.087 2.555 . . . . 0.0 116.769 -176.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 48.3 mt-10 -136.58 127.58 27.72 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 126.959 2.103 . . . . 0.0 110.021 162.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.274 13.5 m 40.78 -62.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.026 1 C-N-CA 132.575 4.35 . . . . 0.0 118.949 178.943 . . . . . . . . 3 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 166.26 155.37 8.8 Favored Glycine 0 CA--C 1.535 1.336 0 C-N-CA 124.981 1.276 . . . . 0.0 114.051 -172.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -77.26 113.64 15.24 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.287 1.435 . . . . 0.0 112.602 175.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.6 t80 66.02 154.53 0.08 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 126.794 2.038 . . . . 0.0 115.662 -173.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.2 mtp180 48.84 16.49 0.12 Allowed 'General case' 0 N--CA 1.485 1.289 0 C-N-CA 128.383 2.673 . . . . 0.0 114.982 -167.339 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.0 m 50.13 28.23 2.94 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 126.119 1.768 . . . . 0.0 114.515 -170.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -157.94 -14.79 0.08 Allowed 'General case' 0 CA--C 1.544 0.732 0 N-CA-C 115.861 1.8 . . . . 0.0 115.861 -174.621 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 31.5 p 36.63 89.1 0.09 OUTLIER Pre-proline 0 CA--C 1.556 1.192 0 C-N-CA 127.793 2.437 . . . . 0.0 115.998 -172.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -63.98 10.69 0.11 Allowed 'Trans proline' 0 CA--C 1.551 1.349 0 C-N-CA 124.683 3.588 . . . . 0.0 117.728 179.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 64.22 -28.83 0.1 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 129.366 3.066 . . . . 0.0 117.986 173.715 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 19.6 ptpt -71.37 -3.51 21.16 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.746 1.619 . . . . 0.0 114.407 174.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 26.3 t90 -68.08 -20.93 64.99 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 125.66 1.584 . . . . 0.0 114.178 -179.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 57.0 tttp -71.55 123.32 22.19 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.856 1.262 . . . . 0.0 112.92 -175.189 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 53.5 mtmt 57.07 -33.72 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 130.519 3.528 . . . . 0.0 119.505 173.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -67.65 145.01 13.96 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.856 0 CA-C-N 120.264 1.393 . . . . 0.0 113.225 -171.708 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -81.02 -19.07 44.71 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.481 1.112 . . . . 0.0 113.076 -176.912 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 69.0 m -97.89 148.35 23.52 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 124.042 0.937 . . . . 0.0 111.943 178.498 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.2 t -74.72 -35.21 62.67 Favored 'General case' 0 N--CA 1.47 0.563 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.494 HD23 ' H ' ' A' ' 69' ' ' LEU . 1.7 pt? -95.23 -25.2 16.46 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 114.605 1.335 . . . . 0.0 114.605 -171.504 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.4 m -75.72 147.06 39.65 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.92 0.888 . . . . 0.0 112.853 -169.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -103.85 -31.4 9.8 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.608 1.163 . . . . 0.0 112.676 175.47 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 50.4 m -79.57 160.67 26.35 Favored 'General case' 0 N--CA 1.47 0.574 0 C-N-CA 124.291 1.036 . . . . 0.0 113.542 179.609 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -125.49 163.7 22.1 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.857 1.663 . . . . 0.0 112.712 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 11.4 tppt? 56.53 31.25 18.67 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 126.467 1.907 . . . . 0.0 113.385 -173.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -89.72 158.84 17.37 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.724 1.609 . . . . 0.0 113.265 179.305 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 43.4 p -162.37 -65.27 0.05 OUTLIER 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 176.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 74.1 mmtt -56.04 147.64 19.5 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 126.7 2.0 . . . . 0.0 113.718 -161.49 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 55.93 27.31 10.92 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 125.851 1.66 . . . . 0.0 113.72 -171.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 24.5 mmt85 50.38 50.65 18.33 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 126.526 1.93 . . . . 0.0 111.917 -169.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 74.0 m 61.23 130.59 0.02 OUTLIER Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 129.096 2.958 . . . . 0.0 113.681 -162.075 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_endo -69.47 157.32 61.38 Favored 'Trans proline' 0 C--N 1.35 0.618 0 C-N-CA 122.83 2.353 . . . . 0.0 112.951 -173.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 2.3 m 58.98 13.01 2.61 Favored 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 115.81 1.781 . . . . 0.0 115.81 174.326 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.6 mt 48.58 31.84 0.18 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.148 0 C-N-CA 125.681 1.592 . . . . 0.0 112.463 -170.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 26.8 t-105 56.74 17.58 3.25 Favored 'General case' 0 CA--C 1.555 1.138 0 C-N-CA 126.66 1.984 . . . . 0.0 115.355 -174.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 70.3 mtp85 -66.33 -15.05 62.94 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.288 1.835 . . . . 0.0 114.44 -176.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -73.55 -16.57 61.26 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 174.302 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -95.18 166.52 11.87 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 125.607 1.563 . . . . 0.0 112.179 177.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 9.6 tp -139.9 150.19 22.02 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 C-N-CA 125.092 1.357 . . . . 0.0 112.226 -176.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 48.4 tp -133.82 144.49 49.01 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 126.109 1.763 . . . . 0.0 110.699 178.319 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 58.8 t -74.74 -45.64 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 123.844 0.858 . . . . 0.0 111.805 -177.517 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 21.6 t70 53.27 30.19 9.68 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 126.215 1.806 . . . . 0.0 115.387 173.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -109.03 2.19 21.07 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 125.035 1.334 . . . . 0.0 113.811 -173.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 83.2 m-20 -80.85 107.3 13.54 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 121.26 -0.9 . . . . 0.0 110.988 -175.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -80.71 -11.54 59.61 Favored 'General case' 0 N--CA 1.478 0.953 0 N-CA-C 114.317 1.228 . . . . 0.0 114.317 -173.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -121.27 119.44 32.26 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 125.435 1.494 . . . . 0.0 111.343 178.592 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -138.81 19.87 2.67 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 125.838 1.655 . . . . 0.0 112.136 172.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -91.77 153.33 43.74 Favored Pre-proline 0 N--CA 1.474 0.754 0 C-N-CA 126.203 1.801 . . . . 0.0 113.172 -169.178 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -72.94 164.61 35.1 Favored 'Trans proline' 0 CA--C 1.541 0.827 0 C-N-CA 123.26 2.64 . . . . 0.0 112.943 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -123.76 168.31 12.88 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 126.604 1.962 . . . . 0.0 111.373 174.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.4 m -79.31 -2.3 5.07 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -168.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.47 ' H ' HD23 ' A' ' 101' ' ' LEU . 1.6 pt? -104.16 144.82 29.47 Favored Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 124.882 1.273 . . . . 0.0 113.738 -176.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.8 Cg_endo -82.59 169.42 13.72 Favored 'Trans proline' 0 CA--C 1.542 0.911 0 C-N-CA 124.093 3.196 . . . . 0.0 113.94 -176.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 40.1 t80 -90.73 152.34 20.85 Favored 'General case' 0 CA--C 1.548 0.88 0 C-N-CA 125.902 1.681 . . . . 0.0 112.385 178.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 26.0 m170 47.32 62.7 2.29 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 125.929 1.692 . . . . 0.0 114.947 179.438 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 12.8 p -79.28 49.79 1.01 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 127.765 2.426 . . . . 0.0 112.577 174.825 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 47.7 pt -82.77 159.91 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.57 0 C-N-CA 125.372 1.469 . . . . 0.0 113.831 -171.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -136.24 170.49 15.94 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 127.286 2.235 . . . . 0.0 110.553 178.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 66.5 m -64.24 155.67 31.21 Favored 'General case' 0 CA--C 1.539 0.546 0 O-C-N 121.62 -0.675 . . . . 0.0 110.503 158.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 94.3 m-85 -72.18 172.7 9.72 Favored 'General case' 0 CA--C 1.544 0.737 0 O-C-N 121.873 -0.517 . . . . 0.0 111.068 159.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 56.0 t30 65.52 -61.71 0.24 Allowed 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 127.555 2.342 . . . . 0.0 115.991 174.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 p -86.94 -21.79 26.04 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 115.285 1.587 . . . . 0.0 115.285 -170.171 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 74.51 -5.59 28.39 Favored Glycine 0 CA--C 1.542 1.739 0 C-N-CA 124.758 1.17 . . . . 0.0 115.457 -173.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -78.8 -171.81 40.56 Favored Glycine 0 CA--C 1.536 1.364 0 C-N-CA 124.866 1.222 . . . . 0.0 112.789 167.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 27.8 tptp -144.34 146.08 32.35 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 125.881 1.672 . . . . 0.0 110.697 -177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 91.47 17.71 48.41 Favored Glycine 0 CA--C 1.533 1.203 0 N-CA-C 117.18 1.632 . . . . 0.0 117.18 162.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 12.5 p80 -140.01 132.64 28.83 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 119.547 1.673 . . . . 0.0 113.23 168.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 40.16 30.55 0.07 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 128.225 2.61 . . . . 0.0 117.141 168.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -52.7 -31.38 37.67 Favored Glycine 0 CA--C 1.537 1.459 0 C-N-CA 124.794 1.188 . . . . 0.0 115.514 -164.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.7 t70 -61.13 -38.34 86.01 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 126.022 1.729 . . . . 0.0 114.284 175.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -106.74 -19.98 13.49 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 126.728 2.011 . . . . 0.0 112.894 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 48.2 t -72.63 -22.67 60.91 Favored 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 126.684 1.994 . . . . 0.0 112.425 174.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -58.82 149.69 25.95 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 125.476 1.51 . . . . 0.0 111.493 168.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -70.48 -21.65 62.75 Favored 'General case' 0 N--CA 1.476 0.867 0 N-CA-C 113.954 1.094 . . . . 0.0 113.954 -169.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 65.2 mttp . . . . . 0 C--O 1.252 1.191 0 C-N-CA 126.282 1.833 . . . . 0.0 111.806 179.274 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 57.9 tptt . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 110.297 -0.261 . . . . 0.0 110.297 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 53.26 38.96 28.96 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 125.688 1.595 . . . . 0.0 114.457 177.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -126.0 134.51 51.44 Favored 'General case' 0 CA--C 1.542 0.643 0 C-N-CA 124.664 1.186 . . . . 0.0 112.689 -175.595 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -68.05 -51.91 25.5 Favored Pre-proline 0 CA--C 1.551 0.991 0 C-N-CA 124.371 1.068 . . . . 0.0 113.223 167.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -73.86 -39.73 1.68 Allowed 'Trans proline' 0 C--N 1.353 0.794 0 C-N-CA 122.447 2.098 . . . . 0.0 113.763 -177.141 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.254 0.0 OUTLIER 61.1 -55.05 0.1 Allowed 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 128.251 2.62 . . . . 0.0 115.956 -176.377 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.7 t -158.92 158.72 33.89 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 127.3 2.24 . . . . 0.0 110.809 174.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 17.7 p-10 -67.79 -39.06 84.06 Favored 'General case' 0 CA--C 1.548 0.891 0 O-C-N 121.291 -0.88 . . . . 0.0 112.923 174.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 23.4 t-20 -160.03 -34.71 0.06 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.934 1.694 . . . . 0.0 113.391 -177.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 4.5 m -68.44 -30.17 68.98 Favored 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 113.909 1.077 . . . . 0.0 113.909 -171.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 42.6 m 53.2 22.63 2.72 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 118.872 2.916 . . . . 0.0 118.872 170.717 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -134.82 6.06 3.4 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.298 1.039 . . . . 0.0 113.45 177.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 78.0 mtt85 -141.02 154.93 46.23 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.971 1.708 . . . . 0.0 112.091 -164.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -72.07 -18.01 77.56 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 116.374 1.31 . . . . 0.0 116.374 -169.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -69.22 95.82 0.79 Allowed 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 118.448 1.124 . . . . 0.0 111.921 172.073 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.32 178.15 0.57 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.138 1.375 . . . . 0.0 112.688 169.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -39.83 -64.56 0.48 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 126.149 1.779 . . . . 0.0 114.323 -170.784 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -74.67 -15.46 60.8 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.897 1.679 . . . . 0.0 115.075 177.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -85.26 -20.02 30.7 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.704 1.202 . . . . 0.0 111.773 178.367 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 69.1 m -72.98 154.09 90.86 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 124.18 0.992 . . . . 0.0 112.243 157.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 77.5 Cg_endo -75.47 142.99 27.1 Favored 'Trans proline' 0 CA--C 1.54 0.796 0 C-N-CA 123.317 2.678 . . . . 0.0 111.585 177.188 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 42.9 t60 -153.58 167.84 28.19 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.07 1.348 . . . . 0.0 111.124 176.817 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 3.8 mt 55.42 52.06 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.002 0 C-N-CA 126.048 1.739 . . . . 0.0 111.407 -177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 2.0 mt -101.1 120.03 50.08 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.503 0 C-N-CA 125.72 1.608 . . . . 0.0 108.728 -174.078 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.4 p -62.66 126.82 28.64 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 119.449 1.022 . . . . 0.0 110.298 -176.784 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 41.0 m 46.87 29.02 0.93 Allowed 'General case' 0 N--CA 1.481 1.121 0 N-CA-C 115.493 1.664 . . . . 0.0 115.493 -175.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.4 t80 55.03 30.89 15.04 Favored 'General case' 0 CA--C 1.552 1.058 0 C-N-CA 126.704 2.002 . . . . 0.0 115.195 -172.882 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 91.4 m -73.87 106.63 5.68 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 125.545 1.538 . . . . 0.0 112.783 -177.308 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 64.44 -151.28 50.55 Favored Glycine 0 CA--C 1.535 1.334 0 O-C-N 121.538 -0.726 . . . . 0.0 113.951 174.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -105.12 139.62 39.52 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.669 1.188 . . . . 0.0 110.202 170.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 15.3 t -55.17 -27.34 45.03 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 115.355 1.613 . . . . 0.0 115.355 -172.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -84.89 -35.3 22.26 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.507 1.299 . . . . 0.0 114.507 179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 4.7 p30 -99.53 -13.02 19.64 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 114.505 1.298 . . . . 0.0 114.505 -179.162 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 27.2 t-80 -63.9 130.27 43.41 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.849 1.66 . . . . 0.0 111.745 174.64 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 20.5 t80 -147.24 149.42 32.86 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.841 1.256 . . . . 0.0 109.804 172.878 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.4 p -64.97 -21.11 66.79 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 115.625 1.713 . . . . 0.0 115.625 -163.504 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 29.9 ptt180 -73.78 -19.41 60.78 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.444 1.098 . . . . 0.0 113.757 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 80.1 m-70 -108.5 -35.66 6.42 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 125.921 1.688 . . . . 0.0 112.323 177.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.502 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.449 1.6 t 47.72 -114.45 0.0 OUTLIER Pre-proline 0 CA--C 1.563 1.454 0 C-N-CA 128.063 2.545 . . . . 0.0 113.973 174.898 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.502 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 56.0 Cg_endo -79.99 -11.52 13.64 Favored 'Trans proline' 0 CA--C 1.544 0.985 0 CA-C-N 124.491 2.64 . . . . 0.0 116.276 -167.177 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -83.48 54.87 2.98 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 125.212 1.405 . . . . 0.0 114.321 -165.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -143.07 -11.46 0.75 Allowed 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 177.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.5 mm -119.12 11.55 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.434 0 C-N-CA 125.565 1.546 . . . . 0.0 112.56 -179.667 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.442 ' HA ' ' HA ' ' A' ' 50' ' ' GLU . 8.3 pt20 -133.06 160.06 38.27 Favored 'General case' 0 N--CA 1.474 0.759 0 O-C-N 119.961 -1.712 . . . . 0.0 114.246 -173.934 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -65.57 165.34 12.46 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.638 1.175 . . . . 0.0 111.61 172.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 22.2 m -71.48 -31.29 66.97 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -179.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.4 mtmt -134.61 19.74 3.59 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 126.06 1.744 . . . . 0.0 113.012 -176.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.0 t -153.13 169.13 23.73 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 126.632 1.973 . . . . 0.0 109.881 -173.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -70.04 -174.43 0.78 Allowed 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 125.335 1.454 . . . . 0.0 113.822 178.018 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.442 ' HA ' ' HA ' ' A' ' 44' ' ' GLN . 1.5 mp0 -40.59 128.29 2.49 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 127.406 2.282 . . . . 0.0 114.967 -172.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 6.9 m -66.85 -7.88 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 O-C-N 120.953 -1.092 . . . . 0.0 112.374 168.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -59.31 -15.51 31.18 Favored Glycine 0 CA--C 1.539 1.556 0 C-N-CA 124.928 1.251 . . . . 0.0 114.848 167.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -85.91 -178.12 6.5 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 119.289 1.544 . . . . 0.0 114.333 175.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.6 173.31 2.82 Favored 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 118.237 2.68 . . . . 0.0 118.237 -158.296 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 41.4 ttp180 44.19 95.74 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 129.834 3.254 . . . . 0.0 115.114 161.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.5 m 61.46 22.06 12.56 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 114.836 1.421 . . . . 0.0 114.836 179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.6 mp0 52.72 72.52 0.41 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.916 1.286 . . . . 0.0 111.024 -167.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . 0.43 ' HA ' ' HD3' ' A' ' 59' ' ' PRO . 2.0 t 74.18 133.89 0.04 OUTLIER Pre-proline 0 CA--C 1.553 1.095 0 C-N-CA 128.186 2.594 . . . . 0.0 112.237 -162.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.43 ' HD3' ' HA ' ' A' ' 58' ' ' CYS . 80.1 Cg_exo -55.63 144.03 76.77 Favored 'Trans proline' 0 C--N 1.356 0.968 0 C-N-CA 123.166 2.577 . . . . 0.0 115.923 -167.926 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 4.9 p-80 -69.62 129.93 41.0 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.816 1.247 . . . . 0.0 112.951 -178.588 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.2 ptmm? -101.68 30.56 4.26 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 126.166 1.786 . . . . 0.0 113.642 177.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 25.7 t-105 -101.29 11.65 38.91 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 126.047 1.739 . . . . 0.0 113.984 -167.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 93.7 mttt 54.65 32.93 18.21 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 125.843 1.657 . . . . 0.0 113.108 -174.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tptp -71.93 156.7 38.98 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 126.232 1.813 . . . . 0.0 111.742 -177.163 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.2 p -58.55 128.95 20.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.831 0 C-N-CA 123.236 0.614 . . . . 0.0 111.593 176.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.6 pt20 -87.1 -12.03 48.34 Favored 'General case' 0 N--CA 1.473 0.688 0 N-CA-C 113.972 1.101 . . . . 0.0 113.972 -175.581 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 46.2 m -84.18 150.62 25.37 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 124.29 1.036 . . . . 0.0 112.169 175.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 6.5 t -78.97 -36.04 42.06 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 124.828 1.251 . . . . 0.0 113.601 178.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -93.9 -9.36 37.45 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 114.716 1.376 . . . . 0.0 114.716 -172.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 72.2 m -89.28 148.93 23.3 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.022 0.929 . . . . 0.0 112.325 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -79.48 169.35 18.18 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.542 1.137 . . . . 0.0 111.081 166.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 64.0 m -82.48 26.92 0.53 Allowed 'General case' 0 N--CA 1.488 1.442 0 C-N-CA 124.369 1.068 . . . . 0.0 113.528 177.256 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 9.8 tppt? -150.1 162.06 41.15 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 127.119 2.168 . . . . 0.0 109.805 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 52.4 mtmt 55.84 39.22 30.69 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 125.471 1.509 . . . . 0.0 113.113 -176.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 17.9 t-80 -119.6 160.49 22.37 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 125.646 1.578 . . . . 0.0 111.924 -174.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 33.7 p -152.5 158.86 43.16 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 124.403 1.081 . . . . 0.0 113.067 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 16.9 tttt -69.28 171.03 9.13 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 124.968 1.307 . . . . 0.0 112.912 -176.612 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 57.87 37.65 26.96 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.993 1.317 . . . . 0.0 112.826 -172.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 2.9 tmm_? 59.18 60.39 2.4 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 127.134 2.174 . . . . 0.0 112.851 -178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 28.6 p 40.8 56.11 7.91 Favored Pre-proline 0 CA--C 1.556 1.206 0 C-N-CA 127.768 2.427 . . . . 0.0 116.895 171.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_endo -81.13 -26.01 3.69 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 123.789 2.993 . . . . 0.0 113.71 -177.989 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 34.8 t -138.43 154.89 48.88 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 125.073 1.349 . . . . 0.0 113.282 -167.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 16.2 tt -74.73 -20.8 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 125.928 1.691 . . . . 0.0 113.43 175.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 46.9 m0 -61.42 148.29 42.19 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 124.465 1.106 . . . . 0.0 113.291 -175.483 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -98.98 -0.33 42.34 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.474 1.51 . . . . 0.0 113.492 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.38 9.92 38.18 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.433 1.493 . . . . 0.0 114.986 -167.709 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 24.0 p90 -61.02 150.83 32.38 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.097 0.959 . . . . 0.0 113.075 178.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 36.8 pt -69.19 148.47 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.702 0 C-N-CA 123.945 0.898 . . . . 0.0 113.342 -171.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 73.3 mt -104.78 12.95 32.11 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 125.455 1.502 . . . . 0.0 113.413 -175.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 27.4 m -104.55 158.21 5.52 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 C-N-CA 125.739 1.616 . . . . 0.0 111.441 175.112 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 38.0 m-20 -79.37 146.14 33.02 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.885 0.874 . . . . 0.0 113.157 -178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 2.9 p30 -111.93 13.18 20.83 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 126.378 1.871 . . . . 0.0 113.647 -177.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . 0.311 0.5 OUTLIER 55.83 19.31 3.42 Favored 'General case' 0 CA--C 1.551 0.989 0 N-CA-C 118.049 2.611 . . . . 0.0 118.049 170.781 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -89.84 147.65 23.66 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 119.216 0.916 . . . . 0.0 111.595 166.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -135.95 -178.87 5.33 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 125.78 1.632 . . . . 0.0 113.233 -168.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 68.67 134.43 0.03 OUTLIER 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 129.004 2.922 . . . . 0.0 115.131 -171.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 83.3 tttt -147.38 97.68 4.04 Favored Pre-proline 0 N--CA 1.473 0.704 0 C-N-CA 127.415 2.286 . . . . 0.0 108.941 -178.647 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -83.63 -14.86 7.62 Favored 'Trans proline' 0 CA--C 1.542 0.892 0 C-N-CA 122.951 2.434 . . . . 0.0 113.952 -178.718 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 67.9 mttm -76.72 152.14 35.81 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.529 1.132 . . . . 0.0 113.419 -175.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.2 p -139.01 160.82 29.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.691 1.597 . . . . 0.0 111.415 -174.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 91.2 mt -111.39 86.24 6.43 Favored Pre-proline 0 CA--C 1.551 0.997 0 C-N-CA 125.921 1.689 . . . . 0.0 109.097 173.629 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -83.57 170.07 11.84 Favored 'Trans proline' 0 CA--C 1.541 0.843 0 C-N-CA 123.613 2.875 . . . . 0.0 113.905 -167.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 9.2 m-85 59.17 33.85 22.95 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 126.021 1.728 . . . . 0.0 115.254 170.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -126.61 150.55 48.83 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.462 1.505 . . . . 0.0 111.54 177.691 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 54.3 m -128.71 -49.09 1.25 Allowed 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -174.036 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 1.3 pp -137.42 154.5 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 124.511 1.124 . . . . 0.0 113.27 -173.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -142.25 97.98 3.23 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 125.297 1.439 . . . . 0.0 110.41 -178.253 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 12.7 t -152.77 154.29 34.89 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 123.957 0.903 . . . . 0.0 111.59 173.851 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 50.2 m-85 -144.2 -43.17 0.26 Allowed 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.792 1.034 . . . . 0.0 113.792 -174.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 21.2 m120 -80.1 -30.9 39.25 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 114.562 1.319 . . . . 0.0 114.562 -164.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 24.2 p -149.6 139.71 22.11 Favored 'General case' 0 CA--C 1.542 0.641 0 C-N-CA 124.886 1.274 . . . . 0.0 110.782 -176.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 67.14 20.83 71.42 Favored Glycine 0 CA--C 1.541 1.665 0 O-C-N 121.415 -0.803 . . . . 0.0 114.459 -175.543 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 61.07 -134.08 48.98 Favored Glycine 0 CA--C 1.534 1.246 0 CA-C-N 118.088 0.944 . . . . 0.0 112.168 -174.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -92.26 -1.41 57.12 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.866 1.266 . . . . 0.0 114.084 169.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.25 -156.35 27.91 Favored Glycine 0 CA--C 1.536 1.397 0 C-N-CA 125.626 1.584 . . . . 0.0 115.355 -173.452 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.7 p80 45.53 -157.14 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 128.593 2.757 . . . . 0.0 115.516 -178.039 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 51.6 p90 -71.61 28.76 0.05 OUTLIER 'General case' 0 CA--C 1.551 1.009 0 C-N-CA 125.951 1.701 . . . . 0.0 113.097 168.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . 0.444 ' HA2' ' SG ' ' A' ' 121' ' ' CYS . . . -52.36 -24.52 16.82 Favored Glycine 0 CA--C 1.541 1.69 0 C-N-CA 127.962 2.696 . . . . 0.0 115.58 -177.063 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -67.04 -40.25 87.11 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.267 172.418 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -98.09 -17.57 19.02 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 126.318 1.847 . . . . 0.0 113.176 -176.693 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . 0.444 ' SG ' ' HA2' ' A' ' 118' ' ' GLY . 1.8 p -71.8 6.5 1.97 Allowed 'General case' 0 CA--C 1.551 0.992 0 N-CA-C 115.033 1.494 . . . . 0.0 115.033 -174.831 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 50.3 mttm -74.94 158.59 33.05 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 125.79 1.636 . . . . 0.0 112.99 -170.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -136.89 147.0 46.19 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.113 1.365 . . . . 0.0 111.759 -172.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 60.7 mtpt . . . . . 0 C--O 1.253 1.27 0 C-N-CA 125.838 1.655 . . . . 0.0 112.174 -179.583 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.487 1.38 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -156.14 165.56 36.05 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 126.085 1.754 . . . . 0.0 111.607 -172.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -137.34 132.88 34.23 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 124.145 0.978 . . . . 0.0 113.082 -179.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -67.29 -50.72 37.86 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.747 1.219 . . . . 0.0 113.58 165.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 56.3 Cg_endo -73.64 -46.16 0.36 Allowed 'Trans proline' 0 C--N 1.354 0.862 0 C-N-CA 122.044 1.829 . . . . 0.0 114.029 -174.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 4.5 ttmt 41.71 -163.31 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.95 1.3 . . . . 0.0 112.816 -149.183 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 20.7 m -58.52 150.13 23.58 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 120.08 -1.637 . . . . 0.0 113.129 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.4 ' HB2' ' HA ' ' A' ' 17' ' ' LYS . 38.4 t30 -64.43 -44.95 89.6 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.691 0.797 . . . . 0.0 112.277 -179.31 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -121.72 -58.25 1.76 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 124.63 1.172 . . . . 0.0 112.249 -167.234 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.5 p -79.48 -166.37 0.95 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.684 0.793 . . . . 0.0 110.931 167.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 62.3 p -134.61 23.47 3.68 Favored 'General case' 0 N--CA 1.477 0.879 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -169.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 31.4 mt-30 -69.19 171.66 8.06 Favored 'General case' 0 CA--C 1.543 0.678 0 O-C-N 121.774 -0.579 . . . . 0.0 111.631 168.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -116.58 149.32 39.85 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.787 1.235 . . . . 0.0 111.964 168.238 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 122.03 -93.28 0.5 Allowed Glycine 0 CA--C 1.528 0.879 0 C-N-CA 125.093 1.33 . . . . 0.0 110.716 -169.087 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -76.08 74.8 2.95 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 121.956 0.884 . . . . 0.0 113.047 176.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.426 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -62.03 173.86 1.0 Allowed 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.865 1.266 . . . . 0.0 113.008 173.583 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 8' ' ' ASN . 0.1 OUTLIER -16.03 -73.63 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 128.776 2.83 . . . . 0.0 115.44 -171.589 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -67.46 -26.26 66.3 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 126.309 1.843 . . . . 0.0 115.65 -177.659 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -88.94 -20.52 24.39 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 126.201 1.8 . . . . 0.0 112.828 176.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.9 t -56.92 -40.93 88.64 Favored Pre-proline 0 CA--C 1.551 0.999 0 C-N-CA 126.243 1.817 . . . . 0.0 114.56 -173.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 31.3 Cg_exo -65.1 131.55 29.01 Favored 'Trans proline' 0 C--N 1.354 0.819 0 C-N-CA 122.865 2.377 . . . . 0.0 112.474 173.026 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -74.77 139.87 43.64 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 113.476 0.917 . . . . 0.0 113.476 -176.223 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 29.5 mt -127.32 90.6 1.58 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.746 0 C-N-CA 125.808 1.643 . . . . 0.0 108.919 178.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 0.3 OUTLIER -151.16 155.65 6.97 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.772 0 C-N-CA 126.8 2.04 . . . . 0.0 110.553 -176.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 73.9 m -87.05 1.05 54.15 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 125.093 1.357 . . . . 0.0 113.853 -179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.0 m 63.66 126.13 0.01 OUTLIER 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 127.343 2.257 . . . . 0.0 114.065 -163.685 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 40.2 t80 57.83 -21.09 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.037 0 C-N-CA 127.412 2.285 . . . . 0.0 116.012 -164.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 4.0 t -110.82 138.15 47.58 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 127.378 2.271 . . . . 0.0 111.036 178.396 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.55 -178.14 51.47 Favored Glycine 0 CA--C 1.533 1.201 0 C-N-CA 125.047 1.308 . . . . 0.0 114.864 -179.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -140.03 144.66 37.01 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 125.51 1.524 . . . . 0.0 110.229 171.877 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 2.0 t -69.98 -16.04 63.12 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 113.473 0.916 . . . . 0.0 113.473 -172.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.7 t70 -100.2 -21.69 15.42 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.663 1.585 . . . . 0.0 114.006 174.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -148.83 108.61 4.03 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 124.533 1.133 . . . . 0.0 111.841 -175.687 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 -148.4 143.19 26.63 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 124.871 1.269 . . . . 0.0 110.799 -178.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 81.5 t80 -135.99 105.47 6.08 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 113.28 0.845 . . . . 0.0 113.28 -167.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 8.2 m 54.76 -160.01 0.17 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 125.533 1.533 . . . . 0.0 114.527 167.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -79.6 2.07 23.75 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 114.144 1.165 . . . . 0.0 114.144 166.093 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 46.5 t-80 -80.13 -40.54 27.23 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.71 1.204 . . . . 0.0 111.733 177.576 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 20.9 m 63.85 166.04 0.11 Allowed Pre-proline 0 CA--C 1.556 1.182 0 C-N-CA 128.121 2.568 . . . . 0.0 114.83 -178.783 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 0.1 OUTLIER -118.42 -153.78 0.0 OUTLIER 'Trans proline' 0 CA--C 1.552 1.387 0 C-N-CA 123.481 2.788 . . . . 0.0 112.814 -160.512 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -66.95 -15.58 63.79 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 126.064 1.746 . . . . 0.0 115.446 179.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 58.35 -166.39 0.16 Allowed 'General case' 0 CA--C 1.554 1.117 0 C-N-CA 126.008 1.723 . . . . 0.0 115.148 178.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 13.3 mt -83.43 52.16 0.09 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 126.123 1.769 . . . . 0.0 112.095 -163.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 21.5 pt20 -150.32 148.83 29.31 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.579 1.552 . . . . 0.0 113.661 173.497 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.3 t -81.13 133.22 35.43 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 126.88 2.072 . . . . 0.0 109.503 171.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 57.7 p -67.16 -21.6 65.8 Favored 'General case' 0 CA--C 1.54 0.568 0 N-CA-C 114.282 1.215 . . . . 0.0 114.282 -178.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -77.09 -26.22 53.14 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.917 1.287 . . . . 0.0 113.059 177.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 8.7 p -153.56 -92.91 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.825 0 N-CA-C 114.315 1.228 . . . . 0.0 114.315 -175.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -136.67 -164.55 1.59 Allowed 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 126.52 1.928 . . . . 0.0 111.772 -166.118 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -45.71 139.47 4.01 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 125.702 1.601 . . . . 0.0 113.946 -176.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.0 m -64.83 -8.61 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.357 0 O-C-N 121.176 -0.952 . . . . 0.0 112.585 173.05 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -55.88 -8.14 2.02 Favored Glycine 0 CA--C 1.541 1.689 0 C-N-CA 127.159 2.314 . . . . 0.0 115.754 171.392 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -75.02 -147.41 0.02 OUTLIER 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 125.921 1.688 . . . . 0.0 112.445 163.818 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 -52.64 126.16 18.87 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 120.814 -1.179 . . . . 0.0 112.732 176.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 56.4 mmt-85 -66.41 160.24 25.25 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 126.897 2.079 . . . . 0.0 112.852 -171.343 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.3 m 55.71 36.66 27.67 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.441 1.096 . . . . 0.0 113.076 -166.501 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.271 10.6 pt20 42.12 90.26 0.01 OUTLIER 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 128.941 2.896 . . . . 0.0 115.843 -178.04 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 4.7 t 61.85 55.05 2.76 Favored Pre-proline 0 CA--C 1.556 1.201 0 N-CA-C 116.008 1.855 . . . . 0.0 116.008 164.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -68.49 179.02 3.28 Favored 'Trans proline' 0 CA--C 1.544 1.02 0 C-N-CA 123.761 2.974 . . . . 0.0 112.723 170.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 40.4 t-80 -56.68 -16.76 6.9 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 126.213 1.805 . . . . 0.0 115.527 -174.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -69.16 -16.55 63.66 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 124.655 1.182 . . . . 0.0 114.133 172.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -66.05 131.92 47.33 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.929 0.891 . . . . 0.0 111.152 167.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 33.0 mmmt -139.21 160.09 40.63 Favored 'General case' 0 N--CA 1.475 0.78 0 C-N-CA 125.935 1.694 . . . . 0.0 111.873 -178.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -140.84 166.09 25.74 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.864 2.066 . . . . 0.0 111.199 173.883 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.509 HG12 ' H ' ' A' ' 67' ' ' CYS . 21.6 t -67.73 131.12 33.31 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 164.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 9.5 pt20 -77.81 -0.39 26.99 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 113.785 1.031 . . . . 0.0 113.785 -178.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.509 ' H ' HG12 ' A' ' 65' ' ' VAL . 80.8 m -124.63 165.58 17.63 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.965 1.706 . . . . 0.0 111.443 170.432 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 31.2 p -127.73 -28.48 2.71 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 127.061 2.144 . . . . 0.0 110.852 -159.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 6.7 mp -62.4 -37.79 87.16 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 126.114 1.766 . . . . 0.0 110.501 161.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 32.9 m -82.79 129.55 35.0 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.01 1.324 . . . . 0.0 111.677 -173.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 70.7 mmtt -114.59 14.57 17.69 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 125.488 1.515 . . . . 0.0 113.49 -176.742 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.3 t -140.95 161.79 37.01 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 126.421 1.888 . . . . 0.0 112.401 -175.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -75.6 -18.66 59.64 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 125.0 1.32 . . . . 0.0 114.262 173.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -79.18 147.05 32.79 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 124.085 0.954 . . . . 0.0 111.074 168.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -142.65 146.3 34.33 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 124.506 1.122 . . . . 0.0 111.878 -175.268 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 69.8 m -133.85 105.25 6.67 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -168.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 21.2 pttp -66.03 -17.35 64.63 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.144 1.377 . . . . 0.0 114.242 179.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 65.8 mm-40 -85.74 -9.77 56.61 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.077 0.951 . . . . 0.0 113.389 175.233 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 28.6 mmm180 -119.81 -43.6 2.56 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 125.533 1.533 . . . . 0.0 113.792 -174.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 25.3 t -80.44 -57.58 0.62 Allowed Pre-proline 0 CA--C 1.549 0.912 0 N-CA-C 114.601 1.334 . . . . 0.0 114.601 -171.038 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -76.07 154.89 37.9 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 122.255 1.97 . . . . 0.0 113.067 -176.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 26.0 m 58.91 -172.17 0.11 Allowed 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 116.224 1.935 . . . . 0.0 116.224 167.794 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 9.5 tp -139.74 138.37 38.93 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.426 0 C-N-CA 125.527 1.531 . . . . 0.0 110.462 174.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 37.1 t-105 -92.92 116.71 29.29 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.664 0.786 . . . . 0.0 111.231 177.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 69.8 mtp180 -134.94 13.35 3.63 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.685 1.594 . . . . 0.0 113.46 178.91 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -110.27 169.1 8.96 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.077 1.351 . . . . 0.0 113.326 -172.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 55.3 t80 -142.47 153.81 43.99 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.996 1.319 . . . . 0.0 111.408 172.094 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 78.9 mt -78.56 131.95 33.36 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 C-N-CA 124.239 1.016 . . . . 0.0 111.213 -173.763 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 96.0 mt -129.58 150.9 50.71 Favored 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 126.377 1.871 . . . . 0.0 109.801 169.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 49.3 t -130.66 138.67 53.13 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.916 0 C-N-CA 124.968 1.307 . . . . 0.0 110.434 -174.191 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -135.34 160.93 36.86 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 126.128 1.771 . . . . 0.0 111.456 -179.275 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -124.65 150.77 45.7 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 125.513 1.525 . . . . 0.0 111.928 179.321 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 27.6 t-20 -110.97 144.2 40.44 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 125.574 1.549 . . . . 0.0 112.461 -175.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -134.45 138.94 45.16 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.241 1.416 . . . . 0.0 111.481 176.186 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -154.07 159.65 41.63 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 126.1 1.76 . . . . 0.0 112.416 176.279 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -114.14 167.11 10.96 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 125.628 1.571 . . . . 0.0 112.758 -179.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -132.6 134.9 25.29 Favored Pre-proline 0 N--CA 1.477 0.917 0 C-N-CA 125.785 1.634 . . . . 0.0 112.089 -176.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -80.85 -177.54 3.81 Favored 'Trans proline' 0 CA--C 1.546 1.078 0 C-N-CA 124.371 3.381 . . . . 0.0 113.124 177.662 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -64.55 160.86 18.6 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.073 1.349 . . . . 0.0 113.304 175.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.8 t -120.07 143.15 32.69 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 126.42 1.888 . . . . 0.0 108.778 166.379 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -66.1 146.34 99.02 Favored Pre-proline 0 CA--C 1.55 0.962 0 N-CA-C 113.707 1.003 . . . . 0.0 113.707 -173.453 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -83.41 140.65 9.7 Favored 'Trans proline' 0 CA--C 1.538 0.712 0 C-N-CA 123.336 2.69 . . . . 0.0 112.788 -179.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -141.93 -6.73 0.97 Allowed 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 172.244 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 9.3 t-160 -110.6 8.68 22.9 Favored 'General case' 0 CA--C 1.546 0.811 0 N-CA-C 114.673 1.36 . . . . 0.0 114.673 -164.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 34.3 p -93.13 7.95 42.12 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.736 2.015 . . . . 0.0 114.031 -175.787 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 20.1 tt -44.47 -38.63 1.59 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 127.25 2.22 . . . . 0.0 116.06 -164.664 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 60.8 m-85 -75.39 -11.7 60.1 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 115.156 1.539 . . . . 0.0 115.156 -174.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . 0.426 ' HB2' ' H ' ' A' ' 115' ' ' GLY . 2.9 t -156.81 46.38 0.42 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.265 1.026 . . . . 0.0 112.011 168.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 36.6 p90 -58.93 -18.21 31.53 Favored 'General case' 0 N--CA 1.478 0.97 0 N-CA-C 114.972 1.471 . . . . 0.0 114.972 -168.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.4 p30 -62.63 -29.63 70.77 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 125.492 1.517 . . . . 0.0 114.802 176.072 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 22.8 p -150.68 -2.07 0.37 Allowed 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.753 1.761 . . . . 0.0 115.753 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.63 -169.09 46.59 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.809 1.195 . . . . 0.0 113.279 -171.641 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 80.58 0.64 87.81 Favored Glycine 0 CA--C 1.54 1.61 0 C-N-CA 124.289 0.947 . . . . 0.0 115.088 -174.307 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 60.0 mtpt 28.87 99.06 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 129.849 3.26 . . . . 0.0 116.256 170.337 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.426 ' H ' ' HB2' ' A' ' 108' ' ' CYS . . . 98.06 3.9 57.79 Favored Glycine 0 CA--C 1.534 1.255 0 N-CA-C 116.883 1.513 . . . . 0.0 116.883 167.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 6.4 p80 -91.51 121.4 33.17 Favored 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 120.182 1.991 . . . . 0.0 112.008 169.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 38.73 35.63 0.12 Allowed 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 127.656 2.382 . . . . 0.0 115.274 177.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -54.32 -33.17 52.46 Favored Glycine 0 N--CA 1.476 1.307 0 N-CA-C 116.575 1.39 . . . . 0.0 116.575 -150.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -71.35 -48.64 49.0 Favored 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.242 1.417 . . . . 0.0 113.282 177.182 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -77.28 -26.82 52.76 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.142 1.377 . . . . 0.0 112.269 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 8.1 t -74.29 -2.99 27.47 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 126.271 1.828 . . . . 0.0 113.382 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -67.37 -22.84 65.55 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 125.603 1.561 . . . . 0.0 113.752 176.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -124.72 158.57 32.91 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 124.958 1.303 . . . . 0.0 112.794 -179.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 99.2 mttt . . . . . 0 C--O 1.252 1.226 0 C-N-CA 126.619 1.968 . . . . 0.0 111.671 179.1 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 47.6 tttp . . . . . 0 N--CA 1.491 1.578 0 CA-C-O 120.499 0.19 . . . . 0.0 110.701 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -74.09 -19.77 60.48 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 114.53 1.307 . . . . 0.0 114.53 -172.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -86.22 124.94 33.17 Favored 'General case' 0 CA--C 1.544 0.749 0 N-CA-C 114.453 1.279 . . . . 0.0 114.453 -167.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -86.66 -51.03 0.46 Allowed Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 125.344 1.457 . . . . 0.0 113.404 158.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -74.15 -31.52 7.67 Favored 'Trans proline' 0 C--N 1.356 0.928 0 C-N-CA 123.032 2.488 . . . . 0.0 115.314 -173.212 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.264 1.4 tmmt? 62.25 -60.93 0.12 Allowed 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 128.115 2.566 . . . . 0.0 117.011 176.783 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.2 m -164.54 152.58 12.23 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 128.738 2.815 . . . . 0.0 109.54 175.126 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 19.8 p-10 -68.53 -34.39 75.78 Favored 'General case' 0 CA--C 1.548 0.867 0 N-CA-C 114.074 1.138 . . . . 0.0 114.074 -173.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.2 p30 -144.92 -39.98 0.25 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.254 1.421 . . . . 0.0 113.223 -178.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 25.6 p -88.0 -156.4 0.36 Allowed 'General case' 0 CA--C 1.544 0.743 0 C-N-CA 125.731 1.612 . . . . 0.0 111.364 175.74 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.2 t -146.25 143.78 29.42 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 116.732 2.123 . . . . 0.0 116.732 -172.967 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 58.71 46.21 14.68 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 126.752 2.021 . . . . 0.0 115.004 160.509 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 19.3 tpp85 -126.54 14.25 7.6 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.979 1.711 . . . . 0.0 113.858 179.697 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 77.62 -41.73 1.92 Allowed Glycine 0 N--CA 1.477 1.39 0 C-N-CA 125.543 1.544 . . . . 0.0 115.704 172.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -69.54 84.4 0.43 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.265 1.426 . . . . 0.0 111.935 172.112 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.501 HD13 ' H ' ' A' ' 16' ' ' LEU . 0.0 OUTLIER -63.44 -179.66 0.36 Allowed 'General case' 0 CA--C 1.542 0.666 0 C-N-CA 125.678 1.591 . . . . 0.0 113.529 176.518 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.03 -68.08 0.06 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 127.171 2.189 . . . . 0.0 114.97 -171.182 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -73.96 -22.57 59.59 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 126.339 1.856 . . . . 0.0 115.386 -179.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -85.15 -26.92 26.53 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 125.58 1.552 . . . . 0.0 112.339 179.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 10.4 t -60.44 -50.85 83.81 Favored Pre-proline 0 CA--C 1.546 0.798 0 C-N-CA 125.789 1.636 . . . . 0.0 114.86 -173.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.36 119.09 5.62 Favored 'Trans proline' 0 C--N 1.355 0.905 0 C-N-CA 121.86 1.706 . . . . 0.0 112.014 -177.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.3 t60 -89.49 167.7 12.78 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.989 0.915 . . . . 0.0 111.241 167.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 11.1 mt -80.05 71.57 0.59 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 C-N-CA 124.759 1.224 . . . . 0.0 110.787 -176.691 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.2 mt -135.25 146.4 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 C-N-CA 127.22 2.208 . . . . 0.0 109.285 172.696 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.1 t -71.16 125.55 27.23 Favored 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 123.344 0.658 . . . . 0.0 111.091 173.769 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 10.0 t -65.63 127.25 31.14 Favored 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 114.105 1.15 . . . . 0.0 114.105 -164.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 36.8 m-85 50.51 31.74 5.9 Favored 'General case' 0 CA--C 1.549 0.936 0 C-N-CA 126.146 1.778 . . . . 0.0 114.329 -177.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 38.8 t -135.39 -21.48 1.56 Allowed 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.625 1.17 . . . . 0.0 113.868 -167.475 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.96 170.7 37.7 Favored Glycine 0 CA--C 1.529 0.962 0 C-N-CA 124.593 1.092 . . . . 0.0 113.13 -174.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -100.96 158.6 15.87 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 125.557 1.543 . . . . 0.0 110.763 170.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 9.8 t -59.95 -31.28 69.72 Favored 'General case' 0 N--CA 1.476 0.828 0 N-CA-C 113.342 0.867 . . . . 0.0 113.342 179.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -100.13 -7.69 24.55 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.901 1.28 . . . . 0.0 113.705 177.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -149.21 87.57 1.54 Allowed 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 124.496 1.119 . . . . 0.0 112.27 -173.307 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . 0.404 ' CD2' ' H ' ' A' ' 35' ' ' TYR . 46.9 t-80 -153.34 174.6 14.12 Favored 'General case' 0 CA--C 1.554 1.129 0 C-N-CA 127.03 2.132 . . . . 0.0 110.009 176.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.404 ' H ' ' CD2' ' A' ' 34' ' ' HIS 0.297 1.7 p90 59.06 -30.24 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 131.157 3.783 . . . . 0.0 117.994 179.315 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 86.6 p -60.83 163.56 5.59 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 119.487 1.039 . . . . 0.0 111.423 162.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 51.9 ttt-85 54.98 24.72 6.16 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.587 1.155 . . . . 0.0 112.508 -164.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 61.4 t-80 46.24 96.07 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 128.043 2.537 . . . . 0.0 114.263 -167.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.433 ' HB3' ' CD ' ' A' ' 40' ' ' PRO 0.431 6.4 t 73.18 -105.02 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.236 0 C-N-CA 127.984 2.514 . . . . 0.0 115.602 177.636 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.433 ' CD ' ' HB3' ' A' ' 39' ' ' CYS . 61.2 Cg_endo -66.75 138.96 50.79 Favored 'Trans proline' 0 C--N 1.356 0.937 0 C-N-CA 122.695 2.264 . . . . 0.0 113.773 -166.26 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 17.7 tptm -143.62 -29.19 0.52 Allowed 'General case' 0 N--CA 1.473 0.707 0 N-CA-C 114.978 1.473 . . . . 0.0 114.978 -171.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -152.46 174.67 13.6 Favored 'General case' 0 CA--C 1.549 0.914 0 N-CA-C 114.586 1.328 . . . . 0.0 114.586 -173.167 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.276 2.7 mt 64.15 63.04 0.14 Allowed 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 C-N-CA 127.48 2.312 . . . . 0.0 114.174 169.269 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 9.7 pt20 -128.83 168.74 15.47 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 125.478 1.511 . . . . 0.0 113.095 173.247 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 83.9 m -70.91 163.48 27.34 Favored 'General case' 0 CA--C 1.543 0.711 0 CA-C-O 121.792 0.806 . . . . 0.0 112.237 166.292 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 18.4 m -74.32 -24.02 59.14 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.753 1.39 . . . . 0.0 114.753 -177.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 56.9 mtpt -120.64 -5.65 9.72 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -176.528 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 23.6 p -148.53 158.72 44.31 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 124.579 1.151 . . . . 0.0 111.995 178.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 p-10 -74.37 137.92 43.08 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.562 1.145 . . . . 0.0 113.202 -176.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER 58.05 155.41 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.123 0 C-N-CA 128.538 2.735 . . . . 0.0 115.203 -172.343 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m -88.4 -10.52 10.72 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 O-C-N 120.571 -1.33 . . . . 0.0 111.164 157.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -72.06 40.26 0.7 Allowed Glycine 0 CA--C 1.537 1.449 0 C-N-CA 128.593 2.996 . . . . 0.0 117.174 -164.278 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -130.06 -138.03 0.22 Allowed 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 127.533 2.333 . . . . 0.0 111.33 -175.567 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 78.5 t80 -51.92 121.91 7.46 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 124.957 1.303 . . . . 0.0 113.194 -176.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 76.8 mtp85 47.75 23.28 0.42 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 128.062 2.545 . . . . 0.0 114.562 -175.661 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.28 77.3 p 44.63 27.99 0.29 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 127.807 2.443 . . . . 0.0 114.906 -166.635 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -145.67 -13.33 0.5 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 116.88 2.178 . . . . 0.0 116.88 -171.27 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.315 1.7 t 97.29 -64.45 0.0 OUTLIER Pre-proline 0 CA--C 1.557 1.222 0 N-CA-C 118.987 2.958 . . . . 0.0 118.987 173.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 97.0 Cg_endo -75.95 159.63 37.71 Favored 'Trans proline' 0 C--N 1.353 0.786 0 CA-C-N 122.983 2.101 . . . . 0.0 114.532 -162.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 83.3 t60 -61.66 144.9 53.8 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 125.369 1.468 . . . . 0.0 113.588 179.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 64.0 tttm -140.5 151.67 44.99 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 126.69 1.996 . . . . 0.0 110.602 169.342 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 28.7 p90 -64.7 151.8 44.08 Favored 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 178.267 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 71.4 tttt -124.66 23.85 7.94 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 126.163 1.785 . . . . 0.0 113.164 -174.803 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 58.6 mtmt -71.8 -19.11 62.04 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 125.376 1.47 . . . . 0.0 114.873 -171.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.452 HG22 ' H ' ' A' ' 67' ' ' CYS . 1.9 p -144.23 133.72 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.682 0 C-N-CA 126.277 1.831 . . . . 0.0 109.674 177.767 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 30.1 mm-40 -94.77 -4.29 47.56 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.986 0.915 . . . . 0.0 113.36 -178.411 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.452 ' H ' HG22 ' A' ' 65' ' ' VAL . 78.0 m -112.58 1.15 15.69 Favored 'General case' 0 N--CA 1.472 0.666 0 C-N-CA 125.663 1.585 . . . . 0.0 114.879 -166.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.263 11.0 t 55.7 -46.72 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 129.292 3.037 . . . . 0.0 118.266 -171.462 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.0 pp -90.92 -18.04 25.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.958 1.703 . . . . 0.0 114.23 -176.124 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 73.9 m -76.05 166.63 23.21 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 124.153 0.981 . . . . 0.0 112.265 177.423 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 28.2 tptp -72.18 150.34 43.85 Favored 'General case' 0 N--CA 1.474 0.751 0 O-C-N 121.487 -0.758 . . . . 0.0 111.921 179.269 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.2 p -74.92 28.74 0.09 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 128.461 2.705 . . . . 0.0 116.064 -176.784 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -122.09 156.35 33.77 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 126.508 1.923 . . . . 0.0 110.48 171.542 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -65.26 116.42 6.58 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.728 0.811 . . . . 0.0 110.87 177.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 49.6 p-80 -137.71 2.82 2.45 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 126.131 1.772 . . . . 0.0 112.861 -174.472 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 2.7 m -81.28 34.61 0.37 Allowed 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 126.029 1.731 . . . . 0.0 115.568 -156.719 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -54.15 139.16 36.31 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 125.274 1.43 . . . . 0.0 112.224 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 45.92 45.98 12.09 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 124.905 1.282 . . . . 0.0 113.522 -170.119 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 84.7 mtm180 58.26 38.75 26.12 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 126.374 1.87 . . . . 0.0 113.45 -176.552 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 35.7 t 60.57 123.11 0.02 OUTLIER Pre-proline 0 CA--C 1.551 1.01 0 C-N-CA 129.085 2.954 . . . . 0.0 113.394 -165.176 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -76.34 -25.01 10.26 Favored 'Trans proline' 0 CA--C 1.539 0.745 0 C-N-CA 122.222 1.948 . . . . 0.0 113.249 -176.249 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 16.3 m -85.28 -5.58 59.31 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 115.362 1.616 . . . . 0.0 115.362 -167.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 15.2 tt -71.59 149.38 9.57 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.702 0 C-N-CA 123.658 0.783 . . . . 0.0 112.35 -178.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 42.8 p90 -78.86 169.53 18.08 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.431 1.493 . . . . 0.0 114.568 -173.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 32.3 ttm-85 -58.61 145.36 39.89 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 126.911 2.085 . . . . 0.0 113.063 -175.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -111.31 169.97 8.43 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 125.351 1.461 . . . . 0.0 113.193 -178.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 50.4 p90 -61.38 -26.93 68.16 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -174.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . 0.52 HD13 ' H ' ' A' ' 88' ' ' ILE . 0.1 OUTLIER -72.22 -7.38 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 N-CA-C 114.234 1.198 . . . . 0.0 114.234 173.959 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 97.0 mt -123.43 5.13 9.03 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.548 1.939 . . . . 0.0 113.579 -178.3 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 4.8 p -73.99 -29.21 25.1 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 CA-C-N 119.476 1.035 . . . . 0.0 113.777 -172.398 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 25.9 t0 49.07 55.16 9.73 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 126.203 1.801 . . . . 0.0 114.676 174.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 26.7 t0 -133.0 144.12 49.89 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 125.01 1.324 . . . . 0.0 112.247 179.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 26.6 m120 -78.65 136.19 37.4 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.519 1.128 . . . . 0.0 111.88 -177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -103.42 157.72 16.84 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 124.634 1.173 . . . . 0.0 113.229 179.745 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -78.3 128.56 33.88 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.27 1.028 . . . . 0.0 111.024 178.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -133.82 -0.93 3.09 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.007 1.484 . . . . 0.0 115.007 -176.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -88.07 147.91 41.78 Favored Pre-proline 0 N--CA 1.477 0.914 0 C-N-CA 124.522 1.129 . . . . 0.0 112.15 -177.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -60.88 155.03 51.88 Favored 'Trans proline' 0 CA--C 1.541 0.853 0 C-N-CA 123.399 2.733 . . . . 0.0 114.204 175.545 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 27.2 tptt -149.65 -172.8 4.24 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 126.251 1.82 . . . . 0.0 111.07 177.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 10.5 p -53.05 144.32 4.0 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 125.068 1.347 . . . . 0.0 112.886 177.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 94.7 mt -69.63 159.73 82.56 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 124.352 1.061 . . . . 0.0 112.51 -179.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_exo -59.42 -23.01 68.6 Favored 'Trans proline' 0 CA--C 1.54 0.815 0 C-N-CA 123.575 2.85 . . . . 0.0 115.064 177.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 60.0 t80 -123.53 126.74 47.24 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 125.531 1.532 . . . . 0.0 110.244 172.678 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 34.4 p80 -148.2 27.89 0.93 Allowed 'General case' 0 CA--C 1.547 0.85 0 C-N-CA 124.53 1.132 . . . . 0.0 113.268 -174.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 7.6 t -122.48 170.32 10.1 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.704 1.201 . . . . 0.0 113.752 -173.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 81.3 mt -125.34 136.46 60.78 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.511 0 C-N-CA 127.556 2.343 . . . . 0.0 110.161 -171.85 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 67.8 t80 -96.44 -48.39 5.59 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 124.219 1.008 . . . . 0.0 112.844 176.797 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 43.5 t -89.02 109.9 20.68 Favored 'General case' 0 CA--C 1.535 0.386 0 C-N-CA 123.967 0.907 . . . . 0.0 111.174 178.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.0 t80 -70.63 -22.69 62.5 Favored 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.103 0.961 . . . . 0.0 113.538 -178.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 74.3 m-20 -83.0 -19.62 36.65 Favored 'General case' 0 CA--C 1.546 0.817 0 N-CA-C 114.963 1.468 . . . . 0.0 114.963 -171.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 31.5 p -150.08 10.12 0.69 Allowed 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 115.605 1.706 . . . . 0.0 115.605 174.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.07 3.71 85.21 Favored Glycine 0 CA--C 1.537 1.443 0 O-C-N 121.033 -1.042 . . . . 0.0 115.199 179.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -81.4 -159.76 23.95 Favored Glycine 0 CA--C 1.533 1.171 0 C-N-CA 124.758 1.171 . . . . 0.0 113.874 176.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.36 169.07 25.56 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 126.09 1.756 . . . . 0.0 112.272 176.259 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 70.31 22.3 77.53 Favored Glycine 0 CA--C 1.535 1.293 0 N-CA-C 117.055 1.582 . . . . 0.0 117.055 158.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . 0.414 ' C ' ' H ' ' A' ' 118' ' ' GLY . 1.7 p80 -138.81 -165.45 1.83 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-N 118.845 1.323 . . . . 0.0 112.145 178.03 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 77.3 m-85 -66.04 30.42 0.02 OUTLIER 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 126.259 1.823 . . . . 0.0 113.998 169.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . 0.414 ' H ' ' C ' ' A' ' 116' ' ' HIS . . . -53.42 -25.75 28.04 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 128.232 2.825 . . . . 0.0 114.869 -178.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -61.9 -40.24 94.75 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 126.298 1.839 . . . . 0.0 113.533 174.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -111.61 -15.35 13.49 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 126.056 1.742 . . . . 0.0 113.027 -172.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 1.6 p -62.7 155.36 26.64 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.809 0.814 . . . . 0.0 112.698 178.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 21.1 pttp -70.26 155.41 40.7 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 124.01 0.924 . . . . 0.0 112.894 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -74.93 129.09 37.05 Favored 'General case' 0 CA--C 1.543 0.698 0 O-C-N 122.126 -0.359 . . . . 0.0 110.452 168.602 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 49.4 tttp . . . . . 0 C--O 1.253 1.237 0 C-N-CA 126.883 2.073 . . . . 0.0 113.296 -178.654 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 60.2 mtmt . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 110.737 -0.097 . . . . 0.0 110.737 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -89.24 156.8 18.53 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.201 1.0 . . . . 0.0 113.531 -178.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -95.57 136.36 36.06 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.628 1.171 . . . . 0.0 110.982 172.033 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -53.73 -48.31 93.82 Favored Pre-proline 0 CA--C 1.551 1.017 0 N-CA-C 113.421 0.897 . . . . 0.0 113.421 170.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -75.81 -41.47 0.54 Allowed 'Trans proline' 0 C--N 1.355 0.893 0 C-N-CA 122.63 2.22 . . . . 0.0 113.988 177.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 2.5 tmmm? 59.01 -54.03 0.05 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 128.778 2.831 . . . . 0.0 116.122 -171.115 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -156.86 167.95 28.94 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 127.828 2.451 . . . . 0.0 111.703 175.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -74.48 -34.03 63.0 Favored 'General case' 0 CA--C 1.546 0.822 0 N-CA-C 113.826 1.047 . . . . 0.0 113.826 176.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -153.89 -47.32 0.09 Allowed 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.966 1.306 . . . . 0.0 112.879 -175.508 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 26.9 p -79.06 -164.91 0.67 Allowed 'General case' 0 CA--C 1.547 0.846 0 C-N-CA 124.284 1.034 . . . . 0.0 111.96 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.9 t -139.15 29.26 2.25 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 116.354 1.983 . . . . 0.0 116.354 -162.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 4.2 tp60 -94.83 156.33 16.41 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.966 1.306 . . . . 0.0 111.512 175.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 1.5 mtm180 -76.29 161.25 28.9 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 126.17 1.788 . . . . 0.0 112.49 178.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 81.22 -11.73 41.96 Favored Glycine 0 CA--C 1.535 1.318 0 N-CA-C 117.652 1.821 . . . . 0.0 117.652 162.156 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.253 0.6 OUTLIER -134.82 72.6 1.46 Allowed 'General case' 0 N--CA 1.471 0.622 0 CA-C-N 119.591 1.696 . . . . 0.0 111.744 173.95 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.75 177.9 0.1 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 127.129 2.172 . . . . 0.0 113.858 175.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -28.24 -68.84 0.06 Allowed 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 127.184 2.194 . . . . 0.0 115.271 -173.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.9 pttp -75.5 -18.54 59.79 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -92.09 -21.97 20.16 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.837 1.655 . . . . 0.0 113.114 -178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 6.1 t -56.97 -43.66 99.49 Favored Pre-proline 0 CA--C 1.549 0.933 0 C-N-CA 125.58 1.552 . . . . 0.0 114.934 179.554 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -66.83 -11.29 31.48 Favored 'Trans proline' 0 C--N 1.355 0.9 0 C-N-CA 122.519 2.146 . . . . 0.0 117.044 -168.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 64.0 m80 -60.86 -19.16 59.55 Favored 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.302 1.223 . . . . 0.0 114.302 -176.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 16.6 tt -70.0 -19.37 22.5 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.815 0 C-N-CA 126.223 1.809 . . . . 0.0 113.829 174.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 3.4 mt -104.85 129.62 57.15 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.527 0 C-N-CA 126.421 1.888 . . . . 0.0 109.414 -176.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.6 p -75.95 133.44 40.47 Favored 'General case' 0 CA--C 1.542 0.668 0 O-C-N 121.416 -0.803 . . . . 0.0 110.375 168.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 12.7 p -57.71 120.61 8.67 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.658 1.583 . . . . 0.0 113.774 -164.798 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 64.0 m-85 55.3 -13.92 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 128.358 2.663 . . . . 0.0 116.984 -171.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.6 t -87.63 46.34 1.37 Allowed 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 126.435 1.894 . . . . 0.0 110.941 176.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 161.23 159.73 10.24 Favored Glycine 0 CA--C 1.529 0.955 0 O-C-N 120.594 -1.316 . . . . 0.0 114.864 171.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -124.58 134.14 53.05 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 125.034 1.333 . . . . 0.0 109.524 163.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.7 t -66.77 -9.54 37.94 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 115.524 1.675 . . . . 0.0 115.524 -162.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -104.08 -10.27 18.14 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 125.278 1.431 . . . . 0.0 114.519 172.602 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 20.6 m-20 -119.94 -17.91 8.33 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 126.043 1.737 . . . . 0.0 113.682 -174.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 49.4 t-80 -87.47 145.07 26.42 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.833 1.653 . . . . 0.0 112.922 -173.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -150.66 155.43 39.34 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 125.504 1.522 . . . . 0.0 109.855 174.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 75.1 p -61.43 -30.26 70.46 Favored 'General case' 0 N--CA 1.476 0.831 0 N-CA-C 114.615 1.339 . . . . 0.0 114.615 -173.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 34.6 mtp-105 -82.79 -28.65 30.15 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 125.145 1.378 . . . . 0.0 112.915 171.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 5.4 t-160 -85.94 -9.35 57.03 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 125.314 1.446 . . . . 0.0 113.448 179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.5 t -17.51 -61.87 0.04 OUTLIER Pre-proline 0 CA--C 1.552 1.039 0 C-N-CA 130.558 3.543 . . . . 0.0 117.3 -175.809 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -63.57 -21.76 70.54 Favored 'Trans proline' 0 CA--C 1.542 0.895 0 C-N-CA 122.757 2.305 . . . . 0.0 115.982 -174.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -83.93 112.1 19.85 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 119.803 1.183 . . . . 0.0 110.165 176.296 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -149.77 -155.8 0.66 Allowed 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 124.838 1.255 . . . . 0.0 112.331 -159.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 10.4 mt -80.5 87.29 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.636 0 C-N-CA 124.709 1.204 . . . . 0.0 109.511 179.322 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 24.5 pt20 -128.38 160.37 32.45 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.181 1.792 . . . . 0.0 113.154 -171.66 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 35.0 m -74.62 -4.11 35.21 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 127.379 2.271 . . . . 0.0 113.63 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 48.2 m 64.66 -28.75 0.1 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 128.102 2.561 . . . . 0.0 117.471 -171.782 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -124.45 3.84 8.37 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 126.155 1.782 . . . . 0.0 113.71 178.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 38.3 t -154.44 47.3 0.58 Allowed 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 124.896 1.278 . . . . 0.0 111.031 -172.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 34.2 m-20 49.39 -159.11 0.06 Allowed 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.864 1.266 . . . . 0.0 114.203 179.518 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.463 ' HG2' ' H ' ' A' ' 52' ' ' GLY . 21.0 tt0 -48.17 140.17 7.59 Favored 'General case' 0 CA--C 1.552 1.054 0 O-C-N 120.018 -1.677 . . . . 0.0 113.193 178.408 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.4 m -63.73 -23.21 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 O-C-N 119.742 -1.849 . . . . 0.0 111.507 171.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . 0.463 ' H ' ' HG2' ' A' ' 50' ' ' GLU . . . -81.13 -13.94 80.02 Favored Glycine 0 CA--C 1.534 1.236 0 C-N-CA 125.962 1.744 . . . . 0.0 116.294 -169.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 16.4 p80 -79.86 -17.7 52.55 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 120.098 1.949 . . . . 0.0 115.152 -168.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 24.5 m-85 -131.74 144.16 50.77 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.904 1.282 . . . . 0.0 110.922 169.263 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 19.5 tpt180 -58.84 152.8 18.43 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 125.392 1.477 . . . . 0.0 112.395 -173.128 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.7 m 58.91 40.81 22.17 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 124.048 0.939 . . . . 0.0 113.175 -176.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.275 18.7 pt20 48.14 49.16 17.82 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 126.809 2.044 . . . . 0.0 114.454 -175.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 73.7 m 63.18 148.75 0.1 OUTLIER Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 128.362 2.665 . . . . 0.0 115.762 -170.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 93.0 Cg_endo -70.66 162.42 42.58 Favored 'Trans proline' 0 CA--C 1.54 0.797 0 C-N-CA 123.376 2.717 . . . . 0.0 112.659 174.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 83.5 t60 -141.99 143.06 33.01 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 125.012 1.325 . . . . 0.0 111.934 176.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -147.46 142.39 26.93 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 126.416 1.886 . . . . 0.0 110.841 173.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 58.1 p-90 -134.76 -4.34 2.52 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 114.953 1.464 . . . . 0.0 114.953 179.062 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 53.3 tttp -127.03 147.49 50.14 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 125.423 1.489 . . . . 0.0 111.939 -171.678 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 99.4 mttt -69.49 -35.55 75.68 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.864 1.266 . . . . 0.0 113.163 -177.186 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.2 p -106.75 145.32 14.51 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.795 0 C-N-CA 125.976 1.71 . . . . 0.0 110.688 174.422 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 8.5 tm0? -84.03 24.62 0.9 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.039 1.336 . . . . 0.0 113.298 -173.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 49.8 m -137.05 154.36 50.38 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 125.783 1.633 . . . . 0.0 110.701 -178.543 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 11.3 t -70.5 -177.37 1.47 Allowed 'General case' 0 CA--C 1.542 0.654 0 O-C-N 122.098 -0.376 . . . . 0.0 110.588 149.643 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . 0.305 2.9 pp 55.25 9.92 0.39 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 127.865 2.466 . . . . 0.0 116.805 173.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 46.7 m -116.43 164.21 14.89 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 125.577 1.551 . . . . 0.0 114.022 -171.401 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt 59.78 1.55 0.31 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.989 2.916 . . . . 0.0 118.353 172.597 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 36.0 p -72.67 -32.71 66.02 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 124.124 0.969 . . . . 0.0 112.137 156.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -139.25 -179.03 5.63 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 129.011 2.925 . . . . 0.0 110.23 174.027 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 64.5 mttp -54.97 148.44 13.51 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.424 1.49 . . . . 0.0 113.107 179.698 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -85.11 114.83 22.53 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.96 0.904 . . . . 0.0 111.882 179.222 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 8.9 m -77.25 78.04 3.78 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 125.443 1.497 . . . . 0.0 112.759 -178.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -57.15 -28.27 62.6 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.336 1.455 . . . . 0.0 114.1 -174.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -81.06 -9.91 59.76 Favored 'General case' 0 CA--C 1.547 0.856 0 N-CA-C 115.11 1.522 . . . . 0.0 115.11 177.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 32.0 ttm180 -131.72 -31.28 1.56 Allowed 'General case' 0 N--CA 1.48 1.039 0 N-CA-C 114.789 1.403 . . . . 0.0 114.789 -169.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 49.8 t -79.14 -46.17 1.69 Allowed Pre-proline 0 CA--C 1.55 0.952 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -65.46 -34.01 44.72 Favored 'Trans proline' 0 C--N 1.354 0.866 0 C-N-CA 122.287 1.991 . . . . 0.0 114.649 -175.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 6.1 p -148.78 138.83 22.24 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 125.002 1.321 . . . . 0.0 111.024 -176.707 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 19.2 tt -140.5 131.28 29.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.823 0 C-N-CA 125.622 1.569 . . . . 0.0 111.141 -176.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 17.9 m0 49.78 31.46 4.5 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 126.661 1.984 . . . . 0.0 115.148 177.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 80.5 ttt180 -82.99 125.69 31.7 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 125.784 1.634 . . . . 0.0 110.495 177.933 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -95.96 146.95 24.18 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.665 0.786 . . . . 0.0 112.884 -177.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 71.2 m-85 -119.33 32.99 5.82 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 125.974 1.71 . . . . 0.0 111.814 178.753 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 1.8 pp -69.56 162.13 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 C-N-CA 124.884 1.274 . . . . 0.0 113.434 -176.095 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 90.6 mt -108.29 151.66 25.67 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 125.279 1.432 . . . . 0.0 111.738 -179.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 10.6 p -137.97 39.4 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 C-N-CA 127.423 2.289 . . . . 0.0 109.231 171.129 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -121.66 103.47 8.92 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.797 1.639 . . . . 0.0 109.722 -162.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 4.8 p-10 -132.15 163.79 27.74 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.427 1.491 . . . . 0.0 113.603 -164.603 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -102.23 14.23 32.53 Favored 'General case' 0 CA--C 1.549 0.932 0 N-CA-C 114.576 1.325 . . . . 0.0 114.576 -170.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -67.53 122.41 17.94 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 120.421 -1.424 . . . . 0.0 111.243 178.206 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -83.02 -26.92 30.74 Favored 'General case' 0 N--CA 1.475 0.807 0 N-CA-C 114.172 1.175 . . . . 0.0 114.172 -170.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 57.64 -19.1 0.02 OUTLIER 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 128.68 2.792 . . . . 0.0 118.295 -179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 52.0 tptt 46.4 71.69 1.49 Allowed Pre-proline 0 N--CA 1.477 0.901 0 C-N-CA 128.256 2.623 . . . . 0.0 113.587 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -63.6 150.4 88.58 Favored 'Trans proline' 0 CA--C 1.539 0.77 0 C-N-CA 122.284 1.99 . . . . 0.0 110.929 168.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -131.16 154.29 48.51 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 125.38 1.472 . . . . 0.0 111.735 -176.08 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 35.5 m -110.86 13.35 8.6 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.114 0 C-N-CA 125.889 1.676 . . . . 0.0 112.906 176.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 42.5 tp -66.96 -30.95 3.5 Favored Pre-proline 0 CA--C 1.553 1.058 0 N-CA-C 114.596 1.332 . . . . 0.0 114.596 172.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 67.7 Cg_exo -58.94 162.1 14.15 Favored 'Trans proline' 0 C--N 1.355 0.915 0 C-N-CA 122.862 2.375 . . . . 0.0 113.779 171.268 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 36.5 t80 -63.54 153.55 35.33 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 27.4 m80 -75.46 1.19 14.69 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 116.435 2.013 . . . . 0.0 116.435 -158.486 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 33.5 p -98.92 -7.36 27.23 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.755 1.622 . . . . 0.0 114.776 -173.623 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 36.1 pt -110.99 137.94 41.32 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 124.952 1.301 . . . . 0.0 112.206 178.36 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -159.12 129.65 5.91 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.765 1.226 . . . . 0.0 112.418 -176.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 28.2 p -92.03 159.69 15.59 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 124.35 1.06 . . . . 0.0 113.799 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 83.3 t80 -130.14 -41.42 1.27 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.621 1.168 . . . . 0.0 113.317 -177.3 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.8 m120 -79.74 4.19 17.05 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 124.736 1.214 . . . . 0.0 113.524 175.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 36.0 t -139.01 145.54 39.79 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 127.091 2.157 . . . . 0.0 108.785 168.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -66.25 164.64 40.47 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 124.559 1.076 . . . . 0.0 115.191 -175.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.5 -13.29 23.09 Favored Glycine 0 CA--C 1.538 1.509 0 C-N-CA 125.35 1.452 . . . . 0.0 116.269 174.565 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . 0.278 64.4 pttt 45.92 31.41 1.08 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 127.804 2.442 . . . . 0.0 116.411 172.863 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -103.26 -17.07 19.02 Favored Glycine 0 CA--C 1.537 1.443 0 N-CA-C 117.095 1.598 . . . . 0.0 117.095 -168.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 13.9 p80 -151.53 156.19 40.02 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 119.211 1.505 . . . . 0.0 114.508 -166.159 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 19.3 t80 46.71 33.67 2.2 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 127.269 2.227 . . . . 0.0 115.33 166.803 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -59.74 -14.54 30.03 Favored Glycine 0 CA--C 1.536 1.373 0 C-N-CA 125.653 1.597 . . . . 0.0 116.73 -166.7 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -63.95 -34.49 78.1 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 124.575 1.15 . . . . 0.0 113.523 175.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -141.79 -11.21 0.89 Allowed 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.387 1.254 . . . . 0.0 114.387 -172.208 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 46.5 t -61.98 116.57 5.01 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.017 -1.052 . . . . 0.0 113.374 -174.445 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -147.51 144.82 28.83 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 128.637 2.775 . . . . 0.0 109.352 178.823 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 13.1 pt-20 -102.14 142.6 33.14 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.62 0.768 . . . . 0.0 111.455 166.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 89.1 mttt . . . . . 0 C--O 1.255 1.38 0 C-N-CA 126.245 1.818 . . . . 0.0 112.858 179.427 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 34.8 mmtp . . . . . 0 N--CA 1.492 1.665 0 N-CA-C 110.409 -0.219 . . . . 0.0 110.409 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -85.29 50.09 1.88 Allowed 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 125.401 1.48 . . . . 0.0 113.791 -175.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -66.28 116.24 7.11 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 124.113 0.965 . . . . 0.0 112.597 -175.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -72.92 -54.63 4.48 Favored Pre-proline 0 CA--C 1.55 0.968 0 C-N-CA 124.134 0.974 . . . . 0.0 112.798 172.088 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -80.42 -27.71 3.3 Favored 'Trans proline' 0 C--N 1.354 0.851 0 C-N-CA 123.0 2.466 . . . . 0.0 114.132 178.119 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 30.6 tptt 57.61 -67.92 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 128.31 2.644 . . . . 0.0 115.524 -175.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 36.0 t -166.17 154.88 11.08 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 129.145 2.978 . . . . 0.0 108.675 177.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.8 t30 -67.32 -55.28 14.51 Favored 'General case' 0 CA--C 1.547 0.845 0 O-C-N 120.85 -1.156 . . . . 0.0 112.747 -177.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -121.13 -58.59 1.79 Allowed 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.835 0.854 . . . . 0.0 113.056 -168.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 23.5 p -86.81 -159.05 0.47 Allowed 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 124.896 1.279 . . . . 0.0 111.194 172.502 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 61.4 m -149.9 169.37 21.29 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.606 1.162 . . . . 0.0 113.646 -174.952 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 61.55 27.11 16.68 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 126.184 1.793 . . . . 0.0 115.418 171.492 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 68.8 mtp85 -120.3 6.02 10.7 Favored 'General case' 0 N--CA 1.481 1.094 0 C-N-CA 125.343 1.457 . . . . 0.0 114.837 -177.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 74.51 -33.69 0.98 Allowed Glycine 0 CA--C 1.536 1.377 0 C-N-CA 125.44 1.495 . . . . 0.0 115.71 175.227 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -71.13 96.29 1.34 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 118.387 1.094 . . . . 0.0 112.263 175.063 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -56.03 179.74 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 127.186 2.195 . . . . 0.0 113.404 169.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.2 -64.37 0.56 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.506 1.522 . . . . 0.0 114.077 -169.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.95 -1.8 41.08 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 125.81 1.644 . . . . 0.0 115.29 179.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 28.9 t0 -94.53 -26.89 16.23 Favored 'General case' 0 CA--C 1.55 0.954 0 C-N-CA 125.101 1.361 . . . . 0.0 111.166 172.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 7.5 t -62.81 149.73 88.95 Favored Pre-proline 0 CA--C 1.558 1.267 0 C-N-CA 125.555 1.542 . . . . 0.0 110.958 173.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -68.21 149.23 75.97 Favored 'Trans proline' 0 CA--C 1.541 0.873 0 C-N-CA 122.748 2.299 . . . . 0.0 115.888 -161.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -111.91 0.36 16.08 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 125.439 1.496 . . . . 0.0 114.457 -178.196 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 17.2 mm -82.76 -6.97 10.56 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 124.637 1.175 . . . . 0.0 112.135 -175.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 9.5 mm -62.53 136.14 26.1 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.846 0 C-N-CA 125.776 1.631 . . . . 0.0 110.334 179.028 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 31.4 p -69.06 -43.38 74.73 Favored 'General case' 0 CA--C 1.55 0.967 0 O-C-N 121.178 -0.951 . . . . 0.0 113.562 -173.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 83.7 p -159.72 171.15 20.05 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 128.808 2.843 . . . . 0.0 108.851 162.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -76.34 37.74 0.17 Allowed 'General case' 0 CA--C 1.548 0.873 0 N-CA-C 114.962 1.467 . . . . 0.0 114.962 -173.586 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 30.5 p -99.15 -31.54 11.7 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 127.144 2.177 . . . . 0.0 112.706 167.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 174.41 170.84 38.09 Favored Glycine 0 CA--C 1.529 0.931 0 N-CA-C 115.392 0.917 . . . . 0.0 115.392 -177.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -70.52 106.92 3.62 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 115.311 1.597 . . . . 0.0 115.311 -168.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER 67.3 -150.09 0.18 Allowed 'General case' 0 N--CA 1.485 1.312 0 CA-C-N 114.577 -1.192 . . . . 0.0 113.496 135.565 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -92.57 1.49 57.23 Favored 'General case' 0 CA--C 1.548 0.9 0 O-C-N 120.419 -1.426 . . . . 0.0 113.182 176.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -86.64 -31.31 21.18 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 -173.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -81.86 157.13 24.5 Favored 'General case' 0 CA--C 1.542 0.64 0 C-N-CA 123.814 0.846 . . . . 0.0 112.351 171.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -115.83 179.21 4.04 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 125.167 1.387 . . . . 0.0 111.409 179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 18.7 m -69.44 16.67 0.05 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 127.283 2.233 . . . . 0.0 116.111 -176.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mmt-85 -125.75 -3.47 7.16 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 126.962 2.105 . . . . 0.0 113.156 166.713 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -133.01 4.7 3.81 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 127.491 2.316 . . . . 0.0 113.324 177.583 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 6.0 t -47.75 -48.32 60.51 Favored Pre-proline 0 CA--C 1.555 1.166 0 C-N-CA 125.06 1.344 . . . . 0.0 113.012 177.753 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -85.02 80.35 2.14 Favored 'Trans proline' 0 CA--C 1.55 1.317 0 C-N-CA 123.296 2.664 . . . . 0.0 112.512 167.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.8 tttt -151.99 153.39 33.96 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.04 1.336 . . . . 0.0 112.401 177.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.24 -31.64 0.1 Allowed 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 128.159 2.584 . . . . 0.0 117.202 -175.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 16.2 mm -112.78 55.52 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.838 0 C-N-CA 126.143 1.777 . . . . 0.0 109.527 -179.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.432 ' HA ' ' C ' ' A' ' 50' ' ' GLU . 5.5 pm0 -140.91 148.29 40.21 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.525 1.13 . . . . 0.0 112.246 174.143 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 29.7 p -86.98 167.39 14.29 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.092 0.957 . . . . 0.0 111.718 170.299 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 12.9 t -58.66 133.7 56.13 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 113.97 1.1 . . . . 0.0 113.97 -170.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt 55.47 19.15 3.0 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 126.819 2.048 . . . . 0.0 114.441 -176.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 78.4 m -130.14 178.51 6.51 Favored 'General case' 0 CA--C 1.548 0.872 0 C-N-CA 126.473 1.909 . . . . 0.0 112.522 -175.655 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -111.65 -15.91 13.35 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 115.183 1.549 . . . . 0.0 115.183 -166.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.432 ' C ' ' HA ' ' A' ' 44' ' ' GLN . 47.4 mt-10 -134.19 167.32 20.89 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 126.766 2.027 . . . . 0.0 108.996 173.019 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 2.1 m -58.6 -11.3 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 120.408 -1.432 . . . . 0.0 113.99 179.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 152.93 140.18 3.04 Favored Glycine 0 CA--C 1.527 0.834 0 C-N-CA 127.153 2.311 . . . . 0.0 109.936 -174.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -125.73 -3.96 7.12 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.763 1.625 . . . . 0.0 112.525 -176.485 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 72.1 m-85 -134.53 141.9 46.84 Favored 'General case' 0 N--CA 1.466 0.334 0 C-N-CA 126.546 1.938 . . . . 0.0 108.884 163.9 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 40.68 47.52 2.44 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 126.037 1.735 . . . . 0.0 112.855 178.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 4.9 m 64.16 -30.52 0.11 Allowed 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 118.658 2.836 . . . . 0.0 118.658 177.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 41.2 mt-30 -139.12 -4.26 1.53 Allowed 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 125.826 1.651 . . . . 0.0 114.071 -174.537 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . 0.292 18.1 p 36.74 49.52 1.31 Allowed Pre-proline 0 CA--C 1.557 1.221 0 C-N-CA 128.789 2.836 . . . . 0.0 116.914 -172.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -70.37 145.88 54.86 Favored 'Trans proline' 0 C--N 1.353 0.766 0 C-N-CA 122.649 2.233 . . . . 0.0 112.192 -178.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 89.8 m-70 -81.23 -13.6 58.37 Favored 'General case' 0 N--CA 1.473 0.682 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 166.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 16.6 tptp -72.82 160.73 31.7 Favored 'General case' 0 N--CA 1.47 0.571 0 C-N-CA 124.504 1.122 . . . . 0.0 111.194 170.205 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 20.9 t-105 -71.77 150.62 44.23 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.334 0.587 . . . . 0.0 112.433 179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 45.7 mttp -108.08 3.85 24.36 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 125.401 1.481 . . . . 0.0 114.235 -159.278 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 79.6 tttt -144.77 159.75 42.36 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 127.076 2.15 . . . . 0.0 110.095 173.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 12.9 p -93.84 133.11 36.02 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 C-N-CA 123.938 0.895 . . . . 0.0 111.164 174.778 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -72.4 -17.82 61.77 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 114.042 1.127 . . . . 0.0 114.042 -169.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . 0.405 ' C ' ' H ' ' A' ' 69' ' ' LEU . 77.0 m -87.11 -28.95 22.2 Favored 'General case' 0 CA--C 1.535 0.375 0 N-CA-C 114.117 1.154 . . . . 0.0 114.117 178.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER 58.1 -36.28 0.05 OUTLIER 'General case' 0 N--CA 1.485 1.305 0 C-N-CA 127.482 2.313 . . . . 0.0 116.081 -151.19 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.405 ' H ' ' C ' ' A' ' 67' ' ' CYS . 29.3 tp -70.55 -15.68 62.8 Favored 'General case' 0 CA--C 1.548 0.875 0 C-N-CA 129.907 3.283 . . . . 0.0 114.12 177.781 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 38.7 t -107.03 156.77 18.39 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 124.625 1.17 . . . . 0.0 112.587 -170.529 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -115.52 1.03 13.52 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 125.681 1.592 . . . . 0.0 114.418 178.956 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 29.7 t -87.34 147.97 25.25 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 113.265 0.839 . . . . 0.0 113.265 174.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 13.7 ptmm? -111.17 2.07 17.6 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 127.532 2.333 . . . . 0.0 115.115 175.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -112.75 -8.33 13.77 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 126.543 1.937 . . . . 0.0 113.599 -172.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -78.09 165.3 24.16 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 115.057 1.502 . . . . 0.0 115.057 -165.284 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 29.3 t -69.59 145.66 52.36 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 114.205 1.187 . . . . 0.0 114.205 178.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 73.0 mmtt -66.9 -22.71 65.95 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 127.265 2.226 . . . . 0.0 114.965 -173.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -77.25 33.76 0.16 Allowed 'General case' 0 CA--C 1.554 1.096 0 C-N-CA 125.117 1.367 . . . . 0.0 112.519 178.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 93.2 mtt180 46.19 47.47 13.26 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 127.485 2.314 . . . . 0.0 112.815 -165.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 27.6 p 33.75 66.45 1.29 Allowed Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 127.707 2.403 . . . . 0.0 116.204 168.262 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 63.8 Cg_endo -70.15 -29.21 22.34 Favored 'Trans proline' 0 CA--C 1.541 0.837 0 C-N-CA 122.82 2.346 . . . . 0.0 114.181 -172.256 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 57.8 p -113.12 -0.85 14.56 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 126.454 1.902 . . . . 0.0 114.714 -170.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.9 tp -61.05 -28.04 42.87 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.999 0 O-C-N 121.189 -0.944 . . . . 0.0 112.124 -177.243 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 13.3 t90 -78.1 13.96 1.3 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 125.439 1.496 . . . . 0.0 114.034 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 89.3 mmt-85 -125.34 1.79 7.75 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 126.852 2.061 . . . . 0.0 113.214 165.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -78.53 -9.26 59.27 Favored 'General case' 0 CA--C 1.546 0.815 0 N-CA-C 114.077 1.14 . . . . 0.0 114.077 179.021 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 37.1 p90 -67.73 -16.49 64.16 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 114.444 1.275 . . . . 0.0 114.444 -176.029 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 15.8 tt -80.17 -11.52 12.81 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.865 0 C-N-CA 124.663 1.185 . . . . 0.0 114.104 -176.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -86.24 9.28 18.13 Favored 'General case' 0 CA--C 1.552 1.047 0 C-N-CA 124.67 1.188 . . . . 0.0 114.096 -177.439 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 2.3 p -106.69 -8.33 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.147 0 N-CA-C 115.29 1.589 . . . . 0.0 115.29 -167.495 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -131.83 157.28 44.31 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 125.167 1.387 . . . . 0.0 113.771 -176.316 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -124.2 -22.88 4.65 Favored 'General case' 0 N--CA 1.478 0.932 0 N-CA-C 115.905 1.817 . . . . 0.0 115.905 -163.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 32.1 m120 -143.8 159.54 42.33 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 125.452 1.501 . . . . 0.0 112.004 178.625 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -126.36 -5.88 6.53 Favored 'General case' 0 N--CA 1.479 1.006 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -174.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -138.56 159.67 41.51 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 124.824 1.25 . . . . 0.0 113.591 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -146.75 165.08 30.72 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.946 1.699 . . . . 0.0 111.529 175.393 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.58 146.59 42.4 Favored Pre-proline 0 N--CA 1.477 0.876 0 C-N-CA 125.243 1.417 . . . . 0.0 112.273 172.614 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 36.1 Cg_exo -64.5 160.59 38.85 Favored 'Trans proline' 0 C--N 1.352 0.713 0 C-N-CA 123.262 2.642 . . . . 0.0 114.023 175.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -134.78 157.16 47.45 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.186 1.794 . . . . 0.0 111.477 173.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 34.6 m -90.28 -10.55 10.19 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 124.918 1.287 . . . . 0.0 114.301 -177.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.9 tp -73.33 -35.15 2.56 Favored Pre-proline 0 CA--C 1.554 1.121 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 -176.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 65.1 Cg_exo -61.8 148.69 92.53 Favored 'Trans proline' 0 C--N 1.354 0.817 0 C-N-CA 123.031 2.487 . . . . 0.0 114.578 -179.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 24.7 p90 -82.04 -20.82 37.53 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.816 1.413 . . . . 0.0 114.816 -175.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 46.9 56.64 6.46 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 126.444 1.897 . . . . 0.0 115.37 164.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 13.8 t -138.97 43.63 2.06 Favored 'General case' 0 N--CA 1.479 0.98 0 CA-C-O 123.913 1.816 . . . . 0.0 112.606 174.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 49.9 pt -100.63 -2.92 9.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 115.052 1.501 . . . . 0.0 115.052 -165.737 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 28.2 t80 -153.48 151.99 30.47 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.969 0.908 . . . . 0.0 112.969 -172.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 57.3 m -82.99 8.59 12.29 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.455 1.502 . . . . 0.0 114.822 177.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.0 m-85 63.42 -26.91 0.07 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 118.132 2.642 . . . . 0.0 118.132 177.098 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 22.5 m120 -133.16 -12.04 2.85 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 115.047 1.499 . . . . 0.0 115.047 -176.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 28.4 p -151.26 172.27 16.12 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 119.348 0.976 . . . . 0.0 112.915 -173.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -62.31 161.29 30.38 Favored Glycine 0 CA--C 1.538 1.516 0 C-N-CA 124.203 0.906 . . . . 0.0 113.695 173.856 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.29 172.07 39.58 Favored Glycine 0 CA--C 1.537 1.425 0 CA-C-O 121.677 0.598 . . . . 0.0 112.797 -165.085 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -125.58 -20.84 4.62 Favored 'General case' 0 N--CA 1.48 1.029 0 N-CA-C 115.569 1.692 . . . . 0.0 115.569 -165.831 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -171.43 22.18 0.08 OUTLIER Glycine 0 CA--C 1.535 1.337 0 N-CA-C 117.538 1.775 . . . . 0.0 117.538 -175.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -66.97 -51.0 60.53 Favored 'General case' 0 N--CA 1.481 1.105 0 CA-C-N 120.183 1.991 . . . . 0.0 112.459 -173.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -135.29 30.52 3.25 Favored 'General case' 0 CA--C 1.544 0.715 0 C-N-CA 127.395 2.278 . . . . 0.0 108.716 161.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.78 -16.25 22.99 Favored Glycine 0 CA--C 1.534 1.276 0 C-N-CA 127.18 2.324 . . . . 0.0 115.258 -170.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -63.26 -37.27 86.6 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 125.459 1.504 . . . . 0.0 113.542 171.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -141.97 -4.16 1.07 Allowed 'General case' 0 CA--C 1.549 0.906 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -166.354 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 17.7 p -72.95 31.68 0.07 Allowed 'General case' 0 CA--C 1.555 1.15 0 O-C-N 120.329 -1.482 . . . . 0.0 114.922 176.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 37.8 tttm -60.65 156.3 17.0 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 128.313 2.645 . . . . 0.0 111.588 169.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -66.62 160.73 24.8 Favored 'General case' 0 CA--C 1.549 0.938 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 169.932 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt . . . . . 0 C--O 1.253 1.277 0 C-N-CA 125.56 1.544 . . . . 0.0 114.532 -179.332 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 14.7 tppt? . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 119.473 -0.298 . . . . 0.0 111.198 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 56.19 31.19 17.88 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 126.451 1.901 . . . . 0.0 115.579 172.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -81.16 100.56 9.15 Favored 'General case' 0 CA--C 1.543 0.71 0 O-C-N 121.144 -0.973 . . . . 0.0 111.525 177.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -63.66 -50.54 71.47 Favored Pre-proline 0 CA--C 1.552 1.027 0 N-CA-C 113.855 1.057 . . . . 0.0 113.855 175.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -79.43 -44.35 0.12 Allowed 'Trans proline' 0 C--N 1.355 0.896 0 C-N-CA 122.023 1.815 . . . . 0.0 113.773 -177.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 1.1 tmtm? 61.48 -55.09 0.11 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 128.047 2.539 . . . . 0.0 114.612 -167.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.3 m -153.8 159.83 42.02 Favored 'General case' 0 CA--C 1.541 0.634 0 C-N-CA 128.656 2.782 . . . . 0.0 111.359 -178.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 50.8 t30 -76.3 -53.17 8.6 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 121.614 -0.679 . . . . 0.0 109.945 157.682 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 41.5 t-20 -134.84 161.54 34.91 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 126.632 1.973 . . . . 0.0 110.207 176.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . 0.318 14.6 p 47.02 -159.39 0.03 OUTLIER 'General case' 0 CA--C 1.551 0.985 0 C-N-CA 126.397 1.879 . . . . 0.0 112.967 -161.461 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 57.4 p -145.43 28.96 1.17 Allowed 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -163.219 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 38.3 mt-30 -91.29 145.62 24.5 Favored 'General case' 0 CA--C 1.542 0.664 0 C-N-CA 124.287 1.035 . . . . 0.0 112.357 179.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 26.3 ptt180 -69.19 -28.79 66.7 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 115.562 1.69 . . . . 0.0 115.562 -165.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -81.81 -13.65 79.26 Favored Glycine 0 CA--C 1.533 1.17 0 N-CA-C 116.169 1.227 . . . . 0.0 116.169 -164.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -142.65 81.85 1.75 Allowed 'General case' 0 CA--C 1.542 0.655 0 CA-C-N 118.642 1.221 . . . . 0.0 113.437 -169.771 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 1.7 pp -62.12 -178.33 0.16 Allowed 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 125.224 1.41 . . . . 0.0 113.211 169.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.63 -68.81 0.11 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 126.495 1.918 . . . . 0.0 114.81 -166.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.4 pttp -68.9 -20.63 64.25 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 115.065 1.505 . . . . 0.0 115.065 -179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.0 m-20 -91.7 -24.53 19.45 Favored 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 125.746 1.618 . . . . 0.0 113.103 -176.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 8.7 t -57.06 -43.99 99.58 Favored Pre-proline 0 CA--C 1.551 1.005 0 C-N-CA 125.657 1.583 . . . . 0.0 114.83 -176.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -92.55 -5.79 3.24 Favored 'Trans proline' 0 CA--C 1.544 1.013 0 C-N-CA 122.554 2.169 . . . . 0.0 115.454 -174.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 29.2 m170 -131.8 155.72 47.27 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-N 119.608 1.095 . . . . 0.0 113.821 -168.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 2.2 pp -92.04 -14.68 8.45 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.37 1.068 . . . . 0.0 113.406 174.782 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 12.4 pt -83.98 142.34 13.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 125.041 1.336 . . . . 0.0 112.774 -176.43 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 2.5 p -84.37 101.99 12.4 Favored 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 124.215 1.006 . . . . 0.0 110.2 171.716 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 48.7 m 44.39 49.72 8.07 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 126.232 1.813 . . . . 0.0 115.681 170.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 5.9 t80 57.85 32.72 22.32 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.976 1.71 . . . . 0.0 115.255 179.446 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 52.8 t -66.61 -19.73 65.84 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 125.191 1.396 . . . . 0.0 112.791 170.236 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -166.58 -171.09 32.3 Favored Glycine 0 CA--C 1.531 1.09 0 O-C-N 120.695 -1.253 . . . . 0.0 114.688 174.647 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -88.41 127.92 35.51 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.419 1.087 . . . . 0.0 111.98 -178.603 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 6.1 t -58.15 -22.54 51.62 Favored 'General case' 0 N--CA 1.475 0.775 0 N-CA-C 115.404 1.631 . . . . 0.0 115.404 -172.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 34.8 m-20 -83.78 -11.47 57.04 Favored 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 114.574 1.324 . . . . 0.0 114.574 178.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -141.18 -1.32 1.37 Allowed 'General case' 0 CA--C 1.551 0.985 0 N-CA-C 114.997 1.48 . . . . 0.0 114.997 -169.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 13.4 t60 -83.97 142.8 30.24 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 120.82 -1.175 . . . . 0.0 113.345 -175.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -156.45 159.48 38.7 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.074 1.349 . . . . 0.0 111.116 175.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 26.1 m -60.47 -29.96 69.38 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 115.517 1.673 . . . . 0.0 115.517 -169.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -103.93 4.47 34.76 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 114.694 1.368 . . . . 0.0 114.694 173.2 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 6.6 t-160 -108.44 -19.05 13.59 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 125.886 1.674 . . . . 0.0 112.941 176.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 7.1 m -14.35 -65.55 0.03 OUTLIER Pre-proline 0 CA--C 1.551 1.006 0 C-N-CA 130.198 3.399 . . . . 0.0 117.191 176.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -67.63 -17.44 48.05 Favored 'Trans proline' 0 C--N 1.354 0.835 0 C-N-CA 122.927 2.418 . . . . 0.0 115.802 -171.516 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -100.53 53.43 0.87 Allowed 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.468 1.507 . . . . 0.0 112.143 -176.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -134.42 -107.67 0.23 Allowed 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.954 1.302 . . . . 0.0 112.253 178.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . 0.262 33.4 mt -96.54 22.5 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 125.37 1.468 . . . . 0.0 110.736 -176.084 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 pt20 -133.5 153.79 51.35 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.318 -1.489 . . . . 0.0 112.031 165.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 19.7 p -102.17 169.32 8.8 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.153 0.981 . . . . 0.0 112.125 174.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.3 m -59.63 143.33 50.79 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.888 1.07 . . . . 0.0 113.888 -174.829 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.4 mmmt 58.63 11.02 1.6 Allowed 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 126.351 1.86 . . . . 0.0 114.716 -173.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 73.0 m -138.79 174.72 10.23 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 125.915 1.686 . . . . 0.0 112.843 -170.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -114.5 5.04 15.42 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 125.413 1.485 . . . . 0.0 114.088 -175.196 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 25.3 tt0 -153.2 150.51 29.09 Favored 'General case' 0 CA--C 1.548 0.902 0 C-N-CA 125.472 1.509 . . . . 0.0 111.109 177.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 14.8 m -77.75 13.64 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 120.666 -1.271 . . . . 0.0 111.858 168.539 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -70.72 -136.29 0.13 Allowed Glycine 0 CA--C 1.531 1.062 0 C-N-CA 127.833 2.635 . . . . 0.0 114.359 -172.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.8 m-70 57.0 -147.38 0.53 Allowed 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.095 0.958 . . . . 0.0 111.532 -173.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 43.9 p90 -93.37 176.49 6.37 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.805 1.242 . . . . 0.0 113.764 172.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 47.3 ttp180 -23.36 134.13 0.01 OUTLIER 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 130.618 3.567 . . . . 0.0 116.133 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 38.1 m 55.59 47.52 20.63 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 125.657 1.583 . . . . 0.0 113.918 179.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . 0.255 14.4 pt20 50.39 43.86 26.79 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 126.725 2.01 . . . . 0.0 114.593 176.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER 59.32 170.19 0.07 OUTLIER Pre-proline 0 CA--C 1.555 1.138 0 C-N-CA 127.527 2.331 . . . . 0.0 115.267 -171.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -58.5 123.91 14.65 Favored 'Trans proline' 0 CA--C 1.536 0.625 0 C-N-CA 123.048 2.499 . . . . 0.0 113.865 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 29.9 p80 -101.52 24.07 10.22 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 126.206 1.802 . . . . 0.0 111.781 171.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.8 mtpt -136.1 160.33 38.98 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 128.117 2.567 . . . . 0.0 110.842 -176.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 6.5 m-90 -67.81 142.71 56.09 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.083 0.953 . . . . 0.0 112.168 178.179 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 42.7 tptt -83.85 131.9 34.84 Favored 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 123.764 0.826 . . . . 0.0 112.983 -171.631 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -123.75 142.93 50.63 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 127.142 2.177 . . . . 0.0 109.431 163.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 8.6 p -83.23 138.01 20.01 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.909 0 C-N-CA 123.521 0.728 . . . . 0.0 112.67 -172.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 7.1 pm0 -108.83 -2.41 18.48 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 126.476 1.91 . . . . 0.0 114.372 -173.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 57.1 m -77.31 -5.17 48.51 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 116.166 1.913 . . . . 0.0 116.166 -163.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.284 10.9 t 59.34 -39.47 0.07 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 129.034 2.934 . . . . 0.0 118.211 -174.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.2 pt? -81.35 -1.96 47.39 Favored 'General case' 0 N--CA 1.476 0.84 0 O-C-N 120.575 -1.328 . . . . 0.0 113.558 170.706 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 74.3 m -107.84 177.84 4.7 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 125.719 1.608 . . . . 0.0 111.994 179.737 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.9 tptt 68.5 138.88 0.03 OUTLIER 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 126.867 2.067 . . . . 0.0 111.32 -156.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 t 54.95 -171.14 0.06 Allowed 'General case' 0 CA--C 1.548 0.888 0 CA-C-N 116.017 -0.538 . . . . 0.0 112.34 -143.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 62.7 mttm 60.91 -8.94 0.07 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 129.047 2.939 . . . . 0.0 116.301 -176.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 83.0 tttt 57.81 111.47 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 128.302 2.641 . . . . 0.0 112.508 -161.736 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 24.6 t-80 -76.45 148.73 37.05 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -173.684 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 28.6 p -133.59 113.95 12.99 Favored 'General case' 0 N--CA 1.47 0.561 0 C-N-CA 125.916 1.686 . . . . 0.0 110.891 175.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -66.9 140.05 57.76 Favored 'General case' 0 N--CA 1.471 0.615 0 O-C-N 121.116 -0.99 . . . . 0.0 111.419 -175.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 60.22 10.18 2.22 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 126.903 2.081 . . . . 0.0 116.115 -173.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 68.6 mtm180 -130.43 -50.18 1.08 Allowed 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.289 1.436 . . . . 0.0 113.14 -175.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 85.0 m 60.29 144.15 0.06 OUTLIER Pre-proline 0 CA--C 1.554 1.125 0 C-N-CA 128.538 2.735 . . . . 0.0 114.468 -170.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo -72.41 -26.46 17.09 Favored 'Trans proline' 0 CA--C 1.54 0.789 0 C-N-CA 122.923 2.415 . . . . 0.0 114.055 -174.055 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 19.4 m -85.9 -0.5 55.56 Favored 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 115.52 1.674 . . . . 0.0 115.52 -168.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 47.9 pt -133.05 165.63 31.84 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 125.564 1.546 . . . . 0.0 112.005 -179.419 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 9.1 m-90 -121.39 157.62 30.09 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 124.971 1.308 . . . . 0.0 112.933 -170.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 86.2 mtt-85 -135.6 159.02 42.92 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 126.473 1.909 . . . . 0.0 112.479 -177.863 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . 58.47 6.03 0.52 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 118.972 2.953 . . . . 0.0 118.972 160.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 54.0 p90 -71.88 134.28 45.95 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-N 119.806 1.185 . . . . 0.0 112.429 -178.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 48.8 pt -132.13 -1.6 1.8 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 125.496 1.519 . . . . 0.0 113.45 177.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 4.3 tt -87.07 111.02 20.49 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 124.804 1.242 . . . . 0.0 108.979 176.048 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 33.7 m -124.31 5.91 4.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 N-CA-C 114.43 1.27 . . . . 0.0 114.43 -170.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 33.6 t70 -70.35 -21.34 62.9 Favored 'General case' 0 N--CA 1.476 0.837 0 O-C-N 121.283 -0.885 . . . . 0.0 113.315 176.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -117.5 143.77 45.73 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 125.907 1.683 . . . . 0.0 111.038 171.023 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -142.9 154.79 44.45 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 125.276 1.43 . . . . 0.0 111.642 -177.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -136.92 143.69 43.07 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 126.258 1.823 . . . . 0.0 111.164 179.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -132.85 157.9 43.88 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 125.881 1.672 . . . . 0.0 112.327 176.302 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -73.76 -177.75 2.9 Favored 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 124.196 0.999 . . . . 0.0 112.145 172.083 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 5.3 mptp? -57.29 150.83 40.48 Favored Pre-proline 0 N--CA 1.478 0.936 0 C-N-CA 124.011 0.924 . . . . 0.0 111.192 171.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -60.76 149.37 88.21 Favored 'Trans proline' 0 CA--C 1.538 0.698 0 C-N-CA 123.355 2.703 . . . . 0.0 113.348 -173.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -69.79 160.62 31.39 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 114.614 1.338 . . . . 0.0 114.614 -170.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 57.2 t -121.72 151.88 25.3 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 C-N-CA 127.023 2.129 . . . . 0.0 108.506 169.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 99.1 mt -57.28 142.1 76.27 Favored Pre-proline 0 CA--C 1.55 0.969 0 C-N-CA 123.803 0.841 . . . . 0.0 112.607 -174.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_endo -77.27 -15.16 16.16 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 123.302 2.668 . . . . 0.0 113.606 -178.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 48.4 m-85 -109.31 150.66 27.66 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 125.22 1.408 . . . . 0.0 112.019 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 38.6 m80 -86.53 155.65 20.4 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 124.219 1.008 . . . . 0.0 113.548 -173.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 97.2 m -90.88 143.61 26.55 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.813 1.245 . . . . 0.0 111.791 -179.692 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 89.9 mt -76.28 137.85 21.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 125.203 1.401 . . . . 0.0 110.737 178.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 46.8 p90 -110.87 146.94 35.61 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 125.409 1.484 . . . . 0.0 112.635 -178.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.8 t -128.77 11.45 6.15 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 125.263 1.425 . . . . 0.0 114.056 -173.459 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 27.5 p90 -63.56 -16.11 59.89 Favored 'General case' 0 N--CA 1.478 0.934 0 N-CA-C 115.412 1.634 . . . . 0.0 115.412 -166.259 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -63.91 -20.12 65.62 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 125.181 1.392 . . . . 0.0 114.545 -174.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.1 p -107.63 8.13 28.95 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 125.638 1.575 . . . . 0.0 113.819 172.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 83.51 131.83 1.94 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 126.017 1.77 . . . . 0.0 112.284 -166.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 79.85 112.99 0.26 Allowed Glycine 0 CA--C 1.535 1.337 0 C-N-CA 125.25 1.405 . . . . 0.0 113.232 -176.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.3 ptmt -69.84 -9.3 54.26 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 115.524 1.676 . . . . 0.0 115.524 -174.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 179.96 124.08 0.87 Allowed Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.801 1.191 . . . . 0.0 111.638 170.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 25.5 p80 -144.16 -46.15 0.26 Allowed 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.614 0.766 . . . . 0.0 113.045 179.869 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -130.3 37.31 3.89 Favored 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.23 1.812 . . . . 0.0 109.266 165.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -57.44 -17.9 27.55 Favored Glycine 0 CA--C 1.535 1.302 0 C-N-CA 126.815 2.15 . . . . 0.0 115.077 -170.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.0 t70 -56.62 -34.56 67.38 Favored 'General case' 0 CA--C 1.546 0.803 0 C-N-CA 125.497 1.519 . . . . 0.0 113.455 171.096 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.3 t70 -129.07 -25.26 2.78 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.722 1.609 . . . . 0.0 113.675 -176.349 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 7.8 t -75.45 -11.15 59.98 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.619 1.168 . . . . 0.0 113.699 -177.404 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 44.6 tptt -65.25 148.24 52.03 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 124.798 1.239 . . . . 0.0 112.874 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 29.1 mp0 -63.75 155.48 30.06 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.914 1.286 . . . . 0.0 113.107 177.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt . . . . . 0 C--O 1.254 1.326 0 C-N-CA 126.05 1.74 . . . . 0.0 111.715 176.904 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 86.0 tttt . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 119.548 -0.263 . . . . 0.0 111.4 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.7 mt-10 -115.3 151.12 35.15 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 125.391 1.476 . . . . 0.0 111.16 174.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -88.61 107.74 19.07 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 113.356 0.873 . . . . 0.0 113.356 -168.411 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -70.36 -51.5 13.13 Favored Pre-proline 0 CA--C 1.553 1.079 0 C-N-CA 123.957 0.903 . . . . 0.0 112.783 165.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -79.64 -29.95 2.65 Favored 'Trans proline' 0 C--N 1.354 0.842 0 C-N-CA 122.811 2.34 . . . . 0.0 114.328 178.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 18.6 tptm 58.76 -63.78 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 128.438 2.695 . . . . 0.0 115.962 -175.335 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 15.4 t -158.11 164.34 36.74 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 128.07 2.548 . . . . 0.0 110.302 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 7.1 p-10 -68.28 -31.42 70.86 Favored 'General case' 0 CA--C 1.547 0.847 0 O-C-N 120.997 -1.064 . . . . 0.0 113.171 176.196 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -160.79 -51.02 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 125.653 1.581 . . . . 0.0 112.466 179.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 8.1 p -91.11 63.07 4.99 Favored 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 125.64 1.576 . . . . 0.0 113.387 -172.16 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 65.6 m -35.92 89.46 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 130.665 3.586 . . . . 0.0 117.387 -172.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 42.6 mt-30 -137.67 143.09 41.17 Favored 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 126.998 2.119 . . . . 0.0 108.68 164.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 4.0 ppt_? -74.39 158.25 34.24 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 113.883 1.068 . . . . 0.0 113.883 -169.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 91.25 -23.54 23.87 Favored Glycine 0 CA--C 1.537 1.453 0 C-N-CA 125.567 1.556 . . . . 0.0 115.145 178.761 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . 0.264 13.9 p-80 -123.9 78.16 1.6 Allowed 'General case' 0 CA--C 1.543 0.682 0 CA-C-O 123.235 1.493 . . . . 0.0 111.756 173.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.6 pp -63.63 -179.54 0.38 Allowed 'General case' 0 CA--C 1.545 0.765 0 C-N-CA 126.613 1.965 . . . . 0.0 113.472 174.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -35.47 -66.55 0.19 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 126.967 2.107 . . . . 0.0 114.512 -174.073 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 21.6 pttp -74.76 -16.49 60.72 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 114.96 1.467 . . . . 0.0 114.96 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -94.78 -14.14 24.97 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 125.374 1.47 . . . . 0.0 113.203 -177.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 35.7 t -64.0 143.54 98.21 Favored Pre-proline 0 CA--C 1.554 1.112 0 C-N-CA 124.409 1.084 . . . . 0.0 111.607 177.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_exo -75.28 173.77 13.94 Favored 'Trans proline' 0 CA--C 1.54 0.802 0 C-N-CA 122.862 2.375 . . . . 0.0 115.591 -164.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 89.4 m-70 -63.89 152.66 39.17 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 124.082 0.953 . . . . 0.0 113.092 175.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 20.7 tt -71.36 -36.98 63.44 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.54 0 C-N-CA 125.025 1.33 . . . . 0.0 114.208 -174.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 74.6 mt 56.04 -74.9 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 C-N-CA 127.642 2.377 . . . . 0.0 112.708 -172.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 38.9 t -156.03 78.71 0.97 Allowed 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 128.28 2.632 . . . . 0.0 106.955 172.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 50.3 m 49.75 51.51 16.38 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 114.517 1.303 . . . . 0.0 114.517 -176.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 8.8 t80 61.51 42.94 10.73 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 127.065 2.146 . . . . 0.0 113.908 -177.73 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 90.0 m -102.54 172.63 6.75 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 125.122 1.369 . . . . 0.0 112.374 169.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 68.93 -171.64 38.33 Favored Glycine 0 CA--C 1.534 1.278 0 N-CA-C 116.829 1.491 . . . . 0.0 116.829 158.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -123.86 5.82 8.72 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 125.585 1.554 . . . . 0.0 112.684 174.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.303 5.0 t 53.88 154.71 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 126.716 2.006 . . . . 0.0 115.133 -150.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.1 t70 59.21 -52.58 0.06 Allowed 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 129.984 3.314 . . . . 0.0 115.085 -168.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -94.98 67.1 3.08 Favored 'General case' 0 CA--C 1.541 0.605 0 C-N-CA 127.231 2.212 . . . . 0.0 111.021 176.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 19.4 t-80 -147.85 138.66 23.25 Favored 'General case' 0 CA--C 1.538 0.496 0 C-N-CA 125.739 1.615 . . . . 0.0 110.646 177.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 38.5 t80 -150.75 157.42 42.92 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 124.928 1.291 . . . . 0.0 110.394 173.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . 0.442 ' HA ' ' SG ' ' A' ' 39' ' ' CYS . 72.2 p -60.18 -22.04 62.45 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 126.455 1.902 . . . . 0.0 115.031 -175.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 77.8 ttt180 -72.6 -25.93 61.51 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 124.932 1.293 . . . . 0.0 112.724 173.299 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 37.1 t-80 -112.95 -34.15 5.84 Favored 'General case' 0 CA--C 1.543 0.702 0 C-N-CA 124.959 1.303 . . . . 0.0 114.435 -169.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.442 ' SG ' ' HA ' ' A' ' 36' ' ' SER 0.335 64.6 m 36.07 -101.69 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.163 0 C-N-CA 128.354 2.662 . . . . 0.0 116.485 172.856 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -76.48 -17.33 16.47 Favored 'Trans proline' 0 C--N 1.353 0.806 0 C-N-CA 122.14 1.893 . . . . 0.0 115.124 -165.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 52.8 mtmt -71.44 -1.83 14.54 Favored 'General case' 0 N--CA 1.477 0.876 0 N-CA-C 115.337 1.606 . . . . 0.0 115.337 -162.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -77.54 -20.81 53.55 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 125.421 1.488 . . . . 0.0 114.659 175.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 18.1 mt -113.67 64.01 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.479 0.983 0 C-N-CA 125.476 1.51 . . . . 0.0 109.199 -169.656 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.5 pt20 -170.11 163.72 9.19 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 126.867 2.067 . . . . 0.0 111.041 179.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 81.3 m -131.5 173.41 11.13 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.644 1.577 . . . . 0.0 110.282 168.359 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 30.3 p -78.95 -42.52 26.66 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.009 1.724 . . . . 0.0 114.054 -178.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -87.44 -27.78 22.51 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 124.876 1.27 . . . . 0.0 112.493 -178.492 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 6.6 p -129.59 124.4 33.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 125.166 1.386 . . . . 0.0 110.995 173.138 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.6 p-10 -84.39 149.69 25.84 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.226 1.41 . . . . 0.0 114.107 -168.264 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 62.32 9.8 3.5 Favored 'General case' 0 N--CA 1.479 1.01 0 N-CA-C 116.994 2.22 . . . . 0.0 116.994 174.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 30.4 m -134.82 137.29 51.12 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.04 0 C-N-CA 124.851 1.26 . . . . 0.0 113.437 179.48 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -91.71 160.64 26.63 Favored Glycine 0 CA--C 1.536 1.399 0 C-N-CA 124.82 1.2 . . . . 0.0 112.474 170.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 24.7 m80 -75.08 81.05 2.25 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 -174.444 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 94.0 m-85 -136.31 160.3 39.14 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 127.48 2.312 . . . . 0.0 110.872 170.392 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.57 146.21 36.6 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-O 121.118 0.485 . . . . 0.0 110.256 169.129 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 21.2 m 61.67 -2.5 0.26 Allowed 'General case' 0 N--CA 1.479 1.017 0 N-CA-C 117.227 2.306 . . . . 0.0 117.227 -171.233 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -102.25 -53.51 2.9 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 124.383 1.073 . . . . 0.0 111.184 170.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 57.4 m -105.97 10.0 0.07 OUTLIER Pre-proline 0 CA--C 1.558 1.278 0 N-CA-C 119.507 3.151 . . . . 0.0 119.507 -178.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_exo -52.92 -22.56 18.6 Favored 'Trans proline' 0 CA--C 1.545 1.072 0 CA-C-N 124.66 2.7 . . . . 0.0 116.673 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 15.8 p-80 -79.45 -3.99 49.1 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 115.46 1.652 . . . . 0.0 115.46 179.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -46.73 -42.93 17.51 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 126.718 2.007 . . . . 0.0 114.448 -172.349 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER -74.92 -11.43 60.12 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 116.58 2.067 . . . . 0.0 116.58 -162.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 62.1 pttt -87.53 -11.26 49.33 Favored 'General case' 0 N--CA 1.477 0.899 0 N-CA-C 115.132 1.53 . . . . 0.0 115.132 -173.451 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 52.5 tptt -110.5 112.13 23.83 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 125.363 1.465 . . . . 0.0 110.842 -178.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 84.9 t -104.41 128.48 57.9 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 C-N-CA 125.501 1.52 . . . . 0.0 109.821 -179.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.2 tt0 -96.36 4.88 51.94 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 126.016 1.726 . . . . 0.0 113.13 -171.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 85.3 m -85.18 -16.21 41.1 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 115.146 1.536 . . . . 0.0 115.146 -171.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.256 7.1 t 56.8 -46.66 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 129.35 3.06 . . . . 0.0 117.809 -168.339 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 3.6 pp -85.07 -22.62 28.89 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.455 1.502 . . . . 0.0 113.186 -177.328 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 58.1 m -82.97 131.09 35.2 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.801 0.841 . . . . 0.0 110.799 174.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt -115.19 2.01 13.98 Favored 'General case' 0 N--CA 1.481 1.11 0 N-CA-C 114.923 1.453 . . . . 0.0 114.923 -169.088 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 83.8 p -78.94 169.68 17.84 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 125.441 1.496 . . . . 0.0 113.43 -179.065 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.8 mttm -95.71 8.96 41.98 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.497 1.519 . . . . 0.0 114.425 -177.499 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -127.05 -148.32 0.38 Allowed 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 127.077 2.151 . . . . 0.0 109.783 177.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 44.8 t60 58.01 -123.39 1.49 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 125.025 1.33 . . . . 0.0 113.292 172.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 1.3 t 59.32 -47.92 0.07 Allowed 'General case' 0 CA--C 1.544 0.742 0 C-N-CA 127.95 2.5 . . . . 0.0 115.936 -159.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 25.4 tptp 51.65 40.33 27.05 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 127.978 2.511 . . . . 0.0 113.86 171.038 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 57.08 61.31 2.62 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.958 1.303 . . . . 0.0 113.222 -171.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 61.0 56.08 2.91 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 127.192 2.197 . . . . 0.0 114.593 176.9 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 2.0 t 51.9 54.65 14.56 Favored Pre-proline 0 CA--C 1.556 1.193 0 C-N-CA 126.529 1.932 . . . . 0.0 115.816 164.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 85.3 Cg_endo -71.07 167.31 26.47 Favored 'Trans proline' 0 C--N 1.349 0.581 0 C-N-CA 123.604 2.869 . . . . 0.0 112.377 176.681 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 68.7 m -84.22 119.33 24.91 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.8 0.84 . . . . 0.0 111.26 171.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 20.6 tt -141.91 139.48 30.79 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 C-N-CA 128.091 2.556 . . . . 0.0 109.944 -6.226 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 54.5 t-105 -89.92 137.54 32.25 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.636 0.774 . . . . 0.0 111.936 -179.725 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 60.7 ttt85 -148.76 140.94 23.99 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 125.851 1.66 . . . . 0.0 111.018 178.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -135.24 158.25 44.83 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.723 1.609 . . . . 0.0 110.401 170.441 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 57.5 t80 -138.0 147.89 44.64 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 124.227 1.011 . . . . 0.0 112.798 -172.71 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 38.3 pt -136.2 144.6 32.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.556 0 C-N-CA 126.034 1.733 . . . . 0.0 111.45 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 49.7 tp -152.67 141.4 20.97 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.583 1.553 . . . . 0.0 110.321 176.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 26.0 t -134.43 141.65 42.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 C-N-CA 125.362 1.465 . . . . 0.0 110.159 -178.74 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -70.26 143.13 52.22 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.157 0.983 . . . . 0.0 112.761 178.824 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.3 t70 -75.82 -43.78 44.3 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.345 1.058 . . . . 0.0 113.819 -175.285 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.7 t30 61.09 6.66 1.32 Allowed 'General case' 0 CA--C 1.56 1.356 0 N-CA-C 118.008 2.596 . . . . 0.0 118.008 175.436 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -131.44 -23.22 2.39 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 115.512 1.671 . . . . 0.0 115.512 -176.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 85.7 mttt 66.12 149.53 0.05 OUTLIER 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 130.041 3.336 . . . . 0.0 115.634 -179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -88.82 156.65 18.82 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 124.413 1.085 . . . . 0.0 113.11 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.8 ptpp? -150.98 152.67 31.98 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 126.487 1.915 . . . . 0.0 111.83 -179.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -79.87 -15.06 12.14 Favored 'Trans proline' 0 CA--C 1.541 0.847 0 C-N-CA 123.35 2.7 . . . . 0.0 114.358 -176.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 53.4 mtpt 60.53 -5.52 0.1 Allowed 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 128.093 2.557 . . . . 0.0 116.688 -176.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 20.2 m -133.72 145.63 33.15 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.822 0 C-N-CA 127.045 2.138 . . . . 0.0 109.86 166.422 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 57.5 tp -147.6 99.78 3.81 Favored Pre-proline 0 CA--C 1.547 0.837 0 C-N-CA 123.815 0.846 . . . . 0.0 112.233 -173.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -65.74 148.06 86.34 Favored 'Trans proline' 0 CA--C 1.538 0.7 0 C-N-CA 123.495 2.797 . . . . 0.0 112.295 167.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 54.5 p90 -136.59 -15.12 1.63 Allowed 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 114.338 1.236 . . . . 0.0 114.338 177.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 4.1 m-70 -129.88 139.87 51.08 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 125.768 1.627 . . . . 0.0 109.39 168.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.0 p -126.33 -5.17 6.63 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.378 1.471 . . . . 0.0 114.285 -165.557 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.407 HG23 ' H ' ' A' ' 118' ' ' GLY . 19.5 tt -140.14 142.79 30.99 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 125.648 1.579 . . . . 0.0 110.783 178.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -123.51 115.58 21.78 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 125.161 1.384 . . . . 0.0 110.831 -166.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 25.1 p -96.44 67.41 2.47 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 113.382 0.882 . . . . 0.0 113.382 -166.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -40.26 -37.16 0.61 Allowed 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 127.984 2.514 . . . . 0.0 116.31 -177.249 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -92.81 -12.5 31.01 Favored 'General case' 0 CA--C 1.546 0.813 0 N-CA-C 115.484 1.661 . . . . 0.0 115.484 -166.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 12.1 p -131.28 179.33 6.09 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.331 1.052 . . . . 0.0 113.245 -177.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . -58.84 154.22 28.21 Favored Glycine 0 CA--C 1.538 1.523 0 C-N-CA 124.155 0.883 . . . . 0.0 114.054 -179.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 78.57 -36.15 1.82 Allowed Glycine 0 CA--C 1.537 1.459 0 C-N-CA 125.096 1.332 . . . . 0.0 114.701 -177.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 31.2 ttmt 45.88 48.56 12.07 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 127.571 2.348 . . . . 0.0 113.69 171.396 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 174.0 17.5 0.02 OUTLIER Glycine 0 CA--C 1.536 1.385 0 N-CA-C 116.149 1.22 . . . . 0.0 116.149 -174.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 5.5 p80 -141.13 144.31 34.78 Favored 'General case' 0 N--CA 1.47 0.575 0 CA-C-N 119.54 1.67 . . . . 0.0 113.106 -176.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 35.08 40.55 0.06 Allowed 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 128.202 2.601 . . . . 0.0 116.571 165.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . 0.407 ' H ' HG23 ' A' ' 106' ' ' ILE . . . -58.23 -19.9 41.23 Favored Glycine 0 CA--C 1.536 1.387 0 N-CA-C 116.225 1.25 . . . . 0.0 116.225 -165.04 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -78.63 -44.18 24.5 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 125.097 1.359 . . . . 0.0 113.438 173.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 35.3 t70 -103.43 -20.75 13.95 Favored 'General case' 0 CA--C 1.541 0.631 0 C-N-CA 125.898 1.679 . . . . 0.0 113.883 -165.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 15.9 p -74.38 -1.12 19.56 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 124.742 1.217 . . . . 0.0 114.243 178.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 65.3 mttm -68.45 155.07 40.6 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.451 1.5 . . . . 0.0 111.79 174.704 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -107.16 151.06 25.9 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.354 1.062 . . . . 0.0 112.4 178.453 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt . . . . . 0 C--O 1.253 1.276 0 C-N-CA 125.389 1.476 . . . . 0.0 112.362 176.166 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 88.3 tttt . . . . . 0 N--CA 1.486 1.336 0 N-CA-C 110.225 -0.287 . . . . 0.0 110.225 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.1 mp0 -103.04 -23.58 13.68 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.025 0.93 . . . . 0.0 113.466 -170.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.01 45.22 0.99 Allowed 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.98 1.312 . . . . 0.0 112.993 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -47.8 -47.24 62.76 Favored Pre-proline 0 CA--C 1.554 1.123 0 C-N-CA 124.436 1.094 . . . . 0.0 113.553 164.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -77.88 -31.44 3.13 Favored 'Trans proline' 0 C--N 1.355 0.869 0 C-N-CA 122.667 2.245 . . . . 0.0 114.033 176.726 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.5 tmtp? 59.83 -65.99 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 128.278 2.631 . . . . 0.0 114.488 -169.029 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 8.4 t -160.68 170.15 21.39 Favored 'General case' 0 CA--C 1.546 0.819 0 C-N-CA 128.078 2.551 . . . . 0.0 110.746 179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -73.82 -31.98 63.5 Favored 'General case' 0 CA--C 1.546 0.794 0 O-C-N 120.808 -1.183 . . . . 0.0 114.15 -179.265 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.0 t30 -157.58 -58.72 0.08 Allowed 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.768 1.227 . . . . 0.0 112.201 -177.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 21.1 p -77.3 130.7 37.53 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.468 0.707 . . . . 0.0 111.657 178.156 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 8.4 m -81.15 42.37 0.65 Allowed 'General case' 0 N--CA 1.481 1.094 0 N-CA-C 115.632 1.716 . . . . 0.0 115.632 -165.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 81.8 mt-30 -95.22 150.89 19.73 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 125.954 1.702 . . . . 0.0 111.45 176.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.7 ptm85 -76.01 171.56 14.24 Favored 'General case' 0 N--CA 1.475 0.824 0 C-N-CA 124.805 1.242 . . . . 0.0 113.871 -176.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 84.8 -78.72 1.98 Allowed Glycine 0 CA--C 1.529 0.914 0 C-N-CA 124.839 1.209 . . . . 0.0 112.692 175.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -79.93 85.9 5.51 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.539 0.94 . . . . 0.0 113.539 -175.592 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.5 pp -54.69 176.71 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 126.047 1.739 . . . . 0.0 113.669 168.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -35.58 -66.19 0.21 Allowed 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 126.945 2.098 . . . . 0.0 114.444 -174.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 24.4 pttm -78.07 -5.46 51.56 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 115.415 1.635 . . . . 0.0 115.415 -179.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -89.94 -37.4 14.4 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 125.127 1.371 . . . . 0.0 111.939 175.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 11.8 t -56.13 -47.58 98.55 Favored Pre-proline 0 CA--C 1.549 0.914 0 N-CA-C 116.063 1.875 . . . . 0.0 116.063 -175.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -73.89 5.41 3.47 Favored 'Trans proline' 0 C--N 1.354 0.859 0 C-N-CA 122.294 1.996 . . . . 0.0 115.473 -164.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 24.0 t-80 -60.41 -26.78 66.95 Favored 'General case' 0 CA--C 1.548 0.878 0 O-C-N 120.851 -1.156 . . . . 0.0 113.556 174.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.6 pp -115.32 13.2 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 N-CA-C 115.024 1.49 . . . . 0.0 115.024 -175.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -130.88 148.13 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 125.204 1.402 . . . . 0.0 110.757 172.55 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 84.8 m -68.54 158.58 33.59 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.64 -0.662 . . . . 0.0 112.033 163.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.8 m -67.19 105.29 1.67 Allowed 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.26 1.024 . . . . 0.0 112.492 177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 9.5 t80 61.15 5.2 1.0 Allowed 'General case' 0 CA--C 1.55 0.963 0 N-CA-C 117.999 2.592 . . . . 0.0 117.999 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 20.3 p -106.1 1.14 26.06 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -150.41 154.35 25.59 Favored Glycine 0 CA--C 1.532 1.098 0 C-N-CA 124.43 1.014 . . . . 0.0 114.937 -176.024 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -113.44 20.44 16.07 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 125.887 1.675 . . . . 0.0 113.896 -174.601 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . 0.277 2.8 t 60.44 -29.46 0.05 Allowed 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 129.608 3.163 . . . . 0.0 118.036 174.327 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -85.22 -24.81 27.69 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 125.506 1.522 . . . . 0.0 113.796 -179.599 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.0 t70 -132.39 5.67 4.08 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 124.954 1.302 . . . . 0.0 114.049 -174.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 50.4 t60 -89.86 148.5 23.13 Favored 'General case' 0 CA--C 1.54 0.564 0 O-C-N 121.139 -0.975 . . . . 0.0 113.383 -171.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 9.1 t80 -147.46 132.51 18.24 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 124.117 0.967 . . . . 0.0 111.725 170.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 4.9 m -58.7 -26.04 63.49 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 126.161 1.784 . . . . 0.0 114.677 -173.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.9 tpp180 -70.7 -21.32 62.58 Favored 'General case' 0 N--CA 1.471 0.586 0 C-N-CA 125.068 1.347 . . . . 0.0 113.744 179.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 73.5 m-70 -125.14 -19.8 5.05 Favored 'General case' 0 CA--C 1.543 0.697 0 C-N-CA 124.809 1.244 . . . . 0.0 114.313 -177.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . 0.383 63.3 m 47.77 -106.92 0.0 OUTLIER Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 127.822 2.449 . . . . 0.0 115.602 179.31 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -62.33 102.41 0.27 Allowed 'Trans proline' 0 C--N 1.356 0.962 0 CA-C-N 123.503 2.287 . . . . 0.0 113.771 -164.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 55.2 tttm -135.67 -15.37 1.84 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 126.662 1.985 . . . . 0.0 113.181 -179.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -133.52 177.52 7.64 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 125.891 1.676 . . . . 0.0 111.409 -178.077 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 76.6 mt 65.1 -76.25 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 127.219 2.208 . . . . 0.0 111.687 179.498 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -59.54 162.82 4.63 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.643 0.777 . . . . 0.0 112.519 162.774 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 7.8 t -109.08 123.9 49.9 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.332 1.053 . . . . 0.0 109.284 163.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 27.8 m 41.91 37.55 0.83 Allowed 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 116.807 2.151 . . . . 0.0 116.807 165.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 54.2 mtpt 55.08 26.17 7.88 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 127.95 2.5 . . . . 0.0 115.221 -175.452 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 20.7 p -81.32 -61.73 1.86 Allowed 'General case' 0 CA--C 1.545 0.751 0 CA-C-N 119.154 0.888 . . . . 0.0 111.687 170.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.5 m-20 -153.68 168.79 25.08 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 126.301 1.84 . . . . 0.0 111.329 172.631 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 14.7 pt-20 -56.61 4.65 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 130.89 3.676 . . . . 0.0 117.337 -175.554 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 1.5 m -164.82 -30.7 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.476 0.859 1 C-N-CA 132.04 4.136 . . . . 0.0 108.807 179.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . 100.49 -157.95 19.37 Favored Glycine 0 CA--C 1.533 1.157 0 C-N-CA 127.181 2.324 . . . . 0.0 113.526 176.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 6.3 p80 -75.44 64.24 1.56 Allowed 'General case' 0 CA--C 1.546 0.806 0 C-N-CA 126.781 2.033 . . . . 0.0 112.609 179.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 18.6 t80 49.15 -128.53 2.05 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 128.96 2.904 . . . . 0.0 112.851 178.944 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 75.9 mtt85 52.47 43.63 30.8 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.854 1.661 . . . . 0.0 113.06 169.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 50.5 m 52.03 63.44 2.24 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 125.916 1.686 . . . . 0.0 113.836 -178.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 70.1 mt-30 58.5 41.38 22.7 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 125.796 1.639 . . . . 0.0 113.172 -174.146 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 79.2 m 63.82 151.89 0.11 Allowed Pre-proline 0 CA--C 1.551 0.998 0 C-N-CA 129.202 3.001 . . . . 0.0 116.533 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -71.22 156.89 58.5 Favored 'Trans proline' 0 CA--C 1.541 0.838 0 C-N-CA 123.159 2.573 . . . . 0.0 112.83 176.352 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 32.7 p80 -76.01 -13.55 60.23 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.313 1.227 . . . . 0.0 114.313 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -126.08 126.77 44.74 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 126.62 1.968 . . . . 0.0 109.146 171.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 50.2 t-105 -152.68 170.15 20.96 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 113.521 0.934 . . . . 0.0 113.521 -174.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.9 tppp? -68.41 150.2 48.42 Favored 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 126.873 2.069 . . . . 0.0 112.126 177.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -63.81 165.9 7.95 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 125.652 1.581 . . . . 0.0 111.793 170.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m -55.25 157.44 0.86 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.047 0 O-C-N 121.677 -0.639 . . . . 0.0 111.539 164.405 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -63.98 -21.43 66.49 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -171.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 24.9 m -87.18 134.59 33.51 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.155 0.982 . . . . 0.0 111.697 174.104 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 10.2 t -63.31 -31.06 72.11 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 173.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.537 HD23 ' H ' ' A' ' 69' ' ' LEU . 2.6 pt? -104.55 18.78 21.56 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.889 1.676 . . . . 0.0 115.24 -172.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 61.9 m -127.98 158.96 36.44 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 125.132 1.373 . . . . 0.0 111.25 176.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 23.4 tptm -151.23 112.82 4.42 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 124.436 1.094 . . . . 0.0 110.899 169.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 14.3 m 57.24 12.22 1.3 Allowed 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 118.028 2.603 . . . . 0.0 118.028 168.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 64.1 mttp -141.89 152.59 43.72 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 126.496 1.918 . . . . 0.0 110.754 -179.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 49.8 tptt -84.29 157.56 21.5 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 124.244 1.018 . . . . 0.0 112.2 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 33.8 p80 -135.81 178.78 6.78 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 127.095 2.158 . . . . 0.0 111.028 -172.177 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 36.2 t -114.7 166.33 11.86 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.779 1.232 . . . . 0.0 112.841 173.451 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -61.66 -17.88 57.25 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 127.732 2.413 . . . . 0.0 114.159 176.823 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -67.99 -25.77 65.58 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.193 0.812 . . . . 0.0 113.193 169.047 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 59.8 ttt85 -92.72 -57.83 2.54 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 125.762 1.625 . . . . 0.0 110.873 172.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 24.2 p -160.41 154.41 19.48 Favored Pre-proline 0 CA--C 1.549 0.932 0 C-N-CA 124.986 1.315 . . . . 0.0 112.136 169.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 71.2 Cg_exo -59.25 150.87 71.48 Favored 'Trans proline' 0 C--N 1.351 0.678 0 C-N-CA 123.55 2.833 . . . . 0.0 116.175 -165.409 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 4.7 t -151.01 159.82 44.32 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 125.578 1.551 . . . . 0.0 110.788 175.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 1.9 pp -69.44 162.91 3.63 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.978 0 C-N-CA 123.941 0.896 . . . . 0.0 113.368 -178.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 35.1 p90 -133.78 161.01 35.87 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 125.487 1.515 . . . . 0.0 112.623 -173.709 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 39.3 mmm-85 -132.24 9.61 4.44 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 126.122 1.769 . . . . 0.0 114.365 175.544 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . 58.72 14.65 3.29 Favored 'General case' 0 CA--C 1.551 1.007 0 N-CA-C 115.291 1.589 . . . . 0.0 115.291 -174.666 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 4.3 t80 -86.0 14.32 6.34 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 125.733 1.613 . . . . 0.0 113.999 -173.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 47.6 mt 64.17 105.91 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 C-N-CA 128.553 2.741 . . . . 0.0 113.353 -178.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -82.79 158.0 22.98 Favored 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 124.861 1.264 . . . . 0.0 111.71 171.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 25.1 m -93.68 150.18 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 C-N-CA 124.649 1.18 . . . . 0.0 112.558 177.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 20.2 m-20 -119.29 -1.87 10.73 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.275 1.43 . . . . 0.0 113.188 175.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 21.0 m-20 -83.35 141.9 31.44 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.554 1.142 . . . . 0.0 112.217 179.388 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.3 p30 -85.76 -14.97 43.61 Favored 'General case' 0 CA--C 1.545 0.75 0 N-CA-C 114.082 1.141 . . . . 0.0 114.082 179.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -83.45 55.53 3.22 Favored 'General case' 0 CA--C 1.546 0.815 0 C-N-CA 125.046 1.338 . . . . 0.0 112.467 -178.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 65.2 pttt -66.47 155.25 38.08 Favored 'General case' 0 N--CA 1.471 0.588 0 C-N-CA 125.693 1.597 . . . . 0.0 113.441 -179.134 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -140.05 164.27 30.49 Favored 'General case' 0 CA--C 1.545 0.779 0 C-N-CA 125.634 1.574 . . . . 0.0 111.739 178.317 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -67.57 158.48 82.47 Favored Pre-proline 0 N--CA 1.476 0.869 0 C-N-CA 124.36 1.064 . . . . 0.0 112.199 178.664 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -64.77 -16.03 53.27 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 123.367 2.712 . . . . 0.0 116.659 -174.529 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . 0.302 21.8 ptmt 52.72 -1.81 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 129.479 3.112 . . . . 0.0 118.679 179.533 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 70.0 t -83.32 132.19 31.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 124.979 1.312 . . . . 0.0 109.709 168.804 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.562 ' H ' ' HD2' ' A' ' 102' ' ' PRO . 3.2 tm? -124.06 -46.83 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.887 0 C-N-CA 125.37 1.468 . . . . 0.0 114.364 -177.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . 0.562 ' HD2' ' H ' ' A' ' 101' ' ' LEU . 85.6 Cg_endo -73.45 158.77 47.58 Favored 'Trans proline' 0 C--N 1.355 0.906 0 CA-C-N 122.097 1.785 . . . . 0.0 113.347 -175.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -130.06 163.22 27.01 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 125.671 1.588 . . . . 0.0 112.758 -175.422 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 33.4 p80 -125.95 21.17 7.57 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 125.889 1.676 . . . . 0.0 113.4 176.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 23.2 p -86.83 -5.67 59.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 126.408 1.883 . . . . 0.0 114.367 -171.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.0 tt -78.82 132.65 31.77 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.602 0 C-N-CA 124.142 0.977 . . . . 0.0 111.152 174.277 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 73.9 m-85 -141.36 169.49 17.51 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 125.196 1.398 . . . . 0.0 112.631 -176.866 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 17.6 t -71.92 158.29 36.3 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 124.35 1.06 . . . . 0.0 113.098 176.82 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 90.5 m-85 -136.52 24.32 3.17 Favored 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.802 1.641 . . . . 0.0 112.488 172.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 24.6 m120 -139.3 167.61 21.69 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 126.22 1.808 . . . . 0.0 111.725 -171.485 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . 0.285 18.6 p 47.25 23.65 0.35 Allowed 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 127.999 2.52 . . . . 0.0 117.341 173.409 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 142.54 -31.64 2.01 Favored Glycine 0 CA--C 1.537 1.409 0 C-N-CA 125.707 1.622 . . . . 0.0 114.283 178.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 138.24 -161.33 25.61 Favored Glycine 0 CA--C 1.536 1.379 0 C-N-CA 124.977 1.275 . . . . 0.0 114.719 176.74 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -77.39 -176.74 4.32 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 126.222 1.809 . . . . 0.0 114.377 -176.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 83.14 -53.53 4.87 Favored Glycine 0 CA--C 1.533 1.173 0 C-N-CA 125.153 1.358 . . . . 0.0 114.742 173.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 2.3 p80 -77.69 142.28 38.88 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 114.415 1.265 . . . . 0.0 114.415 -169.099 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 11.4 m-85 40.79 22.57 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 129.767 3.227 . . . . 0.0 117.877 167.084 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -58.25 -23.31 52.76 Favored Glycine 0 CA--C 1.536 1.353 0 N-CA-C 116.123 1.209 . . . . 0.0 116.123 -161.691 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -61.18 -44.6 97.05 Favored 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 125.054 1.342 . . . . 0.0 112.963 173.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -105.76 -30.73 9.24 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 126.259 1.824 . . . . 0.0 113.031 -175.537 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 53.6 t -70.09 116.18 10.16 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 124.728 1.211 . . . . 0.0 110.445 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -145.39 158.88 43.75 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 127.399 2.28 . . . . 0.0 110.486 -176.187 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 20.7 mm-40 -76.0 130.14 37.96 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 122.706 0.402 . . . . 0.0 111.533 176.002 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.431 ' HA ' ' HE2' ' A' ' 124' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.254 1.328 0 C-N-CA 126.259 1.823 . . . . 0.0 111.766 -177.617 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 63.9 pttt . . . . . 0 N--CA 1.487 1.393 0 CA-C-O 120.492 0.186 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.5 mp0 -112.78 -6.72 13.83 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.466 1.284 . . . . 0.0 114.466 -161.927 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -152.16 149.39 28.71 Favored 'General case' 0 CA--C 1.542 0.657 0 C-N-CA 124.224 1.01 . . . . 0.0 113.202 -178.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -79.29 -55.63 0.88 Allowed Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.304 1.041 . . . . 0.0 112.421 162.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.16 -37.03 3.68 Favored 'Trans proline' 0 C--N 1.355 0.911 0 C-N-CA 122.949 2.432 . . . . 0.0 113.927 178.804 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.336 0.0 OUTLIER 53.12 -31.52 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 131.51 3.924 . . . . 0.0 118.271 -171.235 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 1.8 t -156.58 -179.79 8.53 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 126.488 1.915 . . . . 0.0 111.522 173.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 56.9 t30 -101.47 146.41 27.67 Favored 'General case' 0 CA--C 1.545 0.783 0 O-C-N 121.692 -0.63 . . . . 0.0 109.33 144.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 49.4 t30 59.45 -69.88 0.03 OUTLIER 'General case' 0 CA--C 1.557 1.214 0 N-CA-C 117.814 2.524 . . . . 0.0 117.814 165.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 10.1 p -86.13 -15.35 41.38 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.611 1.565 . . . . 0.0 115.167 -170.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 43.7 m 55.92 30.73 16.53 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 117.971 2.582 . . . . 0.0 117.971 160.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 23.1 pt20 -142.62 19.79 2.02 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 114.69 1.367 . . . . 0.0 114.69 175.312 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 38.5 ttm180 -144.59 143.08 30.61 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 125.166 1.386 . . . . 0.0 111.202 -177.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -66.98 -12.98 61.02 Favored Glycine 0 N--CA 1.475 1.244 0 N-CA-C 116.826 1.49 . . . . 0.0 116.826 -162.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -68.97 93.38 0.56 Allowed 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 118.576 1.188 . . . . 0.0 112.37 171.163 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -53.49 175.62 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.987 1.715 . . . . 0.0 113.595 172.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.37 -62.01 0.94 Allowed 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 124.943 1.297 . . . . 0.0 114.061 -165.463 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.2 ptpt -79.48 -9.18 59.56 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 179.162 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -84.56 -31.55 24.31 Favored 'General case' 0 CA--C 1.544 0.723 0 C-N-CA 125.075 1.35 . . . . 0.0 111.974 173.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 34.4 t -64.64 136.81 96.92 Favored Pre-proline 0 CA--C 1.55 0.951 0 C-N-CA 125.843 1.657 . . . . 0.0 111.073 -178.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 55.6 Cg_endo -67.69 158.46 57.11 Favored 'Trans proline' 0 CA--C 1.537 0.667 0 C-N-CA 123.797 2.998 . . . . 0.0 114.713 -170.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -132.58 170.27 15.43 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 126.754 2.021 . . . . 0.0 109.703 169.38 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 1.9 pp -62.13 150.56 8.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.724 0 N-CA-C 113.453 0.908 . . . . 0.0 113.453 -175.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 31.0 mt -125.14 137.15 58.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 C-N-CA 124.652 1.181 . . . . 0.0 111.027 -167.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 32.8 t -61.35 109.37 1.13 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.17 1.388 . . . . 0.0 111.708 170.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 67.6 m 47.38 16.97 0.07 Allowed 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 127.722 2.409 . . . . 0.0 116.724 178.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 1.1 t80 48.45 34.18 4.58 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.98 1.312 . . . . 0.0 113.347 -168.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 19.7 p -96.93 -22.77 16.67 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 114.174 1.176 . . . . 0.0 114.174 -175.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -164.61 157.69 30.16 Favored Glycine 0 CA--C 1.532 1.144 0 C-N-CA 124.851 1.215 . . . . 0.0 112.151 177.553 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.56 121.89 14.97 Favored 'General case' 0 CA--C 1.539 0.535 0 CA-C-N 118.318 1.059 . . . . 0.0 112.631 -176.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 14.5 t -59.13 -26.89 65.11 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 114.769 1.396 . . . . 0.0 114.769 -172.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -75.27 -22.16 57.99 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 114.085 1.142 . . . . 0.0 114.085 -178.42 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 28.3 t70 -141.41 -18.25 0.79 Allowed 'General case' 0 N--CA 1.477 0.891 0 N-CA-C 115.938 1.829 . . . . 0.0 115.938 -168.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.25 149.92 45.74 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 120.077 1.308 . . . . 0.0 112.85 -179.066 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 52.7 t80 -147.08 167.74 23.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.589 1.556 . . . . 0.0 110.029 176.148 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 32.7 t -38.81 -45.64 1.17 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 126.986 2.115 . . . . 0.0 115.899 -172.62 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 12.3 ptp85 -73.59 -15.89 61.26 Favored 'General case' 0 N--CA 1.477 0.901 0 N-CA-C 115.819 1.785 . . . . 0.0 115.819 -177.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 7.7 t-80 -127.38 0.55 6.32 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 126.104 1.762 . . . . 0.0 113.539 179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 1.8 t -40.3 -50.99 6.41 Favored Pre-proline 0 CA--C 1.549 0.907 0 C-N-CA 128.005 2.522 . . . . 0.0 115.81 -172.572 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 98.3 Cg_endo -79.33 -2.83 12.61 Favored 'Trans proline' 0 CA--C 1.548 1.192 0 C-N-CA 123.192 2.595 . . . . 0.0 116.483 -176.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 28.1 tttm -128.83 11.29 6.1 Favored 'General case' 0 N--CA 1.482 1.127 0 N-CA-C 115.724 1.75 . . . . 0.0 115.724 -162.008 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -94.27 24.14 4.63 Favored 'General case' 0 CA--C 1.552 1.046 0 N-CA-C 115.743 1.757 . . . . 0.0 115.743 -168.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 42.2 mt -128.77 62.96 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.298 0 C-N-CA 126.578 1.951 . . . . 0.0 108.742 -179.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -145.4 150.26 36.22 Favored 'General case' 0 N--CA 1.477 0.889 0 O-C-N 120.265 -1.522 . . . . 0.0 113.99 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 74.1 m -76.25 168.0 20.84 Favored 'General case' 0 CA--C 1.543 0.704 0 C-N-CA 124.258 1.023 . . . . 0.0 112.042 174.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 21.2 m -85.1 -18.95 32.69 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 114.715 1.376 . . . . 0.0 114.715 -177.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 8.2 tppt? -127.95 -9.01 5.46 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.043 1.337 . . . . 0.0 114.37 -175.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 27.9 p -145.55 167.33 23.28 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.033 1.333 . . . . 0.0 111.776 174.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -76.89 132.19 38.98 Favored 'General case' 0 CA--C 1.542 0.654 0 O-C-N 121.43 -0.794 . . . . 0.0 112.566 -176.533 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.0 mt-10 62.63 141.85 0.02 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 127.836 2.454 . . . . 0.0 116.186 179.481 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.2 m -80.33 -21.41 11.61 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.354 0 O-C-N 120.451 -1.405 . . . . 0.0 110.797 157.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -64.92 -6.48 24.85 Favored Glycine 0 CA--C 1.537 1.448 0 C-N-CA 125.949 1.738 . . . . 0.0 116.399 -171.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . 0.263 0.7 OUTLIER -87.64 -132.49 0.07 Allowed 'General case' 0 CA--C 1.548 0.877 0 CA-C-N 118.746 1.273 . . . . 0.0 113.122 172.453 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.8 p90 -61.6 126.42 27.29 Favored 'General case' 0 CA--C 1.541 0.6 0 N-CA-C 115.367 1.617 . . . . 0.0 115.367 -157.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 45.85 30.84 0.93 Allowed 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 127.647 2.379 . . . . 0.0 113.761 -175.086 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 83.1 p 49.8 -4.8 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 130.805 3.642 . . . . 0.0 119.061 -179.309 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 25.2 mm-40 -147.34 8.55 0.92 Allowed 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 126.696 1.998 . . . . 0.0 112.982 176.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 11.8 m 58.92 27.74 0.05 OUTLIER Pre-proline 0 CA--C 1.563 1.48 0 N-CA-C 117.306 2.335 . . . . 0.0 117.306 -170.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -68.1 121.48 8.49 Favored 'Trans proline' 0 C--N 1.358 1.056 0 CA-C-N 122.922 2.079 . . . . 0.0 112.706 -178.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 62.0 m80 58.71 167.4 0.05 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 126.929 2.092 . . . . 0.0 115.122 -177.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 66.9 mttm -71.55 -43.14 66.91 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 120.925 -1.109 . . . . 0.0 111.837 174.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -155.53 135.86 13.15 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 126.17 1.788 . . . . 0.0 110.024 175.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 70.5 tttt -152.39 41.59 0.63 Allowed 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 124.426 1.091 . . . . 0.0 112.864 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 94.6 mttt -89.19 173.13 8.59 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 125.03 1.332 . . . . 0.0 112.641 -179.971 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 7.5 p -114.27 150.78 16.17 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 126.64 1.976 . . . . 0.0 109.357 165.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 27.7 mp0 -70.26 -12.66 61.74 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 125.412 1.485 . . . . 0.0 113.238 -175.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.3 m -111.8 166.83 10.85 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.22 1.408 . . . . 0.0 112.131 -179.33 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 57.1 p -116.09 -3.43 12.07 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 125.894 1.677 . . . . 0.0 112.882 -158.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.6 pp -132.15 -3.42 3.52 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 127.063 2.145 . . . . 0.0 113.252 174.575 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 67.3 m -86.7 157.15 19.71 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 124.575 1.15 . . . . 0.0 112.191 -177.321 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 20.2 tptt -133.99 7.23 3.71 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 114.858 1.429 . . . . 0.0 114.858 -178.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 30.7 t -149.27 154.4 38.98 Favored 'General case' 0 N--CA 1.466 0.372 0 C-N-CA 124.676 1.19 . . . . 0.0 112.138 175.675 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 32.1 mmtp -83.3 -28.05 29.37 Favored 'General case' 0 N--CA 1.472 0.627 0 C-N-CA 125.283 1.433 . . . . 0.0 114.454 -174.113 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -88.82 70.22 8.67 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 124.517 1.127 . . . . 0.0 111.942 -175.58 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 19.9 p-80 -139.55 175.56 9.46 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 125.083 1.353 . . . . 0.0 112.322 177.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 35.9 t -133.49 165.34 25.1 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.691 1.597 . . . . 0.0 111.336 174.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -58.56 -32.61 69.07 Favored 'General case' 0 N--CA 1.475 0.783 0 C-N-CA 125.204 1.402 . . . . 0.0 112.981 175.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.7 tp10 -74.47 -23.06 58.83 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.646 1.178 . . . . 0.0 112.985 173.015 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 30.3 ttm180 -103.85 -12.24 17.03 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 126.388 1.875 . . . . 0.0 114.059 -173.798 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 46.3 m -46.77 131.66 8.5 Favored Pre-proline 0 CA--C 1.55 0.961 0 C-N-CA 125.346 1.458 . . . . 0.0 111.55 176.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_exo -58.93 -29.78 91.38 Favored 'Trans proline' 0 CA--C 1.542 0.906 0 C-N-CA 122.713 2.275 . . . . 0.0 117.433 -163.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 64.5 m -114.7 19.28 16.11 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 125.071 1.348 . . . . 0.0 114.295 -177.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.8 tp -65.61 142.42 16.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 O-C-N 120.718 -1.239 . . . . 0.0 112.229 -177.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 57.6 t-105 -71.26 139.78 50.13 Favored 'General case' 0 CA--C 1.54 0.559 0 C-N-CA 123.58 0.752 . . . . 0.0 112.813 179.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 8.8 ptp180 -151.57 145.89 25.45 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 126.432 1.893 . . . . 0.0 111.305 166.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -83.94 157.48 21.9 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 87.1 m-85 -137.91 149.14 45.96 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 126.073 1.749 . . . . 0.0 111.927 179.384 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 20.7 tt -78.97 -38.36 20.62 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 123.509 0.724 . . . . 0.0 111.621 165.033 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 11.0 tp 52.41 27.59 5.06 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 127.21 2.204 . . . . 0.0 115.238 175.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 90.3 t -135.4 139.44 46.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 C-N-CA 126.476 1.911 . . . . 0.0 108.751 175.251 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 3.6 p30 -143.45 165.05 28.61 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.744 1.218 . . . . 0.0 113.605 -172.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -106.21 13.07 29.37 Favored 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 127.06 2.144 . . . . 0.0 114.418 -175.712 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 77.2 m-20 -75.93 172.8 12.1 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 124.314 1.046 . . . . 0.0 111.844 176.531 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -61.84 122.74 16.17 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 121.349 -0.845 . . . . 0.0 111.286 176.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -146.33 147.77 31.69 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 126.19 1.796 . . . . 0.0 111.567 -173.708 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . 53.98 -176.66 0.03 OUTLIER 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 125.397 1.479 . . . . 0.0 113.773 -165.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -148.15 161.8 33.04 Favored Pre-proline 0 N--CA 1.476 0.838 0 C-N-CA 125.354 1.461 . . . . 0.0 112.436 174.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -62.37 -172.66 0.12 Allowed 'Trans proline' 0 CA--C 1.544 0.981 0 C-N-CA 124.296 3.331 . . . . 0.0 113.819 168.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 37.1 tttp -66.8 9.73 0.17 Allowed 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 126.84 2.056 . . . . 0.0 115.278 -179.357 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 21.9 t 65.12 121.33 0.02 OUTLIER 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 128.891 2.877 . . . . 0.0 113.489 -176.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 1.8 pt? -72.05 151.75 92.71 Favored Pre-proline 0 CA--C 1.548 0.896 0 C-N-CA 124.003 0.921 . . . . 0.0 112.623 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 33.6 Cg_exo -64.9 128.42 20.77 Favored 'Trans proline' 0 CA--C 1.538 0.713 0 C-N-CA 122.401 2.068 . . . . 0.0 113.025 178.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -86.85 -29.74 21.98 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 124.071 0.948 . . . . 0.0 112.26 169.696 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 42.1 m80 -140.15 161.42 37.68 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 126.458 1.903 . . . . 0.0 110.211 177.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 36.7 p -126.12 144.25 50.81 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.19 1.396 . . . . 0.0 111.349 179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.3 pp -87.6 159.18 3.06 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 123.905 0.882 . . . . 0.0 112.532 179.084 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -77.97 158.94 29.1 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 124.557 1.143 . . . . 0.0 113.015 -174.027 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 31.9 t -145.22 140.48 27.91 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.794 0.838 . . . . 0.0 112.058 171.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 51.2 m-85 -138.54 -10.11 1.41 Allowed 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 -176.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 52.4 p-10 -90.11 -44.82 9.54 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -161.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 30.8 p -119.06 5.11 11.32 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 126.266 1.826 . . . . 0.0 113.558 177.44 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 170.8 -172.28 44.18 Favored Glycine 0 CA--C 1.533 1.168 0 C-N-CA 126.428 1.966 . . . . 0.0 111.44 -178.719 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -75.92 177.3 50.24 Favored Glycine 0 CA--C 1.536 1.391 0 C-N-CA 123.545 0.593 . . . . 0.0 113.341 170.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -54.27 140.19 33.81 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.378 1.471 . . . . 0.0 111.908 173.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 156.83 -9.34 0.25 Allowed Glycine 0 CA--C 1.535 1.32 0 N-CA-C 117.776 1.87 . . . . 0.0 117.776 175.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -137.49 -167.26 2.09 Favored 'General case' 0 N--CA 1.475 0.807 0 CA-C-N 119.955 1.877 . . . . 0.0 112.942 178.102 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 89.6 m-85 -69.42 45.39 0.06 Allowed 'General case' 0 CA--C 1.547 0.831 0 C-N-CA 126.313 1.845 . . . . 0.0 113.236 173.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -53.46 -21.14 12.64 Favored Glycine 0 CA--C 1.536 1.37 0 C-N-CA 128.188 2.804 . . . . 0.0 115.573 -176.92 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.8 t70 -75.57 -44.56 42.6 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 118.304 1.052 . . . . 0.0 112.825 171.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 33.9 t70 -88.3 -11.42 46.5 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 125.511 1.524 . . . . 0.0 113.167 -177.431 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 2.1 p -69.18 1.07 3.97 Favored 'General case' 0 CA--C 1.548 0.892 0 N-CA-C 115.317 1.599 . . . . 0.0 115.317 -176.308 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -54.13 140.04 33.4 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 125.225 1.41 . . . . 0.0 111.952 175.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -91.75 164.45 13.7 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 124.28 1.032 . . . . 0.0 113.382 -175.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 62.4 tttp . . . . . 0 C--O 1.253 1.245 0 C-N-CA 126.626 1.971 . . . . 0.0 111.215 175.969 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 35.9 mtmm . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.583 0.23 . . . . 0.0 110.99 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -110.8 -2.38 16.19 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 126.849 2.06 . . . . 0.0 113.891 174.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -143.52 126.53 16.36 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.263 1.025 . . . . 0.0 113.123 178.459 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -84.16 -49.18 0.66 Allowed Pre-proline 0 CA--C 1.552 1.035 0 C-N-CA 125.092 1.357 . . . . 0.0 113.19 159.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -76.2 -29.83 6.06 Favored 'Trans proline' 0 C--N 1.357 0.983 0 C-N-CA 122.796 2.331 . . . . 0.0 114.857 -175.429 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 3.6 tmtm? 62.33 -63.45 0.1 Allowed 'General case' 0 N--CA 1.483 1.195 0 C-N-CA 127.968 2.507 . . . . 0.0 114.647 -172.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 11.4 t -156.82 172.3 18.88 Favored 'General case' 0 CA--C 1.547 0.859 0 C-N-CA 127.758 2.423 . . . . 0.0 111.245 -179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 20.6 p-10 -73.51 -39.62 64.68 Favored 'General case' 0 CA--C 1.547 0.843 0 O-C-N 121.13 -0.981 . . . . 0.0 113.417 175.183 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 48.3 t30 -155.97 -58.34 0.1 Allowed 'General case' 0 CA--C 1.545 0.777 0 C-N-CA 124.9 1.28 . . . . 0.0 113.105 -171.571 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 31.9 p -79.01 -9.74 59.62 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 115.34 1.608 . . . . 0.0 115.34 -169.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 1.4 t 46.62 51.76 11.77 Favored 'General case' 0 N--CA 1.471 0.604 0 N-CA-C 117.346 2.35 . . . . 0.0 117.346 159.829 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.9 pt20 -143.84 6.12 1.38 Allowed 'General case' 0 N--CA 1.475 0.804 0 N-CA-C 115.243 1.571 . . . . 0.0 115.243 -175.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 57.4 ttt85 -150.41 157.52 43.13 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 126.295 1.838 . . . . 0.0 110.273 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . -65.14 -9.52 42.1 Favored Glycine 0 CA--C 1.535 1.288 0 N-CA-C 116.267 1.267 . . . . 0.0 116.267 -174.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 0.6 OUTLIER -72.97 94.49 1.87 Allowed 'General case' 0 CA--C 1.545 0.772 0 CA-C-N 118.962 1.381 . . . . 0.0 113.098 175.514 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.3 pp -54.75 175.75 0.05 Allowed 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 126.857 2.063 . . . . 0.0 113.79 169.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -34.01 -63.66 0.26 Allowed 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 126.827 2.051 . . . . 0.0 114.433 -172.389 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -82.6 -12.47 57.67 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 126.324 1.85 . . . . 0.0 115.382 -179.426 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 35.5 t0 -83.47 -23.42 32.21 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.619 1.168 . . . . 0.0 111.992 171.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 16.9 t -61.25 -52.8 68.49 Favored Pre-proline 0 CA--C 1.549 0.925 0 O-C-N 120.908 -1.12 . . . . 0.0 113.386 -179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 62.5 Cg_endo -76.49 -179.68 5.55 Favored 'Trans proline' 0 CA--C 1.542 0.922 0 C-N-CA 122.849 2.366 . . . . 0.0 111.936 168.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 5.8 p-80 -72.16 33.21 0.06 Allowed 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 126.116 1.766 . . . . 0.0 114.878 178.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 64.4 mt -109.33 160.49 8.21 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 C-N-CA 127.774 2.43 . . . . 0.0 110.095 -173.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 26.4 pt -54.69 128.68 15.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.672 0 C-N-CA 124.877 1.271 . . . . 0.0 112.623 178.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 17.3 p -78.99 -21.98 46.21 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 179.879 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 9.2 t -157.39 -162.63 1.23 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 127.125 2.17 . . . . 0.0 110.014 -176.633 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -77.18 49.29 0.67 Allowed 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 126.285 1.834 . . . . 0.0 112.253 174.559 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 29.3 p -147.85 150.51 34.3 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 126.636 1.974 . . . . 0.0 110.954 177.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 70.11 -179.12 28.75 Favored Glycine 0 CA--C 1.537 1.445 0 C-N-CA 124.958 1.266 . . . . 0.0 113.363 -167.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -107.3 145.95 32.14 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 125.426 1.49 . . . . 0.0 110.662 172.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 3.1 t -66.88 -5.28 11.82 Favored 'General case' 0 CA--C 1.548 0.903 0 N-CA-C 113.771 1.026 . . . . 0.0 113.771 -179.667 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 36.4 t70 -114.03 -11.17 12.78 Favored 'General case' 0 CA--C 1.555 1.146 0 C-N-CA 126.267 1.827 . . . . 0.0 114.178 170.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -157.27 105.7 2.12 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.532 1.533 . . . . 0.0 111.205 177.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -130.83 -21.34 2.74 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 114.515 1.302 . . . . 0.0 114.515 -167.514 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 82.9 m-85 -64.23 -40.31 95.76 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 119.691 1.132 . . . . 0.0 112.143 173.645 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 23.3 t 50.03 -152.78 0.15 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 124.673 1.189 . . . . 0.0 111.878 -170.727 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.8 mmp_? -80.43 -38.59 29.86 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 120.592 -1.318 . . . . 0.0 110.283 150.205 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.3 m-70 -136.92 87.67 2.3 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 125.324 1.45 . . . . 0.0 111.784 177.601 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 50.7 t 17.04 -74.1 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.291 0 C-N-CA 129.572 3.149 . . . . 0.0 117.654 157.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . . . . . . . . . 89.2 Cg_endo -71.09 72.89 2.06 Favored 'Trans proline' 0 CA--C 1.549 1.266 0 C-N-CA 124.612 3.541 . . . . 0.0 112.995 177.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 8.0 tptm -134.33 -173.34 3.25 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 127.526 2.33 . . . . 0.0 110.958 179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 63.09 -41.36 0.19 Allowed 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 128.481 2.713 . . . . 0.0 116.956 -179.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 8.1 mt -133.61 93.7 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.552 0 C-N-CA 125.68 1.592 . . . . 0.0 109.285 -174.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 pt20 -139.59 167.45 22.06 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.661 1.584 . . . . 0.0 111.86 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 94.5 m -70.34 161.49 30.32 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-O 122.292 1.044 . . . . 0.0 111.996 170.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 15.4 m -71.41 -20.78 62.08 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 114.286 1.217 . . . . 0.0 114.286 -176.158 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -134.41 2.35 3.24 Favored 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 115.222 1.564 . . . . 0.0 115.222 -175.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 12.8 p -152.37 165.95 33.39 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.769 1.227 . . . . 0.0 112.288 175.584 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -76.7 134.1 39.32 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 125.557 1.543 . . . . 0.0 113.807 -172.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 36.6 mt-10 59.23 156.99 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 127.225 2.21 . . . . 0.0 115.296 -172.255 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 26.2 m -88.85 -22.76 6.51 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.145 0 O-C-N 120.222 -1.549 . . . . 0.0 110.196 153.747 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -63.83 -20.11 63.91 Favored Glycine 0 CA--C 1.535 1.299 0 C-N-CA 126.402 1.953 . . . . 0.0 115.512 -173.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 5.7 p80 -79.87 -14.35 58.71 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 115.232 1.567 . . . . 0.0 115.232 -169.35 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 31.1 t80 -150.77 124.4 9.08 Favored 'General case' 0 CA--C 1.539 0.539 0 C-N-CA 123.974 0.91 . . . . 0.0 111.793 174.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 38.3 tpt85 52.97 12.05 0.25 Allowed 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 126.854 2.062 . . . . 0.0 115.138 -173.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . 0.304 33.0 p 48.4 23.95 0.65 Allowed 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 126.917 2.087 . . . . 0.0 115.183 -161.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -147.35 -36.11 0.23 Allowed 'General case' 0 CA--C 1.544 0.733 0 N-CA-C 114.244 1.201 . . . . 0.0 114.244 -177.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 25.4 t 42.78 65.51 5.2 Favored Pre-proline 0 CA--C 1.556 1.178 0 C-N-CA 126.548 1.939 . . . . 0.0 114.2 -178.522 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -69.17 150.61 72.03 Favored 'Trans proline' 0 CA--C 1.54 0.822 0 C-N-CA 122.943 2.429 . . . . 0.0 112.865 -179.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -77.24 148.33 35.85 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.756 0.822 . . . . 0.0 111.739 172.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 63.5 pttt -91.13 157.83 16.99 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 114.588 1.329 . . . . 0.0 114.588 -173.085 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 11.3 t90 -144.28 -171.81 3.65 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 126.748 2.019 . . . . 0.0 109.376 163.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 63.2 mttp -51.51 120.77 5.46 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 124.418 1.087 . . . . 0.0 111.248 175.108 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -74.49 123.43 24.73 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.149 0.98 . . . . 0.0 111.236 -174.414 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 78.5 t -78.0 -37.56 23.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.757 1.223 . . . . 0.0 112.504 -169.259 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 62.6 -36.37 0.13 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 128.226 2.61 . . . . 0.0 115.809 -172.015 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 35.5 m -78.59 -1.11 32.55 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 126.519 1.927 . . . . 0.0 114.902 178.643 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . 0.271 15.0 t 56.36 -51.69 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 129.657 3.183 . . . . 0.0 118.59 -177.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 4.2 pp -86.37 -13.94 44.95 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 125.503 1.521 . . . . 0.0 113.828 -177.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 96.7 m -79.67 168.79 18.88 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.308 1.043 . . . . 0.0 112.381 177.269 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 75.1 mmtt -111.0 -30.33 7.55 Favored 'General case' 0 N--CA 1.481 1.12 0 N-CA-C 114.448 1.277 . . . . 0.0 114.448 177.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 42.2 p -87.27 172.89 9.54 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 125.388 1.475 . . . . 0.0 112.906 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.33 162.61 7.54 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.129 0.972 . . . . 0.0 113.376 174.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 10.0 ptpp? -52.82 147.05 9.51 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 114.656 1.354 . . . . 0.0 114.656 -173.422 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 15.1 p80 -148.19 17.34 1.07 Allowed 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 125.564 1.545 . . . . 0.0 112.914 172.849 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 85.7 p -75.22 -38.77 60.5 Favored 'General case' 0 N--CA 1.469 0.481 0 N-CA-C 115.901 1.815 . . . . 0.0 115.901 -152.035 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 13.2 mptt 47.89 34.78 4.24 Favored 'General case' 0 N--CA 1.48 1.059 0 C-N-CA 125.657 1.583 . . . . 0.0 113.248 -169.276 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 56.73 18.04 3.51 Favored 'General case' 0 CA--C 1.555 1.136 0 C-N-CA 126.546 1.938 . . . . 0.0 115.528 -172.448 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 50.3 tpt85 -125.08 -30.14 3.24 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 127.217 2.207 . . . . 0.0 114.136 -175.566 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 9.8 t 49.55 66.07 6.15 Favored Pre-proline 0 CA--C 1.553 1.081 0 C-N-CA 125.543 1.537 . . . . 0.0 112.441 -166.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 83.5 Cg_endo -70.02 168.99 20.31 Favored 'Trans proline' 0 CA--C 1.538 0.702 0 C-N-CA 123.392 2.728 . . . . 0.0 112.474 179.763 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 25.3 p -70.22 161.29 30.57 Favored 'General case' 0 N--CA 1.47 0.533 0 CA-C-O 121.809 0.814 . . . . 0.0 112.662 166.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 10.2 tp -60.46 149.83 7.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 C-N-CA 124.327 1.051 . . . . 0.0 111.808 176.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 73.0 t-105 -59.47 140.73 55.95 Favored 'General case' 0 CA--C 1.542 0.636 0 CA-C-O 121.769 0.795 . . . . 0.0 113.025 -175.76 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 35.0 ptt85 -156.12 158.63 38.03 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 126.962 2.105 . . . . 0.0 111.443 -165.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -65.44 156.11 33.41 Favored 'General case' 0 CA--C 1.545 0.766 0 N-CA-C 113.142 0.793 . . . . 0.0 113.142 -179.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -64.74 143.37 57.98 Favored 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 123.627 0.771 . . . . 0.0 112.336 177.461 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 31.0 mm -84.44 142.15 13.73 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 C-N-CA 124.46 1.104 . . . . 0.0 110.545 -177.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 91.2 mt -66.48 150.31 49.13 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.873 0.869 . . . . 0.0 111.918 176.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 14.8 p -65.21 135.91 27.54 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 C-N-CA 123.456 0.703 . . . . 0.0 111.807 -179.746 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 7.1 p-10 -80.47 150.42 29.7 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.882 1.273 . . . . 0.0 113.419 -176.899 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 34.6 t0 -148.69 156.33 42.24 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.391 1.477 . . . . 0.0 111.442 179.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 93.9 m-20 -110.96 157.42 19.92 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 126.23 1.812 . . . . 0.0 112.236 -174.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -138.92 163.87 31.19 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 125.592 1.557 . . . . 0.0 112.51 175.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 94.6 mttt 56.19 23.96 7.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 126.54 1.936 . . . . 0.0 114.893 176.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -78.41 156.9 29.21 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 124.362 1.065 . . . . 0.0 112.949 178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 56.9 tttm -139.47 136.7 17.98 Favored Pre-proline 0 N--CA 1.475 0.804 0 C-N-CA 126.563 1.945 . . . . 0.0 110.57 178.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -68.91 143.37 54.77 Favored 'Trans proline' 0 CA--C 1.539 0.734 0 C-N-CA 122.731 2.287 . . . . 0.0 111.734 173.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -126.54 113.33 16.65 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 124.942 1.297 . . . . 0.0 110.824 -177.176 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.12 19.21 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.136 0 C-N-CA 126.391 1.876 . . . . 0.0 112.267 -177.808 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 92.9 mt -72.56 155.76 90.79 Favored Pre-proline 0 CA--C 1.546 0.826 0 C-N-CA 125.49 1.516 . . . . 0.0 112.409 -176.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -62.13 152.9 73.03 Favored 'Trans proline' 0 CA--C 1.54 0.79 0 C-N-CA 123.062 2.508 . . . . 0.0 112.397 172.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -93.53 148.58 21.95 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 124.045 0.938 . . . . 0.0 112.794 -177.19 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 24.2 m80 60.43 0.51 0.32 Allowed 'General case' 0 N--CA 1.478 0.956 0 N-CA-C 117.236 2.31 . . . . 0.0 117.236 175.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 6.9 p -84.04 134.67 34.61 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 125.03 1.332 . . . . 0.0 111.296 173.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -133.31 18.03 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.485 1.514 . . . . 0.0 113.836 -173.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 5.9 p90 -136.57 156.16 48.94 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.383 1.473 . . . . 0.0 112.505 -175.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 2.4 t -124.73 12.19 8.52 Favored 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 114.406 1.261 . . . . 0.0 114.406 -162.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 88.1 m-85 -56.66 -35.84 68.86 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 120.294 -1.504 . . . . 0.0 114.084 -176.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 95.0 m-20 -70.05 -13.76 62.37 Favored 'General case' 0 CA--C 1.548 0.901 0 N-CA-C 113.836 1.05 . . . . 0.0 113.836 178.303 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -86.34 -6.43 58.95 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 125.985 1.714 . . . . 0.0 112.743 172.088 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 114.99 -7.64 21.56 Favored Glycine 0 CA--C 1.537 1.427 0 C-N-CA 126.313 1.911 . . . . 0.0 114.384 -177.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . 165.14 149.65 5.92 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-N 118.614 1.207 . . . . 0.0 113.89 174.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 24.8 tptp -65.2 -17.91 64.88 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 126.491 1.917 . . . . 0.0 114.257 -178.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -71.86 -5.4 61.18 Favored Glycine 0 CA--C 1.538 1.482 0 N-CA-C 118.602 2.201 . . . . 0.0 118.602 -164.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -147.35 150.68 35.2 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 120.897 2.349 . . . . 0.0 115.535 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 12.1 m-85 39.16 29.44 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 129.978 3.311 . . . . 0.0 117.658 164.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -62.34 -11.7 35.09 Favored Glycine 0 CA--C 1.536 1.386 0 C-N-CA 124.961 1.267 . . . . 0.0 115.025 -174.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -67.86 -33.51 74.89 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 125.499 1.519 . . . . 0.0 113.92 174.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -151.39 -26.66 0.2 Allowed 'General case' 0 N--CA 1.476 0.85 0 N-CA-C 115.849 1.796 . . . . 0.0 115.849 -166.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 14.9 p -65.44 136.67 56.76 Favored 'General case' 0 CA--C 1.544 0.734 0 CA-C-N 120.579 1.536 . . . . 0.0 113.535 -168.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . 0.427 ' HE2' ' HA ' ' A' ' 122' ' ' LYS . 0.7 OUTLIER -155.78 -29.23 0.1 Allowed 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 125.007 1.323 . . . . 0.0 113.45 -176.251 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -74.94 163.56 27.5 Favored 'General case' 0 CA--C 1.546 0.802 0 N-CA-C 114.113 1.153 . . . . 0.0 114.113 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 28.2 mtpp . . . . . 0 C--O 1.252 1.213 0 C-N-CA 126.895 2.078 . . . . 0.0 113.102 -179.395 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 21.1 tptp . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -61.81 153.23 29.32 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 125.966 1.706 . . . . 0.0 112.926 -178.252 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -116.83 130.65 56.85 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 124.367 1.067 . . . . 0.0 112.804 -177.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -75.41 -51.4 3.3 Favored Pre-proline 0 CA--C 1.553 1.074 0 C-N-CA 124.001 0.92 . . . . 0.0 112.471 159.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -76.05 -41.39 0.51 Allowed 'Trans proline' 0 C--N 1.357 0.984 0 C-N-CA 122.548 2.166 . . . . 0.0 114.74 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . 0.295 0.1 OUTLIER 50.85 -33.95 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.399 0 C-N-CA 131.343 3.857 . . . . 0.0 119.286 -171.98 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.9 t -157.79 164.49 36.97 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 126.416 1.886 . . . . 0.0 112.652 171.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -74.54 -40.21 61.86 Favored 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 124.515 1.126 . . . . 0.0 113.307 173.573 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -158.37 -31.3 0.07 Allowed 'General case' 0 CA--C 1.544 0.739 0 C-N-CA 125.741 1.617 . . . . 0.0 113.101 -171.343 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 m -73.21 -163.82 0.16 Allowed 'General case' 0 CA--C 1.55 0.959 0 C-N-CA 123.856 0.862 . . . . 0.0 110.654 169.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 24.1 p -135.87 155.69 49.92 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 120.893 -1.129 . . . . 0.0 112.9 170.884 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 39.7 mt-30 56.51 -173.59 0.07 Allowed 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 126.87 2.068 . . . . 0.0 114.716 179.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . 0.265 9.1 ttp180 65.6 27.19 11.52 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 127.2 2.2 . . . . 0.0 115.659 172.48 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.48 -17.02 0.66 Allowed Glycine 0 N--CA 1.476 1.353 0 N-CA-C 117.907 1.923 . . . . 0.0 117.907 160.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -81.14 77.63 8.01 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.202 1.501 . . . . 0.0 111.142 -178.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 4.4 pp -56.99 178.74 0.05 Allowed 'General case' 0 CA--C 1.54 0.593 0 C-N-CA 128.107 2.563 . . . . 0.0 113.693 176.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -36.21 -64.44 0.32 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 126.616 1.966 . . . . 0.0 114.252 -171.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 60.4 pttt -78.71 -13.97 59.54 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 126.083 1.753 . . . . 0.0 115.296 179.064 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -90.87 -14.78 31.08 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 125.336 1.454 . . . . 0.0 113.139 177.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 15.6 t -63.94 -53.91 45.12 Favored Pre-proline 0 CA--C 1.549 0.923 0 CA-C-O 118.08 -0.962 . . . . 0.0 113.018 171.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.26 154.44 41.3 Favored 'Trans proline' 0 CA--C 1.543 0.933 0 C-N-CA 122.199 1.932 . . . . 0.0 111.68 169.636 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' HIS . . . . . . . . . . . . . 28.7 p-80 -122.55 0.77 9.43 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.087 1.514 . . . . 0.0 115.087 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ILE . . . . . 0.505 ' H ' HD13 ' A' ' 23' ' ' ILE . 0.2 OUTLIER -102.18 15.6 5.29 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.118 0 C-N-CA 125.301 1.44 . . . . 0.0 114.073 -175.922 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 17.8 mm -107.17 134.62 48.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 125.645 1.578 . . . . 0.0 110.631 -168.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 23.7 p -87.59 141.61 28.48 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-O 122.323 1.059 . . . . 0.0 112.272 173.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 23.2 p -70.17 137.5 51.03 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.314 1.446 . . . . 0.0 114.119 -164.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 65.6 m-85 50.66 14.29 0.17 Allowed 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 126.121 1.768 . . . . 0.0 115.217 -169.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 8.9 t -150.39 29.49 0.7 Allowed 'General case' 0 CA--C 1.544 0.738 0 C-N-CA 124.183 0.993 . . . . 0.0 112.159 -163.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . -161.7 153.99 24.86 Favored Glycine 0 CA--C 1.527 0.794 0 O-C-N 120.297 -1.502 . . . . 0.0 114.863 -176.754 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -142.58 140.72 31.81 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.557 1.543 . . . . 0.0 110.101 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.76 -21.54 64.35 Favored 'General case' 0 N--CA 1.476 0.845 0 N-CA-C 114.047 1.129 . . . . 0.0 114.047 -171.374 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -138.84 15.0 2.68 Favored 'General case' 0 N--CA 1.479 0.987 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 179.481 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -138.7 -1.06 1.87 Allowed 'General case' 0 N--CA 1.482 1.145 0 N-CA-C 115.278 1.584 . . . . 0.0 115.278 -172.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 37.0 t-80 -106.37 150.19 26.25 Favored 'General case' 0 CA--C 1.541 0.62 0 C-N-CA 125.068 1.347 . . . . 0.0 113.226 -172.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -142.37 147.21 35.88 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 125.158 1.383 . . . . 0.0 111.188 168.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 29.5 t -54.62 -40.95 69.42 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.692 1.597 . . . . 0.0 114.47 -172.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 32.6 mmt180 -79.13 -13.38 59.77 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 178.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 8.2 m-70 -104.49 -18.21 14.46 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 125.218 1.407 . . . . 0.0 113.42 179.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' CYS . . . . . 0.503 ' CB ' ' HD3' ' A' ' 40' ' ' PRO 0.288 1.2 m 24.43 -88.63 0.0 OUTLIER Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 129.989 3.316 . . . . 0.0 116.561 172.44 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.503 ' HD3' ' CB ' ' A' ' 39' ' ' CYS . 25.0 Cg_exo -70.17 -19.95 33.54 Favored 'Trans proline' 0 C--N 1.357 1.011 0 CA-C-N 122.284 1.851 . . . . 0.0 116.709 -158.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 71.4 mmtt -79.03 1.91 22.36 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 114.79 1.404 . . . . 0.0 114.79 -174.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -73.26 -21.52 60.59 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 115.08 1.511 . . . . 0.0 115.08 -175.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 23.1 mt -130.21 141.22 46.91 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.818 0 C-N-CA 125.813 1.645 . . . . 0.0 108.854 176.633 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.3 pt20 -147.6 161.44 41.13 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 114.093 1.146 . . . . 0.0 114.093 179.094 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 44.0 t -67.04 156.91 34.83 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 125.525 1.53 . . . . 0.0 112.036 168.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 3.4 m -65.71 -17.72 64.82 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 125.18 1.392 . . . . 0.0 114.63 174.324 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 30.8 ttmt -129.63 -2.57 4.81 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 125.33 1.452 . . . . 0.0 114.696 -171.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 31.1 p -149.27 156.01 41.46 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 124.368 1.067 . . . . 0.0 111.835 169.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -70.39 151.52 45.11 Favored 'General case' 0 N--CA 1.472 0.662 0 O-C-N 121.647 -0.658 . . . . 0.0 112.163 174.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 59.18 175.06 0.07 Allowed 'General case' 0 CA--C 1.55 0.972 0 C-N-CA 124.739 1.216 . . . . 0.0 113.278 -170.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.8 m -75.94 71.14 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 O-C-N 119.813 -1.805 . . . . 0.0 109.66 167.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLY . . . . . . . . . . . . . . . -74.39 -116.29 0.09 OUTLIER Glycine 0 CA--C 1.535 1.307 0 C-N-CA 126.458 1.98 . . . . 0.0 117.132 -159.209 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -67.9 -7.92 32.4 Favored 'General case' 0 CA--C 1.545 0.77 0 N-CA-C 117.704 2.483 . . . . 0.0 117.704 -154.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -128.93 118.67 23.04 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 119.475 1.034 . . . . 0.0 112.24 176.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 1.7 ptp180 43.98 26.16 0.13 Allowed 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 128.724 2.81 . . . . 0.0 116.66 166.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 18.0 m 52.66 30.25 8.45 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.31 1.444 . . . . 0.0 114.786 -172.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -145.02 -34.34 0.35 Allowed 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 125.127 1.371 . . . . 0.0 113.38 -174.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 86.7 m 45.71 58.33 15.6 Favored Pre-proline 0 CA--C 1.555 1.17 0 C-N-CA 126.189 1.796 . . . . 0.0 114.813 -174.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_endo -70.69 170.47 17.61 Favored 'Trans proline' 0 CA--C 1.544 0.999 0 C-N-CA 123.551 2.834 . . . . 0.0 113.065 175.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 44.8 p-80 -133.25 158.32 43.21 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 125.162 1.385 . . . . 0.0 112.123 172.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -86.38 140.3 30.14 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.965 1.306 . . . . 0.0 112.372 -176.753 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -74.17 158.7 33.68 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.226 1.01 . . . . 0.0 113.242 176.264 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -125.15 41.12 3.59 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 126.215 1.806 . . . . 0.0 111.739 175.026 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.9 tptt -70.9 154.16 42.06 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.639 1.176 . . . . 0.0 111.746 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 14.2 p -70.58 131.13 34.67 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 123.327 0.651 . . . . 0.0 112.044 -178.43 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 21.0 mm100 -103.69 6.7 37.13 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 125.285 1.434 . . . . 0.0 113.735 -173.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 73.4 m -74.11 -17.67 60.91 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 115.083 1.512 . . . . 0.0 115.083 -172.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER 62.86 -47.76 0.2 Allowed 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 128.212 2.605 . . . . 0.0 117.608 -166.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -86.36 0.07 54.8 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 114.478 1.288 . . . . 0.0 114.478 -176.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 91.8 m -111.37 156.28 21.83 Favored 'General case' 0 CA--C 1.537 0.458 0 C-N-CA 124.866 1.266 . . . . 0.0 112.854 -178.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 49.2 mmtm -114.48 160.95 18.62 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 126.027 1.731 . . . . 0.0 109.619 161.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 25.8 m -76.04 -20.83 57.44 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 114.638 1.347 . . . . 0.0 114.638 -172.323 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . . . . . . . . . 19.2 ptpt -66.84 134.13 51.47 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.521 0.728 . . . . 0.0 112.262 178.778 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 37.2 tttp 47.61 35.22 4.18 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 126.764 2.025 . . . . 0.0 114.221 177.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' HIS . . . . . . . . . . . . . 56.9 t-80 -82.51 131.61 35.21 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 123.824 0.85 . . . . 0.0 112.668 -171.227 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 50.8 m -94.3 110.96 22.68 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.914 0.886 . . . . 0.0 111.956 177.337 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 37.4 mtmm -62.86 135.45 57.33 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.782 0.833 . . . . 0.0 111.578 -177.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 54.52 20.07 2.67 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 126.355 1.862 . . . . 0.0 115.669 -173.421 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -130.87 -40.04 1.2 Allowed 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 125.43 1.492 . . . . 0.0 113.356 177.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 60.8 m 63.91 148.64 0.1 Allowed Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 128.655 2.782 . . . . 0.0 115.667 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PRO . . . . . . . . . . . . . 59.0 Cg_endo -69.91 -32.69 17.48 Favored 'Trans proline' 0 CA--C 1.539 0.772 0 C-N-CA 123.057 2.505 . . . . 0.0 112.812 171.582 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' SER . . . . . . . . . . . . . 47.4 t -126.36 151.99 46.87 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 126.483 1.913 . . . . 0.0 111.476 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 16.8 tt -137.74 -28.47 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 N-CA-C 114.371 1.248 . . . . 0.0 114.371 -174.602 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' TRP . . . . . . . . . . . . . 13.6 t-105 -96.29 -19.4 19.3 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.86 1.43 . . . . 0.0 114.86 -163.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 66.9 mtp180 -92.36 25.54 2.93 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 125.542 1.537 . . . . 0.0 113.824 -175.131 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -87.22 -8.29 57.0 Favored 'General case' 0 CA--C 1.549 0.911 0 N-CA-C 115.134 1.531 . . . . 0.0 115.134 -173.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -82.6 -18.91 39.59 Favored 'General case' 0 CA--C 1.546 0.79 0 N-CA-C 114.424 1.268 . . . . 0.0 114.424 -170.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 73.1 mt -88.35 132.5 33.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.603 1.161 . . . . 0.0 110.443 -178.241 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 87.2 mt -124.66 8.11 8.24 Favored 'General case' 0 CA--C 1.548 0.874 0 C-N-CA 125.441 1.497 . . . . 0.0 113.934 -172.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 41.1 t -82.12 110.58 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.987 0 C-N-CA 124.121 0.968 . . . . 0.0 111.562 -171.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -156.69 136.73 12.7 Favored 'General case' 0 CA--C 1.545 0.774 0 C-N-CA 125.605 1.562 . . . . 0.0 111.298 172.7 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -155.05 150.22 27.01 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 125.115 1.366 . . . . 0.0 113.052 178.136 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.3 p-10 -150.4 170.91 17.93 Favored 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 126.101 1.761 . . . . 0.0 112.087 174.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -97.28 141.91 29.81 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.387 1.075 . . . . 0.0 112.296 177.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 60.6 mtpt -137.15 -59.2 0.7 Allowed 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 125.25 1.42 . . . . 0.0 112.869 -172.358 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -74.66 157.04 36.02 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.973 0.909 . . . . 0.0 112.945 -179.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.427 ' HA ' ' HD3' ' A' ' 98' ' ' PRO . 7.9 ptpp? -148.58 146.43 22.36 Favored Pre-proline 0 N--CA 1.478 0.944 0 C-N-CA 125.624 1.57 . . . . 0.0 112.347 -178.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' PRO . . . . . 0.427 ' HD3' ' HA ' ' A' ' 97' ' ' LYS . 31.6 Cg_exo -70.69 -33.86 12.4 Favored 'Trans proline' 0 C--N 1.353 0.785 0 C-N-CA 122.741 2.294 . . . . 0.0 114.822 -178.532 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 36.3 mtmm -138.17 158.35 44.48 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 126.414 1.885 . . . . 0.0 111.633 -177.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 7.1 p -121.05 -4.65 9.32 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 C-N-CA 125.375 1.47 . . . . 0.0 113.777 -177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 21.2 tp -68.71 124.41 90.08 Favored Pre-proline 0 CA--C 1.551 1.01 0 O-C-N 121.183 -0.948 . . . . 0.0 110.974 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -80.64 159.42 21.98 Favored 'Trans proline' 0 CA--C 1.539 0.728 0 C-N-CA 122.84 2.36 . . . . 0.0 113.774 -174.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 10.5 p90 -144.42 158.47 43.73 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 127.72 2.408 . . . . 0.0 109.607 173.797 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' HIS . . . . . . . . . . . . . 32.6 p80 -73.1 -23.74 60.55 Favored 'General case' 0 N--CA 1.474 0.753 0 N-CA-C 114.534 1.309 . . . . 0.0 114.534 -170.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' THR . . . . . . . . . . . . . 14.1 t -87.81 61.81 6.62 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-O 123.786 1.755 . . . . 0.0 113.569 -178.156 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 48.7 pt -72.35 11.72 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.837 0 C-N-CA 126.165 1.786 . . . . 0.0 115.172 -171.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -99.25 9.33 43.61 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 116.764 2.135 . . . . 0.0 116.764 -152.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER 59.05 164.11 0.04 OUTLIER 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 115.751 1.76 . . . . 0.0 115.751 -172.956 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' TYR . . . . . . . . . . . . . 37.2 p90 -70.87 -17.64 62.72 Favored 'General case' 0 CA--C 1.542 0.671 0 N-CA-C 114.45 1.278 . . . . 0.0 114.45 -168.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -64.6 -32.09 73.59 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 119.159 0.89 . . . . 0.0 111.81 170.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 55.6 m -99.1 -3.64 34.15 Favored 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 126.393 1.877 . . . . 0.0 113.3 178.333 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 86.66 8.74 76.31 Favored Glycine 0 CA--C 1.542 1.753 0 C-N-CA 125.431 1.491 . . . . 0.0 115.801 -175.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . . . . . . . . . . . -106.94 -157.97 21.2 Favored Glycine 0 CA--C 1.539 1.569 0 C-N-CA 126.404 1.954 . . . . 0.0 113.606 174.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -140.49 150.99 44.45 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 127.051 2.14 . . . . 0.0 111.601 174.441 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 88.2 -152.18 23.37 Favored Glycine 0 CA--C 1.54 1.636 0 N-CA-C 116.271 1.268 . . . . 0.0 116.271 176.257 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . 0.305 0.6 OUTLIER 47.52 -161.75 0.03 OUTLIER 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 128.952 2.901 . . . . 0.0 115.661 -170.014 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 93.2 m-85 -67.07 36.89 0.02 OUTLIER 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 126.729 2.012 . . . . 0.0 113.736 171.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -50.17 -30.04 16.6 Favored Glycine 0 CA--C 1.536 1.402 0 C-N-CA 126.53 2.014 . . . . 0.0 113.877 175.057 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 34.8 t70 -54.1 -38.62 65.55 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 126.518 1.927 . . . . 0.0 114.189 172.45 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -97.68 -34.16 11.03 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 125.798 1.639 . . . . 0.0 111.798 176.162 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 11.3 t -71.18 -7.63 48.08 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 125.486 1.514 . . . . 0.0 113.839 -177.385 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.6 -8.49 57.94 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.205 1.402 . . . . 0.0 114.313 169.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -107.82 146.45 32.24 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 125.237 1.415 . . . . 0.0 112.455 173.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 16.3 tppt? . . . . . 0 C--O 1.253 1.265 0 C-N-CA 126.499 1.92 . . . . 0.0 111.076 174.127 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 201' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 202' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 203' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 204' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 205' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_