data_1n89_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 1n89 _Structure_validation_residue.Date_analyzed 2016-10-06 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' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.784 0.326 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.19 32.52 20.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.871 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -149.17 -36.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.31 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.26 -14.83 62.57 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.858 0.361 . . . . 0.0 111.166 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.57 -20.23 13.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.87 -43.78 28.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.115 0.483 . . . . 0.0 111.486 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.6 p -56.45 -25.23 20.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.193 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -88.54 -30.78 19.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.61 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.2 -30.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.37 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.1 m -55.04 -35.38 64.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.783 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.41 -43.3 14.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.303 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.411 ' CG2' ' HA ' ' A' ' 47' ' ' TYR . 4.1 mp -60.9 -53.42 49.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 26.9 mt -73.7 -80.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 t -60.22 -75.32 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.946 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.5 37.34 0.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.591 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.22 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.128 0.489 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.99 138.01 3.15 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.831 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.71 -171.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.447 2.098 . . . . 0.0 112.321 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 m -174.39 140.99 0.67 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.82 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.43 -44.22 93.57 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.582 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -48.81 -36.31 16.46 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 120.905 0.383 . . . . 0.0 111.059 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.1 t -53.7 -63.29 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.291 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 12.2 p -53.48 -25.21 15.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.272 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.47 -38.01 18.83 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -56.5 -50.32 72.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.13 0.49 . . . . 0.0 111.613 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.474 ' CD1' ' CE2' ' A' ' 35' ' ' PHE . 3.9 pp -51.36 -37.86 50.22 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.337 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 34.5 mmm-85 -54.24 -47.14 72.54 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.395 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.46 -28.44 13.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.304 0.573 . . . . 0.0 109.592 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -81.93 -74.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.454 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 49.01 19.62 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.615 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -130.08 -82.45 0.28 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.517 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.8 t -61.4 -34.62 75.67 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.417 0.627 . . . . 0.0 110.181 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.474 ' CE2' ' CD1' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -56.31 -37.16 69.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.464 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.22 -51.28 21.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.067 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.517 HE21 ' HA ' ' A' ' 34' ' ' CYS . 5.1 pt20 -70.59 -23.07 62.51 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.219 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.55 -22.49 13.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.742 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.86 -19.55 12.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.758 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -94.65 -23.17 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 111.016 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -57.39 116.32 13.46 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.772 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.67 -44.23 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.523 2.149 . . . . 0.0 112.722 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 p -51.2 -41.84 60.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.228 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -95.77 15.14 20.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.197 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.65 -27.91 62.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.575 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.6 -25.84 62.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.776 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.411 ' HA ' ' CG2' ' A' ' 14' ' ' ILE . 9.3 t80 -75.22 -51.76 12.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.0 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 29.5 mt -69.72 -42.68 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.545 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.82 27.97 0.36 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.427 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.83 164.56 50.39 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.447 179.153 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -81.01 -46.95 0.08 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.443 2.095 . . . . 0.0 111.826 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.513 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -80.89 -17.75 49.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.701 -179.303 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.427 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -61.49 -58.96 6.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.178 0.513 . . . . 0.0 111.445 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -57.96 -32.26 67.66 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.067 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -66.27 -44.79 82.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.933 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -60.24 -51.57 68.97 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.847 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -63.8 -44.6 92.84 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.154 0.502 . . . . 0.0 110.787 179.879 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.3 m -63.58 -41.86 98.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.572 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.4 t -51.45 -38.62 54.63 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.534 0.683 . . . . 0.0 109.592 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.64 -40.63 25.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.362 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.19 54.91 31.07 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.104 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.443 HD11 ' CD1' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -109.78 -60.03 1.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.398 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.77 132.6 15.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 111.602 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.438 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 9.9 p -109.91 137.73 20.55 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.438 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 19.4 Cg_endo -57.19 -160.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.485 2.123 . . . . 0.0 112.246 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 m80 61.97 31.91 17.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.764 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.873 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.885 0.374 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.55 19.19 9.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.347 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.21 -24.93 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.359 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -69.86 -16.59 63.28 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.182 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt -99.99 -24.88 14.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.218 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.07 -38.09 23.25 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.092 0.473 . . . . 0.0 111.329 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.1 p -60.86 -25.93 37.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.165 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.65 -32.69 25.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.97 -29.24 0.55 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.458 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 71.2 m -53.07 -43.38 66.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.847 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.83 -25.78 34.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.311 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.438 HG22 ' CD2' ' A' ' 47' ' ' TYR . 2.4 mp -68.7 -62.01 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.771 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -74.06 -79.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.208 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -62.62 1.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.062 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.5 36.45 4.33 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.432 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.584 ' O ' ' HG3' ' A' ' 19' ' ' LYS . . . -57.63 -79.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.899 0.38 . . . . 0.0 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -158.95 145.9 12.91 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.558 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.08 -174.69 0.81 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.457 2.105 . . . . 0.0 112.201 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.7 p -173.41 138.57 0.71 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.03 -27.67 60.06 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -53.15 -43.09 66.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.895 0.378 . . . . 0.0 111.081 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 47.7 t -55.67 -23.51 28.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.393 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 87.6 m -78.02 -45.58 23.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.846 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.95 -35.28 58.14 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -62.67 -60.22 3.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.185 0.517 . . . . 0.0 110.915 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.502 ' CD1' ' CE2' ' A' ' 35' ' ' PHE . 1.2 pp -54.47 -31.35 55.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.675 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HD2' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -59.69 -47.47 85.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.216 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.16 -25.82 3.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.564 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -72.66 0.42 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.3 20.68 0.16 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.588 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.97 -80.49 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.919 -0.657 . . . . 0.0 112.195 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.514 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.6 t -59.52 -36.22 75.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.408 0.623 . . . . 0.0 110.416 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.502 ' CE2' ' CD1' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -57.18 -43.96 83.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.441 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.93 -33.94 77.22 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.504 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.514 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 28.3 mt-30 -59.03 -35.01 72.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.383 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.85 -15.4 54.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.334 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -47.99 -28.93 3.03 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.938 0.399 . . . . 0.0 111.519 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -118.79 -27.99 5.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.233 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -60.15 107.51 1.06 Allowed Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.853 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -82.09 38.16 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.917 2.411 . . . . 0.0 112.744 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.4 p -67.58 -38.13 83.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.902 0.382 . . . . 0.0 110.736 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -98.31 -55.09 2.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.38 -56.63 5.06 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.622 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -75.7 -21.14 57.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.704 0.288 . . . . 0.0 111.196 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.438 ' CD2' HG22 ' A' ' 14' ' ' ILE . 3.4 t80 -80.02 -51.72 8.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.256 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.9 mm -65.15 -59.24 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.185 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -80.45 31.06 0.28 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.867 0.365 . . . . 0.0 111.541 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.461 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -80.77 147.51 62.72 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 179.548 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -80.12 -42.01 0.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.563 2.176 . . . . 0.0 112.692 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -80.25 -30.23 38.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.834 -179.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.461 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -59.25 -54.92 41.32 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.262 0.553 . . . . 0.0 111.466 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -54.73 -35.78 64.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.09 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -68.79 -42.0 77.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.545 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -61.0 -50.85 71.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -46.56 87.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.195 0.521 . . . . 0.0 110.631 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.5 m -62.14 -42.49 99.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.719 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -51.74 -39.52 58.61 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.434 0.635 . . . . 0.0 109.762 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.67 -34.87 34.44 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.565 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 56.06 46.59 84.49 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.478 -0.868 . . . . 0.0 111.888 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.49 ' CD1' ' N ' ' A' ' 63' ' ' ALA . 3.5 pp -109.9 -40.88 4.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.592 0.234 . . . . 0.0 111.502 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.49 ' N ' ' CD1' ' A' ' 62' ' ' LEU . . . -150.43 159.08 44.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.016 0.436 . . . . 0.0 111.643 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.425 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 0.5 OUTLIER -150.16 161.69 30.13 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.396 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.425 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 65.7 Cg_endo -77.74 31.71 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.012 2.475 . . . . 0.0 113.343 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -132.79 43.17 3.0 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.725 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 23.1 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.977 -179.913 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.836 0.35 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 61.94 31.98 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.061 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 m -122.2 -39.78 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -76.55 -5.07 46.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.477 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.8 mt -114.37 -19.36 11.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.46 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.41 -52.81 15.72 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.175 0.512 . . . . 0.0 111.424 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.3 p -57.35 -22.49 17.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.369 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -88.56 -32.49 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.495 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.03 -30.02 0.68 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.39 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -53.37 -43.64 67.97 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.5 -32.96 48.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.073 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.43 HG12 ' CE2' ' A' ' 47' ' ' TYR . 3.6 mp -70.66 -62.48 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.889 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -68.11 -77.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.228 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.01 -70.2 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.172 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.25 27.22 4.29 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.477 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -77.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.142 0.496 . . . . 0.0 111.103 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.29 143.52 1.56 Allowed Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.858 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.64 -170.8 0.56 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.522 2.148 . . . . 0.0 112.37 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.32 -162.61 0.54 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.423 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -102.5 -27.48 6.78 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.467 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.85 -50.01 73.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.843 0.354 . . . . 0.0 110.966 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.3 t -52.36 -27.87 17.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.163 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 29' ' ' ARG . 60.9 m -67.92 -61.0 2.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.768 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.1 -29.7 56.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.8 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -70.6 -67.67 0.48 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.073 0.463 . . . . 0.0 110.918 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.477 HD12 ' CD1' ' A' ' 62' ' ' LEU . 3.9 pp -56.26 -28.1 57.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.587 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -61.75 -47.26 86.0 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 121.166 0.507 . . . . 0.0 110.41 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.25 -24.23 10.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.265 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -81.07 -71.86 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.639 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.423 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 48.28 20.03 0.25 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.602 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.7 -81.73 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -59.14 -36.01 74.48 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.391 0.615 . . . . 0.0 110.112 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.417 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -63.71 -40.15 96.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.171 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.88 -55.7 13.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.546 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.5 pp0? -62.81 -24.87 67.97 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.707 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -23.17 14.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.586 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.49 -21.69 17.64 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.687 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.55 15.75 18.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.02 114.04 43.29 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.29 -21.25 13.69 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.529 2.153 . . . . 0.0 112.749 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.78 68.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.722 0.296 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -89.71 -75.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.488 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.02 -55.02 3.09 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.189 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.34 -24.22 65.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 111.005 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.43 ' CE2' HG12 ' A' ' 14' ' ' ILE . 8.1 t80 -76.44 -53.49 8.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.788 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.433 HD13 HG23 ' A' ' 48' ' ' ILE . 36.6 mm -69.56 -51.29 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.209 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -80.67 31.0 0.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.842 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.405 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.74 148.41 65.22 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.638 179.352 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.32 -44.35 4.91 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.251 1.968 . . . . 0.0 112.01 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -80.22 -17.82 51.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.382 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.405 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -55.37 -50.89 68.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.219 0.533 . . . . 0.0 111.273 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.86 -47.49 74.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.1 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.11 -41.57 90.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.598 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.5 m -57.51 -37.26 72.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.641 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.0 -59.39 5.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -59.46 -44.03 93.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.03 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.0 t -52.4 -29.83 26.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.625 0.726 . . . . 0.0 109.363 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -39.1 63.13 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.901 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.92 55.66 6.29 Favored Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.843 -0.694 . . . . 0.0 113.387 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.477 ' CD1' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -134.13 -92.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.789 0.295 . . . . 0.0 111.019 179.109 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.32 178.8 8.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 120.868 0.366 . . . . 0.0 111.388 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.438 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 0.3 OUTLIER -109.9 147.45 36.22 Favored Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.587 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.438 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 43.1 Cg_endo -81.83 32.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.966 2.444 . . . . 0.0 113.8 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.434 ' HB2' HG13 ' A' ' 64' ' ' VAL . 45.7 m80 -103.13 32.28 3.83 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.713 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.951 -179.946 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.822 0.344 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 58.16 23.11 9.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.282 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -123.61 -34.68 3.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.105 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -86.86 48.45 1.65 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.223 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 49.3 mt -151.99 -39.94 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.341 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -45.97 -44.31 14.81 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.089 0.471 . . . . 0.0 111.667 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 p -55.62 -24.65 16.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.226 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 t -81.38 -30.31 33.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.41 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.18 -30.48 0.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.351 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -51.47 -34.79 37.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.726 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.33 -31.71 17.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.123 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.421 HG12 ' CE2' ' A' ' 47' ' ' TYR . 4.0 mp -74.26 -65.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.16 -74.38 0.11 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.219 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -69.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.138 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.71 25.55 5.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.56 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -77.06 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.177 0.513 . . . . 0.0 111.033 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.6 157.59 3.62 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.828 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.5 -167.03 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.571 2.181 . . . . 0.0 112.202 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.71 144.63 0.84 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.824 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.54 -26.74 62.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.585 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -56.29 23.5 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.93 0.395 . . . . 0.0 110.817 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -55.39 -26.05 39.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.168 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.53 -48.49 72.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.855 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.99 -25.08 60.53 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.725 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.77 -62.74 1.39 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.129 0.49 . . . . 0.0 110.972 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.474 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 2.8 pp -54.76 -24.87 24.47 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.588 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.45 ' HD2' ' CD1' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.34 -52.44 58.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.19 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.75 -25.39 2.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.477 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.474 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -81.41 -71.6 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.914 179.416 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 48.76 19.25 0.24 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.694 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.0 -81.87 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.72 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.566 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.7 t -60.7 -33.78 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.43 0.633 . . . . 0.0 110.253 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.441 ' CD1' ' N ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -55.54 -45.75 77.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.671 179.611 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.441 ' N ' ' CD1' ' A' ' 35' ' ' PHE . 4.7 t -64.43 -56.3 15.17 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.937 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.566 HE21 ' HA ' ' A' ' 34' ' ' CYS . 15.3 pt20 -66.05 -23.15 66.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.28 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -18.53 31.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.409 ' HA ' HG13 ' A' ' 48' ' ' ILE . . . -51.51 -22.95 3.52 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.284 -0.416 . . . . 0.0 112.031 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -97.53 -24.26 15.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.499 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -57.44 109.1 1.51 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -88.62 -10.07 4.59 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.822 2.348 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.7 -27.77 12.77 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -67.3 -58.92 3.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.897 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.27 80.83 0.74 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.68 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.08 22.46 9.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 0.0 110.865 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.421 ' CE2' HG12 ' A' ' 14' ' ' ILE . 8.4 t80 -65.74 -54.66 24.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.94 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.409 HG13 ' HA ' ' A' ' 39' ' ' ALA . 20.8 mm -71.08 -37.27 66.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.576 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -80.81 25.08 0.46 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.445 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.03 155.79 72.42 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.66 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.431 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 13.1 Cg_endo -81.01 -40.55 0.17 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.365 2.043 . . . . 0.0 111.968 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.489 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.69 -30.83 36.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.593 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.445 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -53.6 -42.02 67.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -65.88 -30.39 70.99 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.785 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.31 -40.1 74.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.707 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -58.06 -49.04 78.27 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.918 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.14 -50.79 72.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.067 0.461 . . . . 0.0 110.886 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.7 m -60.8 -44.55 96.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.336 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -50.67 -31.28 15.85 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.55 0.69 . . . . 0.0 109.705 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.25 -38.99 55.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.226 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.61 54.62 5.9 Favored Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.688 -0.768 . . . . 0.0 113.113 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.444 ' CD1' ' NE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -123.48 -81.0 0.63 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.798 0.332 . . . . 0.0 110.662 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.63 168.45 24.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.503 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.423 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.8 p -109.93 137.94 20.61 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.804 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.423 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 18.7 Cg_endo -57.73 -160.57 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.34 2.026 . . . . 0.0 112.095 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.3 m80 61.55 31.24 18.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.704 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.026 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.91 179.996 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.834 0.35 . . . . 0.0 110.959 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.36 -27.33 68.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.303 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -27.91 44.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.107 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -70.38 -12.82 61.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.17 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.58 -19.09 13.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.245 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.0 -60.98 2.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.175 0.512 . . . . 0.0 111.501 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.5 p -51.53 -26.32 6.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.322 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -72.09 -31.81 66.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.533 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.404 ' N ' ' OH ' ' A' ' 47' ' ' TYR . . . -44.61 -28.78 0.64 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.12 -32.03 9.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.997 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -96.04 -34.52 11.72 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.313 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.42 HG12 ' CE2' ' A' ' 47' ' ' TYR . 5.2 mp -74.74 -59.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.067 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.2 mt -74.61 -74.31 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.211 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.9 -54.79 21.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.315 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.06 22.2 25.88 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.526 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.89 -77.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.143 0.497 . . . . 0.0 111.115 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.99 163.95 8.82 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.841 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.44 -164.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.648 2.232 . . . . 0.0 112.42 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -172.41 136.92 0.82 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.13 -35.18 90.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.538 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.78 -50.55 71.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.883 0.373 . . . . 0.0 110.939 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.7 t -56.95 -26.59 59.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.126 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.9 -51.81 36.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.711 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.87 -39.51 95.57 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.473 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -59.16 -56.76 18.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.288 0.566 . . . . 0.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.538 HD23 ' CD1' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -48.66 -30.87 5.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.386 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . 0.48 ' HA ' ' NE2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -66.31 -53.78 32.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.494 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.93 -25.15 2.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.061 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.416 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 1.9 mt-30 -81.09 -71.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.54 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.48 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 46.39 21.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.754 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 175.52 28.73 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.5 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.504 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.3 t -135.1 -37.08 0.8 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.998 0.427 . . . . 0.0 111.7 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.538 ' CD1' HD23 ' A' ' 28' ' ' LEU . 17.0 p90 -57.57 -58.29 8.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.403 0.621 . . . . 0.0 111.15 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.3 t -48.12 -33.65 8.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.504 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 29.5 mt-30 -54.54 -34.18 61.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 111.127 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -66.19 -21.17 66.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.968 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . 0.409 ' HA ' ' CD1' ' A' ' 48' ' ' ILE . . . -56.23 -21.7 25.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.728 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.2 -21.07 14.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.23 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -70.83 127.21 92.02 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.802 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.47 -42.62 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.48 2.12 . . . . 0.0 112.525 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -40.11 76.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.964 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -95.18 15.65 18.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.239 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.57 -25.08 76.27 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.642 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -71.36 -27.76 63.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.913 0.387 . . . . 0.0 110.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.42 ' CE2' HG12 ' A' ' 14' ' ' ILE . 9.2 t80 -73.38 -46.11 50.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.99 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.409 ' CD1' ' HA ' ' A' ' 39' ' ' ALA . 26.9 mt -71.37 -30.46 39.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.651 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -80.73 22.88 0.56 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.432 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -81.15 149.93 67.15 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.611 179.103 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.55 -44.62 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.322 2.015 . . . . 0.0 112.193 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -80.36 -16.77 53.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.621 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.432 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -54.47 -48.89 71.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.204 0.526 . . . . 0.0 111.449 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 43.6 mtm180 -58.6 -38.39 77.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.281 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -67.07 -42.21 85.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.791 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.02 -47.47 85.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.969 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.28 -49.85 75.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.978 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -62.02 -42.71 99.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.524 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -52.4 -33.98 46.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.487 0.661 . . . . 0.0 109.952 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.17 -33.46 38.32 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.385 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.54 55.73 16.5 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.549 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.87 -83.57 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.74 159.63 44.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.239 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.445 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 8.6 p -109.8 138.71 20.76 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.667 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.445 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 17.5 Cg_endo -56.42 -160.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.444 2.096 . . . . 0.0 112.151 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 30.8 m80 59.02 32.09 21.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.544 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.922 -179.811 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.84 0.353 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -83.03 -26.37 31.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 m -67.77 -13.06 61.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.468 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 27' ' ' ASN . 0.4 OUTLIER -83.6 -31.58 26.21 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.111 0.481 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.79 -13.78 17.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.369 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.36 -36.96 23.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.067 0.461 . . . . 0.0 111.295 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 p -59.05 -25.18 29.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.146 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -84.04 -37.52 22.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.4 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.432 ' HA ' ' CG2' ' A' ' 14' ' ' ILE . . . -47.84 -27.88 2.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.536 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -51.43 -29.87 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.416 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -140.58 21.27 2.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.439 ' CG2' ' N ' ' A' ' 15' ' ' LEU . 0.5 OUTLIER -80.22 -45.03 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.81 0.338 . . . . 0.0 111.253 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . 0.439 ' N ' ' CG2' ' A' ' 14' ' ' ILE . 2.2 mp -80.2 -68.07 0.71 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.1 m -79.43 -64.08 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 114.09 49.07 0.55 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.497 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.33 99.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.096 0.474 . . . . 0.0 111.216 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.97 94.92 0.21 Allowed Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.942 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -67.0 -167.26 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.438 2.092 . . . . 0.0 112.238 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -172.45 144.38 1.5 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.812 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.04 -29.1 61.89 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.604 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -48.39 -31.86 6.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.842 0.353 . . . . 0.0 111.144 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 41.3 t -53.86 -25.11 18.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.342 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.79 -50.57 14.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.677 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.63 -32.83 84.75 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.511 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . 0.4 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 34.5 m120 -66.39 -64.72 0.8 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.918 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.529 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 1.2 pp -50.76 -28.7 9.75 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.43 -42.62 74.43 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.743 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.83 -23.99 20.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.384 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -80.89 -71.56 0.46 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.536 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.502 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 48.66 19.8 0.28 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.827 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -176.62 26.6 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.163 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.563 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.5 t -135.27 -38.08 0.77 Allowed 'General case' 0 N--CA 1.443 -0.776 0 CA-C-O 120.869 0.366 . . . . 0.0 111.802 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.502 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 4.6 p90 -56.09 -53.17 60.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.495 0.664 . . . . 0.0 111.445 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 t -55.73 -49.61 72.61 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.334 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.563 HE21 ' HA ' ' A' ' 34' ' ' CYS . 23.1 pt20 -67.65 -26.23 66.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.224 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.2 -27.91 67.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.716 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.0 -20.13 15.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.805 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.05 -23.6 20.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.864 0.364 . . . . 0.0 111.23 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.66 112.1 9.42 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.042 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -89.23 105.9 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.918 2.412 . . . . 0.0 112.474 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.75 -45.27 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.059 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -75.54 -62.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 57.52 30.61 62.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.388 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -164.16 -40.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.995 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.43 ' CD1' HG12 ' A' ' 14' ' ' ILE . 1.7 t80 -59.5 -54.03 51.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.935 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.3 mt -74.61 -47.83 37.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.449 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -80.76 28.46 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.884 0.373 . . . . 0.0 111.923 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.452 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -80.94 151.49 70.59 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.539 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.45 -42.48 0.89 Allowed 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.223 1.948 . . . . 0.0 112.185 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.29 -26.36 38.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.492 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.452 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -57.91 -52.47 65.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.193 0.521 . . . . 0.0 111.411 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -54.12 -32.45 55.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.229 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.9 -41.09 71.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.629 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.91 -49.12 78.94 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -50.23 74.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.181 0.515 . . . . 0.0 110.872 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.4 m -60.43 -44.27 95.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.576 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.87 -32.51 32.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.484 0.659 . . . . 0.0 109.875 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -80.12 -35.63 36.48 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.314 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.29 58.27 7.45 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.401 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -116.99 -76.49 0.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.644 0.259 . . . . 0.0 110.988 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.51 -170.68 3.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.052 0.453 . . . . 0.0 111.684 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.417 ' CG1' ' HD2' ' A' ' 65' ' ' PRO . 61.7 t -148.21 139.79 13.99 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.849 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.417 ' HD2' ' CG1' ' A' ' 64' ' ' VAL . 17.9 Cg_endo -58.02 -160.66 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.466 2.111 . . . . 0.0 112.145 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 61.2 m80 60.7 35.95 19.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.836 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.946 -179.924 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.681 0.277 . . . . 0.0 111.177 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 71.56 8.68 6.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.611 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 12.69 2.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 111.185 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -81.08 -20.24 41.95 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.834 0.35 . . . . 0.0 111.227 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mt -96.9 -17.45 20.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.356 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -48.05 -54.04 14.4 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.178 0.513 . . . . 0.0 111.54 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.1 p -53.66 -25.46 11.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.363 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 t -77.15 -29.84 54.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.61 -30.84 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.438 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.3 t -50.26 -31.24 13.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.994 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.36 -29.78 14.27 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.333 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.453 ' CD1' ' CZ ' ' A' ' 47' ' ' TYR . 4.3 mp -76.32 -67.54 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.975 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.11 -77.26 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.308 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -51.78 -59.27 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.183 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.88 28.77 7.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.381 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.36 -78.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.09 0.471 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.14 153.98 1.63 Allowed Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.867 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.62 -177.92 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 0.0 112.233 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -174.76 135.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.23 -26.73 56.7 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.502 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.05 -48.02 79.56 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.5 t -54.22 -29.35 46.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.57 -55.88 7.8 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.65 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.39 -31.07 59.41 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.413 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -70.36 -66.21 0.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.074 0.464 . . . . 0.0 111.02 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.512 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 3.8 pp -52.98 -25.76 13.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.573 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -44.59 88.12 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.91 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.63 -26.1 12.65 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.318 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.512 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 0.6 OUTLIER -81.41 -71.31 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.89 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.466 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 51.66 17.97 0.66 Allowed 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.685 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 177.74 28.57 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.96 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.431 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.2 t -137.53 -34.81 0.68 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 120.993 0.425 . . . . 0.0 111.499 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.466 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -51.65 -50.45 60.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.424 0.631 . . . . 0.0 111.346 -179.205 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -41.77 63.72 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.968 -1.015 . . . . 0.0 111.203 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.431 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 28.6 mt-30 -54.72 -29.68 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.282 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -79.44 -22.67 43.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.65 -19.24 15.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.911 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 8.95 26.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.399 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -80.04 131.02 64.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.657 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.66 -59.12 0.15 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.506 2.137 . . . . 0.0 112.812 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -27.32 27.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.344 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -97.66 15.54 23.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.257 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -34.56 87.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.615 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.57 -26.63 61.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.453 ' CZ ' ' CD1' ' A' ' 14' ' ' ILE . 9.0 t80 -75.17 -46.44 34.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.8 mm -70.27 -36.94 69.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.586 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -80.84 24.39 0.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.44 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.18 153.67 71.93 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.481 179.081 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.428 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 12.7 Cg_endo -81.17 -42.55 0.12 Allowed 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.363 2.042 . . . . 0.0 112.053 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.73 -18.11 48.83 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.761 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.44 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -57.42 -53.52 57.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.288 0.565 . . . . 0.0 111.374 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.67 -33.57 70.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.167 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -69.71 -41.71 74.98 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.701 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -60.4 -48.88 79.84 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.868 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.42 -48.12 82.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.883 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.3 m -61.28 -43.53 98.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.456 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.93 -31.72 29.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.526 0.679 . . . . 0.0 109.83 178.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . 0.401 ' HB3' ' CD2' ' A' ' 62' ' ' LEU . 0.5 OUTLIER -78.66 -33.7 46.91 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.379 179.387 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.11 57.58 6.81 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.603 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.405 ' CD2' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -119.04 -80.85 0.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 110.651 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.54 167.96 25.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.402 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.411 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.3 p -109.85 137.37 20.43 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.987 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.411 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 32.9 Cg_endo -62.92 -163.26 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.363 2.042 . . . . 0.0 112.118 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 78.4 m80 56.42 35.32 25.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.869 -179.938 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.746 0.307 . . . . 0.0 111.0 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 70.48 22.26 5.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.85 -19.83 6.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.43 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -75.29 -6.93 52.38 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.584 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mt -116.14 -20.32 9.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.569 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.19 -50.48 37.91 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.172 0.511 . . . . 0.0 111.392 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.4 p -57.21 -22.83 17.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.39 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -81.79 -33.32 30.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.63 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.05 -29.02 0.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.426 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.95 -45.56 74.92 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.893 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.24 -28.09 42.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.336 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.435 HG22 ' CG ' ' A' ' 47' ' ' TYR . 2.0 mp -70.21 -63.21 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.75 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mt -69.85 -75.02 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.326 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.03 -64.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.227 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.94 32.83 6.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.303 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -53.68 39.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.208 0.528 . . . . 0.0 111.167 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.52 157.85 0.61 Allowed Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.767 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.28 -179.2 2.54 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.498 2.132 . . . . 0.0 112.155 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.94 129.76 3.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.921 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.12 -28.94 59.08 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.457 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -54.92 -47.18 74.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.925 0.393 . . . . 0.0 110.948 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.3 t -54.6 -30.21 54.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.015 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.7 t -76.72 -36.31 57.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.524 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.08 -32.01 37.11 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.611 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -65.87 -61.01 2.3 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.993 0.425 . . . . 0.0 111.026 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.402 ' CD1' ' CD2' ' A' ' 62' ' ' LEU . 3.9 pp -50.59 -27.41 6.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.508 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -44.16 67.7 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.704 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.51 -23.83 28.33 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.087 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -81.08 -71.73 0.46 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.65 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . 0.465 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 49.86 19.06 0.4 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.904 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 179.14 27.8 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.177 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.443 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.3 t -137.4 -34.58 0.7 Allowed 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.916 0.388 . . . . 0.0 111.702 -179.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.465 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 1.5 p90 -53.18 -52.28 59.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.389 0.614 . . . . 0.0 111.369 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -51.61 -38.94 56.92 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.233 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.443 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 29.3 mt-30 -56.43 -28.27 58.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.264 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -77.14 -28.2 54.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.006 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.62 -24.51 8.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.542 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.77 -23.73 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.175 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -57.94 109.27 1.67 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.036 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -83.79 97.95 0.78 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.699 2.266 . . . . 0.0 112.361 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.96 -45.39 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.816 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -90.1 -62.62 1.42 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.836 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.65 -58.29 3.8 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.777 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -69.57 -13.57 62.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.614 0.245 . . . . 0.0 111.233 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.435 ' CG ' HG22 ' A' ' 14' ' ' ILE . 2.7 t80 -80.07 -55.65 4.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.824 0.345 . . . . 0.0 111.119 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 37.8 mm -66.76 -55.8 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.348 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.64 30.55 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 111.676 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.438 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.71 160.53 66.58 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.701 179.41 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.405 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 11.1 Cg_endo -81.05 -44.2 0.1 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.466 2.111 . . . . 0.0 111.917 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.81 -24.53 38.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.705 -179.283 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.438 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -55.7 -50.21 70.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.204 0.526 . . . . 0.0 111.347 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.1 mtm180 -56.79 -32.49 65.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.219 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -68.02 -40.06 83.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -58.76 -50.92 72.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.876 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.47 -48.81 76.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.6 m -63.14 -41.05 99.23 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.442 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.2 t -52.93 -36.15 59.42 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.396 0.617 . . . . 0.0 109.918 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -32.18 37.69 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.104 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.66 53.48 31.23 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.846 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.402 ' CD2' ' CD1' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -112.25 -78.84 0.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.806 0.336 . . . . 0.0 110.786 179.239 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.65 -164.28 1.98 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.436 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.464 ' CG1' ' HD2' ' A' ' 65' ' ' PRO . 33.7 t -137.1 139.19 27.62 Favored Pre-proline 0 N--CA 1.452 -0.373 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.813 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . 0.464 ' HD2' ' CG1' ' A' ' 64' ' ' VAL . 17.9 Cg_endo -56.69 -160.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.54 2.16 . . . . 0.0 112.305 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m80 67.49 43.4 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.012 -179.936 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.842 0.353 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -88.2 11.83 15.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.751 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.7 m -109.78 -23.25 11.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.1 -11.18 60.63 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.228 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mt -108.59 -17.92 13.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.455 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.38 -35.53 19.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.086 0.469 . . . . 0.0 111.236 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.1 p -65.05 -24.42 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.281 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.08 -32.07 26.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.435 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.89 -30.08 0.64 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -53.13 -38.44 62.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.691 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.38 -40.01 21.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.19 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ILE . . . . . 0.457 HG12 ' CE1' ' A' ' 47' ' ' TYR . 4.4 mp -66.18 -58.69 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.878 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -53.68 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.463 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 t -70.69 -79.64 0.06 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.19 43.14 0.13 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.445 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.95 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 111.075 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 141.79 0.73 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.889 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.01 -179.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.459 2.106 . . . . 0.0 112.297 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.22 139.64 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.96 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.76 -25.22 55.52 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -55.25 -48.52 73.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 120.938 0.399 . . . . 0.0 110.965 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.9 t -57.15 -35.97 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.068 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 69.7 m -65.11 -40.49 94.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.912 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.53 -42.52 98.88 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.748 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -65.09 -61.26 2.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.03 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.505 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 4.6 pp -51.3 -25.8 6.42 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.45 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -56.16 25.46 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.305 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.55 -25.88 3.07 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.149 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . 0.505 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 1.4 mt-30 -81.75 -71.9 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.789 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.01 20.66 0.12 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.518 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.21 -81.02 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.9 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' CYS . . . . . 0.522 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.7 t -58.94 -37.92 77.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.189 0.519 . . . . 0.0 110.54 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CD1' ' C ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -50.08 -41.68 48.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.152 178.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.8 t -75.78 -33.01 60.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.605 178.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLN . . . . . 0.522 HE21 ' HA ' ' A' ' 34' ' ' CYS . 28.1 mt-30 -62.46 -32.64 73.54 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.905 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -59.18 -19.96 49.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -51.32 -25.11 5.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.8 0.333 . . . . 0.0 111.683 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.61 -22.33 12.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -59.63 114.43 9.5 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.792 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.43 3.32 7.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.547 2.165 . . . . 0.0 113.071 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 41.0 p -51.2 -41.13 60.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.819 0.342 . . . . 0.0 111.075 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -105.75 -62.2 1.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.762 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.47 -59.45 4.38 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -70.54 -20.57 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.717 0.294 . . . . 0.0 111.138 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' TYR . . . . . 0.457 ' CE1' HG12 ' A' ' 14' ' ' ILE . 7.2 t80 -74.82 -49.91 19.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.937 0.399 . . . . 0.0 110.865 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.8 mm -68.25 -53.22 30.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.264 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.2 mtt180 -80.64 30.56 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 111.797 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . 0.414 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -80.72 147.59 63.14 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.757 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.3 -42.06 2.16 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.377 2.051 . . . . 0.0 112.281 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -80.15 -18.93 48.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.376 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.414 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -59.08 -55.72 31.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.218 0.533 . . . . 0.0 111.293 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -57.25 -33.9 68.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.124 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -66.7 -49.38 66.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.754 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.42 -48.23 82.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.515 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -48.14 80.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.674 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.9 m -61.66 -42.77 99.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.543 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.7 t -51.35 -37.55 48.53 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.48 0.657 . . . . 0.0 109.694 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.57 -39.22 28.04 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.192 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 59.5 49.97 72.82 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.482 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . 0.444 ' CD1' ' N ' ' A' ' 63' ' ' ALA . 1.7 pp -115.36 -40.88 3.35 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . 0.444 ' N ' ' CD1' ' A' ' 62' ' ' LEU . . . -150.78 175.01 12.39 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.02 0.438 . . . . 0.0 111.628 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.412 HG13 ' CD2' ' A' ' 66' ' ' HIS . 0.4 OUTLIER -146.44 148.14 33.2 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.755 179.917 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.9 33.05 0.39 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.196 2.598 . . . . 0.0 113.287 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.412 ' CD2' HG13 ' A' ' 64' ' ' VAL . 87.0 m-70 -128.63 29.72 5.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.682 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.3 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.916 -179.904 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.857 0.36 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 3.5 m 59.94 93.88 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.77 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -79.82 -42.25 24.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.022 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.19 32.52 20.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.871 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -149.17 -36.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.31 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.26 -14.83 62.57 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.858 0.361 . . . . 0.0 111.166 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -108.57 -20.23 13.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 -179.431 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.87 -43.78 28.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.115 0.483 . . . . 0.0 111.486 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.6 p -56.45 -25.23 20.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.193 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -88.54 -30.78 19.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.61 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.2 -30.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.37 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.1 m -55.04 -35.38 64.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.783 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.41 -43.3 14.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.303 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.411 ' CG2' ' HA ' ' A' ' 47' ' ' TYR . 4.1 mp -60.9 -53.42 49.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 26.9 mt -73.7 -80.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 t -60.22 -75.32 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.946 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.5 37.34 0.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.591 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.22 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.128 0.489 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.99 138.01 3.15 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.831 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.71 -171.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.447 2.098 . . . . 0.0 112.321 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 m -174.39 140.99 0.67 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.82 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.43 -44.22 93.57 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.582 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -48.81 -36.31 16.46 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 120.905 0.383 . . . . 0.0 111.059 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.1 t -53.7 -63.29 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.291 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.418 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 12.2 p -53.48 -25.21 15.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.272 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.47 -38.01 18.83 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -56.5 -50.32 72.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.13 0.49 . . . . 0.0 111.613 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.474 ' CD1' ' CE2' ' A' ' 35' ' ' PHE . 3.9 pp -51.36 -37.86 50.22 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.337 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 34.5 mmm-85 -54.24 -47.14 72.54 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.395 -179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.46 -28.44 13.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.304 0.573 . . . . 0.0 109.592 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -81.93 -74.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.454 178.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 49.01 19.62 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.615 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -130.08 -82.45 0.28 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.517 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.8 t -61.4 -34.62 75.67 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.417 0.627 . . . . 0.0 110.181 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.474 ' CE2' ' CD1' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -56.31 -37.16 69.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.464 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.22 -51.28 21.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.067 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.517 HE21 ' HA ' ' A' ' 34' ' ' CYS . 5.1 pt20 -70.59 -23.07 62.51 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.219 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.55 -22.49 13.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.742 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.86 -19.55 12.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.758 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -94.65 -23.17 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 111.016 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -57.39 116.32 13.46 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.772 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.67 -44.23 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.523 2.149 . . . . 0.0 112.722 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 p -51.2 -41.84 60.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.228 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -95.77 15.14 20.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.197 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.65 -27.91 62.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.575 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.6 -25.84 62.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.776 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.411 ' HA ' ' CG2' ' A' ' 14' ' ' ILE . 9.3 t80 -75.22 -51.76 12.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.0 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 29.5 mt -69.72 -42.68 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.545 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.82 27.97 0.36 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.427 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.83 164.56 50.39 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.447 179.153 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -81.01 -46.95 0.08 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.443 2.095 . . . . 0.0 111.826 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.513 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -80.89 -17.75 49.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.701 -179.303 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.427 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -61.49 -58.96 6.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.178 0.513 . . . . 0.0 111.445 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -57.96 -32.26 67.66 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.067 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -66.27 -44.79 82.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.933 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -60.24 -51.57 68.97 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.847 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.411 HD22 ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -63.8 -44.6 92.84 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.154 0.502 . . . . 0.0 110.787 179.879 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.3 m -63.58 -41.86 98.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.572 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.4 t -51.45 -38.62 54.63 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.534 0.683 . . . . 0.0 109.592 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.64 -40.63 25.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.362 178.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.19 54.91 31.07 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.104 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.443 HD11 ' CD1' ' A' ' 28' ' ' LEU . 0.2 OUTLIER -109.78 -60.03 1.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.398 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.77 132.6 15.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 111.602 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.438 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 9.9 p -109.91 137.73 20.55 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.438 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 19.4 Cg_endo -57.19 -160.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.485 2.123 . . . . 0.0 112.246 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 m80 61.97 31.91 17.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.764 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.873 179.979 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' PGM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.772 0.32 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t -148.49 72.53 1.2 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.919 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -68.41 -34.25 75.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.845 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.55 19.19 9.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.347 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.21 -24.93 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.359 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -69.86 -16.59 63.28 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.182 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.1 mt -99.99 -24.88 14.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.218 -179.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.07 -38.09 23.25 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.092 0.473 . . . . 0.0 111.329 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.1 p -60.86 -25.93 37.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.165 179.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.65 -32.69 25.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.97 -29.24 0.55 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.458 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 71.2 m -53.07 -43.38 66.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.847 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.83 -25.78 34.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.311 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.438 HG22 ' CD2' ' A' ' 47' ' ' TYR . 2.4 mp -68.7 -62.01 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.771 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -74.06 -79.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.208 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -62.62 1.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.062 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.5 36.45 4.33 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.432 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.584 ' O ' ' HG3' ' A' ' 19' ' ' LYS . . . -57.63 -79.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.899 0.38 . . . . 0.0 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.584 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -158.95 145.9 12.91 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.558 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.08 -174.69 0.81 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.457 2.105 . . . . 0.0 112.201 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.7 p -173.41 138.57 0.71 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.03 -27.67 60.06 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -53.15 -43.09 66.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.895 0.378 . . . . 0.0 111.081 -179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 47.7 t -55.67 -23.51 28.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.393 -179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 87.6 m -78.02 -45.58 23.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.846 179.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.95 -35.28 58.14 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -62.67 -60.22 3.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.185 0.517 . . . . 0.0 110.915 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.502 ' CD1' ' CE2' ' A' ' 35' ' ' PHE . 1.2 pp -54.47 -31.35 55.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.675 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.406 ' HD2' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -59.69 -47.47 85.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.216 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.16 -25.82 3.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.564 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.36 -72.66 0.42 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 179.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.3 20.68 0.16 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.588 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.97 -80.49 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.919 -0.657 . . . . 0.0 112.195 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.514 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.6 t -59.52 -36.22 75.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.408 0.623 . . . . 0.0 110.416 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.502 ' CE2' ' CD1' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -57.18 -43.96 83.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.441 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.93 -33.94 77.22 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.504 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.514 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 28.3 mt-30 -59.03 -35.01 72.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.383 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.85 -15.4 54.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.334 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -47.99 -28.93 3.03 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.938 0.399 . . . . 0.0 111.519 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -118.79 -27.99 5.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.233 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.0 t0 -60.15 107.51 1.06 Allowed Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.853 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -82.09 38.16 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.917 2.411 . . . . 0.0 112.744 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 16.4 p -67.58 -38.13 83.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.902 0.382 . . . . 0.0 110.736 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -98.31 -55.09 2.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.38 -56.63 5.06 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.622 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -75.7 -21.14 57.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.704 0.288 . . . . 0.0 111.196 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.438 ' CD2' HG22 ' A' ' 14' ' ' ILE . 3.4 t80 -80.02 -51.72 8.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.256 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.9 mm -65.15 -59.24 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.185 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -80.45 31.06 0.28 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.867 0.365 . . . . 0.0 111.541 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.461 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -80.77 147.51 62.72 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 179.548 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -80.12 -42.01 0.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.563 2.176 . . . . 0.0 112.692 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -80.25 -30.23 38.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.834 -179.261 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.461 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -59.25 -54.92 41.32 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.262 0.553 . . . . 0.0 111.466 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -54.73 -35.78 64.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.09 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -68.79 -42.0 77.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.545 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -61.0 -50.85 71.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.95 -46.56 87.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.195 0.521 . . . . 0.0 110.631 179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.5 m -62.14 -42.49 99.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.719 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -51.74 -39.52 58.61 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.434 0.635 . . . . 0.0 109.762 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.67 -34.87 34.44 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.565 179.14 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 56.06 46.59 84.49 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.478 -0.868 . . . . 0.0 111.888 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.49 ' CD1' ' N ' ' A' ' 63' ' ' ALA . 3.5 pp -109.9 -40.88 4.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.592 0.234 . . . . 0.0 111.502 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.49 ' N ' ' CD1' ' A' ' 62' ' ' LEU . . . -150.43 159.08 44.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.016 0.436 . . . . 0.0 111.643 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.425 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 0.5 OUTLIER -150.16 161.69 30.13 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.396 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.425 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 65.7 Cg_endo -77.74 31.71 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.012 2.475 . . . . 0.0 113.343 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -132.79 43.17 3.0 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.725 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 23.1 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.977 -179.913 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' PGM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.822 0.344 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.1 m -110.78 -57.02 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -156.64 -56.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 61.94 31.98 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.061 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 m -122.2 -39.78 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -76.55 -5.07 46.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.477 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.8 mt -114.37 -19.36 11.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.46 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.41 -52.81 15.72 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.175 0.512 . . . . 0.0 111.424 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.3 p -57.35 -22.49 17.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.369 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -88.56 -32.49 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.495 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.03 -30.02 0.68 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.39 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -53.37 -43.64 67.97 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.5 -32.96 48.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.073 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.43 HG12 ' CE2' ' A' ' 47' ' ' TYR . 3.6 mp -70.66 -62.48 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.889 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -68.11 -77.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.228 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.01 -70.2 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.172 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.25 27.22 4.29 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.477 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -77.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.142 0.496 . . . . 0.0 111.103 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.29 143.52 1.56 Allowed Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.858 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.64 -170.8 0.56 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.522 2.148 . . . . 0.0 112.37 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.32 -162.61 0.54 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.423 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -102.5 -27.48 6.78 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.467 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -56.85 -50.01 73.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.843 0.354 . . . . 0.0 110.966 -179.793 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 43.3 t -52.36 -27.87 17.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.163 -179.824 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.427 ' O ' ' HB2' ' A' ' 29' ' ' ARG . 60.9 m -67.92 -61.0 2.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.768 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.1 -29.7 56.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.8 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -70.6 -67.67 0.48 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.073 0.463 . . . . 0.0 110.918 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.477 HD12 ' CD1' ' A' ' 62' ' ' LEU . 3.9 pp -56.26 -28.1 57.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.587 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 0.0 OUTLIER -61.75 -47.26 86.0 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 121.166 0.507 . . . . 0.0 110.41 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.25 -24.23 10.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.265 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 12.3 mt-30 -81.07 -71.86 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.639 179.319 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.423 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 48.28 20.03 0.25 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.602 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.7 -81.73 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -59.14 -36.01 74.48 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.391 0.615 . . . . 0.0 110.112 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.417 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -63.71 -40.15 96.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.171 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.88 -55.7 13.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.546 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.5 pp0? -62.81 -24.87 67.97 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.707 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -23.17 14.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.586 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.49 -21.69 17.64 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.687 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.55 15.75 18.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.02 114.04 43.29 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.29 -21.25 13.69 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.529 2.153 . . . . 0.0 112.749 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.78 68.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.722 0.296 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -89.71 -75.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.488 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.02 -55.02 3.09 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.189 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.34 -24.22 65.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 111.005 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.43 ' CE2' HG12 ' A' ' 14' ' ' ILE . 8.1 t80 -76.44 -53.49 8.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.788 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.433 HD13 HG23 ' A' ' 48' ' ' ILE . 36.6 mm -69.56 -51.29 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.209 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -80.67 31.0 0.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.842 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.405 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.74 148.41 65.22 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.638 179.352 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.32 -44.35 4.91 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.251 1.968 . . . . 0.0 112.01 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -80.22 -17.82 51.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.382 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.405 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -55.37 -50.89 68.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.219 0.533 . . . . 0.0 111.273 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -54.86 -47.49 74.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.1 -179.833 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.11 -41.57 90.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.598 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.5 m -57.51 -37.26 72.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.641 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.0 -59.39 5.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -59.46 -44.03 93.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.03 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.0 t -52.4 -29.83 26.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.625 0.726 . . . . 0.0 109.363 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -39.1 63.13 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.901 179.203 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.92 55.66 6.29 Favored Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.843 -0.694 . . . . 0.0 113.387 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.477 ' CD1' HD12 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -134.13 -92.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.789 0.295 . . . . 0.0 111.019 179.109 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.32 178.8 8.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 120.868 0.366 . . . . 0.0 111.388 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.438 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 0.3 OUTLIER -109.9 147.45 36.22 Favored Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.587 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.438 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 43.1 Cg_endo -81.83 32.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.966 2.444 . . . . 0.0 113.8 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.434 ' HB2' HG13 ' A' ' 64' ' ' VAL . 45.7 m80 -103.13 32.28 3.83 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.713 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.951 -179.946 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' PGM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.791 0.329 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.3 m 59.99 99.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.877 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -36.31 83.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 58.16 23.11 9.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.282 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -123.61 -34.68 3.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.105 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -86.86 48.45 1.65 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.223 -179.722 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 49.3 mt -151.99 -39.94 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.341 -179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -45.97 -44.31 14.81 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.089 0.471 . . . . 0.0 111.667 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 p -55.62 -24.65 16.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.226 179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 t -81.38 -30.31 33.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.41 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.18 -30.48 0.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.351 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -51.47 -34.79 37.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.726 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.33 -31.71 17.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.123 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.421 HG12 ' CE2' ' A' ' 47' ' ' TYR . 4.0 mp -74.26 -65.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.16 -74.38 0.11 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.219 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -69.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.138 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.71 25.55 5.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.56 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -77.06 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.177 0.513 . . . . 0.0 111.033 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.6 157.59 3.62 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.828 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 29.9 Cg_endo -63.5 -167.03 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.571 2.181 . . . . 0.0 112.202 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.71 144.63 0.84 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.824 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.54 -26.74 62.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.585 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -59.94 -56.29 23.5 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.93 0.395 . . . . 0.0 110.817 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -55.39 -26.05 39.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.168 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.53 -48.49 72.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.855 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.99 -25.08 60.53 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.725 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.77 -62.74 1.39 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.129 0.49 . . . . 0.0 110.972 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.474 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 2.8 pp -54.76 -24.87 24.47 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.588 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.45 ' HD2' ' CD1' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -64.34 -52.44 58.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.19 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.75 -25.39 2.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.477 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.474 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -81.41 -71.6 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.914 179.416 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.415 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 48.76 19.25 0.24 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.694 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.0 -81.87 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.72 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.566 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.7 t -60.7 -33.78 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.43 0.633 . . . . 0.0 110.253 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.441 ' CD1' ' N ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -55.54 -45.75 77.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.671 179.611 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.441 ' N ' ' CD1' ' A' ' 35' ' ' PHE . 4.7 t -64.43 -56.3 15.17 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.937 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.566 HE21 ' HA ' ' A' ' 34' ' ' CYS . 15.3 pt20 -66.05 -23.15 66.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.28 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -18.53 31.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.409 ' HA ' HG13 ' A' ' 48' ' ' ILE . . . -51.51 -22.95 3.52 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.284 -0.416 . . . . 0.0 112.031 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -97.53 -24.26 15.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.499 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -57.44 109.1 1.51 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 -179.836 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -88.62 -10.07 4.59 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.822 2.348 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.7 -27.77 12.77 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -67.3 -58.92 3.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.897 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.27 80.83 0.74 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.68 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.08 22.46 9.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 0.0 110.865 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.421 ' CE2' HG12 ' A' ' 14' ' ' ILE . 8.4 t80 -65.74 -54.66 24.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.94 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.409 HG13 ' HA ' ' A' ' 39' ' ' ALA . 20.8 mm -71.08 -37.27 66.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.576 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -80.81 25.08 0.46 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.445 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.03 155.79 72.42 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.66 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.431 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 13.1 Cg_endo -81.01 -40.55 0.17 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.365 2.043 . . . . 0.0 111.968 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.489 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.69 -30.83 36.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.593 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.445 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -53.6 -42.02 67.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -65.88 -30.39 70.99 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.785 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.31 -40.1 74.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.707 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.3 m -58.06 -49.04 78.27 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.918 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.14 -50.79 72.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.067 0.461 . . . . 0.0 110.886 179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.7 m -60.8 -44.55 96.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.336 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -50.67 -31.28 15.85 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.55 0.69 . . . . 0.0 109.705 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -76.25 -38.99 55.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.226 179.315 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.61 54.62 5.9 Favored Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.688 -0.768 . . . . 0.0 113.113 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.444 ' CD1' ' NE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -123.48 -81.0 0.63 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.798 0.332 . . . . 0.0 110.662 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.63 168.45 24.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.503 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.423 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.8 p -109.93 137.94 20.61 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.804 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.423 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 18.7 Cg_endo -57.73 -160.57 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.34 2.026 . . . . 0.0 112.095 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.3 m80 61.55 31.24 18.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.704 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.026 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.91 179.996 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' PGM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.811 0.339 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.4 p -85.12 62.53 7.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.868 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.62 153.2 40.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.959 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.36 -27.33 68.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.303 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -27.91 44.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.107 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -70.38 -12.82 61.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.17 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -109.58 -19.09 13.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.245 -179.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.0 -60.98 2.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.175 0.512 . . . . 0.0 111.501 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 8.5 p -51.53 -26.32 6.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.322 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -72.09 -31.81 66.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.533 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.404 ' N ' ' OH ' ' A' ' 47' ' ' TYR . . . -44.61 -28.78 0.64 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.12 -32.03 9.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.997 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -96.04 -34.52 11.72 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.313 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.42 HG12 ' CE2' ' A' ' 47' ' ' TYR . 5.2 mp -74.74 -59.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.067 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 93.2 mt -74.61 -74.31 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.211 -179.743 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.9 -54.79 21.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.315 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.06 22.2 25.88 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.526 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.89 -77.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.143 0.497 . . . . 0.0 111.115 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.99 163.95 8.82 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.841 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.44 -164.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.648 2.232 . . . . 0.0 112.42 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -172.41 136.92 0.82 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.13 -35.18 90.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.538 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -56.78 -50.55 71.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.883 0.373 . . . . 0.0 110.939 -179.818 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.7 t -56.95 -26.59 59.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.126 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.9 -51.81 36.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.711 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.87 -39.51 95.57 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.473 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -59.16 -56.76 18.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.288 0.566 . . . . 0.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.538 HD23 ' CD1' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -48.66 -30.87 5.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.386 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . 0.48 ' HA ' ' NE2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -66.31 -53.78 32.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.494 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.93 -25.15 2.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.061 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.416 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 1.9 mt-30 -81.09 -71.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.54 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.48 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 46.39 21.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.754 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 175.52 28.73 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.5 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.504 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.3 t -135.1 -37.08 0.8 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.998 0.427 . . . . 0.0 111.7 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.538 ' CD1' HD23 ' A' ' 28' ' ' LEU . 17.0 p90 -57.57 -58.29 8.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.403 0.621 . . . . 0.0 111.15 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.3 t -48.12 -33.65 8.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.504 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 29.5 mt-30 -54.54 -34.18 61.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 111.127 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 83.2 m-85 -66.19 -21.17 66.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.968 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . 0.409 ' HA ' ' CD1' ' A' ' 48' ' ' ILE . . . -56.23 -21.7 25.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.728 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.2 -21.07 14.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.23 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -70.83 127.21 92.02 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.802 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.47 -42.62 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.48 2.12 . . . . 0.0 112.525 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -40.11 76.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.964 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -95.18 15.65 18.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.239 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.57 -25.08 76.27 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.642 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -71.36 -27.76 63.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.913 0.387 . . . . 0.0 110.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.42 ' CE2' HG12 ' A' ' 14' ' ' ILE . 9.2 t80 -73.38 -46.11 50.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.99 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.409 ' CD1' ' HA ' ' A' ' 39' ' ' ALA . 26.9 mt -71.37 -30.46 39.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.651 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -80.73 22.88 0.56 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.432 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -81.15 149.93 67.15 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.611 179.103 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.55 -44.62 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.322 2.015 . . . . 0.0 112.193 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 13.0 m-70 -80.36 -16.77 53.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.621 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.432 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -54.47 -48.89 71.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.204 0.526 . . . . 0.0 111.449 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 43.6 mtm180 -58.6 -38.39 77.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.281 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -67.07 -42.21 85.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.791 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.02 -47.47 85.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.969 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.28 -49.85 75.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.978 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -62.02 -42.71 99.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.524 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -52.4 -33.98 46.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.487 0.661 . . . . 0.0 109.952 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.17 -33.46 38.32 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.385 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.54 55.73 16.5 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.549 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -113.87 -83.57 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 179.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.74 159.63 44.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.239 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.445 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 8.6 p -109.8 138.71 20.76 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.667 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.445 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 17.5 Cg_endo -56.42 -160.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.444 2.096 . . . . 0.0 112.151 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 30.8 m80 59.02 32.09 21.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.544 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.922 -179.811 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' PGM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.821 0.343 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 m -106.26 -67.4 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -161.71 108.04 1.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.792 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -83.03 -26.37 31.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 m -67.77 -13.06 61.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.468 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . 0.4 ' O ' ' HB3' ' A' ' 27' ' ' ASN . 0.4 OUTLIER -83.6 -31.58 26.21 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.111 0.481 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -101.79 -13.78 17.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.369 -179.574 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.36 -36.96 23.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.067 0.461 . . . . 0.0 111.295 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 p -59.05 -25.18 29.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.146 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -84.04 -37.52 22.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.4 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.432 ' HA ' ' CG2' ' A' ' 14' ' ' ILE . . . -47.84 -27.88 2.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.536 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -51.43 -29.87 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.416 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -140.58 21.27 2.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.439 ' CG2' ' N ' ' A' ' 15' ' ' LEU . 0.5 OUTLIER -80.22 -45.03 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.81 0.338 . . . . 0.0 111.253 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . 0.439 ' N ' ' CG2' ' A' ' 14' ' ' ILE . 2.2 mp -80.2 -68.07 0.71 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.1 m -79.43 -64.08 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 114.09 49.07 0.55 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.497 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.33 99.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.096 0.474 . . . . 0.0 111.216 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.97 94.92 0.21 Allowed Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.942 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -67.0 -167.26 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.438 2.092 . . . . 0.0 112.238 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -172.45 144.38 1.5 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.812 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.04 -29.1 61.89 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.604 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -48.39 -31.86 6.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.842 0.353 . . . . 0.0 111.144 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 41.3 t -53.86 -25.11 18.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.342 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.79 -50.57 14.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.677 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.63 -32.83 84.75 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.511 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . 0.4 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 34.5 m120 -66.39 -64.72 0.8 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.918 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.529 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 1.2 pp -50.76 -28.7 9.75 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.43 -42.62 74.43 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.743 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.83 -23.99 20.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.384 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.529 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -80.89 -71.56 0.46 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.536 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.502 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 48.66 19.8 0.28 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.827 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -176.62 26.6 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.163 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.563 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.5 t -135.27 -38.08 0.77 Allowed 'General case' 0 N--CA 1.443 -0.776 0 CA-C-O 120.869 0.366 . . . . 0.0 111.802 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.502 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 4.6 p90 -56.09 -53.17 60.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.495 0.664 . . . . 0.0 111.445 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 t -55.73 -49.61 72.61 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.334 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.563 HE21 ' HA ' ' A' ' 34' ' ' CYS . 23.1 pt20 -67.65 -26.23 66.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.224 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.2 -27.91 67.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.716 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.0 -20.13 15.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.805 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.05 -23.6 20.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.864 0.364 . . . . 0.0 111.23 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.66 112.1 9.42 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.042 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -89.23 105.9 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.918 2.412 . . . . 0.0 112.474 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.75 -45.27 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.059 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -75.54 -62.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 57.52 30.61 62.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.388 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -164.16 -40.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.995 -179.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.43 ' CD1' HG12 ' A' ' 14' ' ' ILE . 1.7 t80 -59.5 -54.03 51.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.935 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.3 mt -74.61 -47.83 37.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.449 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -80.76 28.46 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.884 0.373 . . . . 0.0 111.923 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.452 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -80.94 151.49 70.59 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.539 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.45 -42.48 0.89 Allowed 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.223 1.948 . . . . 0.0 112.185 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.29 -26.36 38.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.492 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.452 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -57.91 -52.47 65.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.193 0.521 . . . . 0.0 111.411 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -54.12 -32.45 55.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.229 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.9 -41.09 71.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.629 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.91 -49.12 78.94 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.67 -50.23 74.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.181 0.515 . . . . 0.0 110.872 179.857 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.4 m -60.43 -44.27 95.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.576 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.87 -32.51 32.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.484 0.659 . . . . 0.0 109.875 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -80.12 -35.63 36.48 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.314 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.29 58.27 7.45 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.401 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -116.99 -76.49 0.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.644 0.259 . . . . 0.0 110.988 179.714 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.51 -170.68 3.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.052 0.453 . . . . 0.0 111.684 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.417 ' CG1' ' HD2' ' A' ' 65' ' ' PRO . 61.7 t -148.21 139.79 13.99 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.849 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.417 ' HD2' ' CG1' ' A' ' 64' ' ' VAL . 17.9 Cg_endo -58.02 -160.66 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.466 2.111 . . . . 0.0 112.145 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 61.2 m80 60.7 35.95 19.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.836 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.946 -179.924 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' PGM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.831 0.348 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.0 m 61.37 104.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.903 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -62.35 -21.54 65.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.177 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 71.56 8.68 6.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.611 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 12.69 2.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 111.185 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -81.08 -20.24 41.95 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.834 0.35 . . . . 0.0 111.227 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.4 mt -96.9 -17.45 20.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.356 -179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -48.05 -54.04 14.4 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.178 0.513 . . . . 0.0 111.54 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 10.1 p -53.66 -25.46 11.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.363 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 t -77.15 -29.84 54.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.61 -30.84 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.438 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.3 t -50.26 -31.24 13.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.994 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.36 -29.78 14.27 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.333 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.453 ' CD1' ' CZ ' ' A' ' 47' ' ' TYR . 4.3 mp -76.32 -67.54 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.975 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.11 -77.26 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.308 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -51.78 -59.27 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.183 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.88 28.77 7.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.381 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.36 -78.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.09 0.471 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.14 153.98 1.63 Allowed Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.867 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.62 -177.92 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 0.0 112.233 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -174.76 135.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.23 -26.73 56.7 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.502 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.05 -48.02 79.56 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 53.5 t -54.22 -29.35 46.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 -179.644 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.57 -55.88 7.8 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.65 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.39 -31.07 59.41 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.413 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -70.36 -66.21 0.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.074 0.464 . . . . 0.0 111.02 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.512 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 3.8 pp -52.98 -25.76 13.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.573 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -44.59 88.12 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.91 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.63 -26.1 12.65 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.318 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.512 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 0.6 OUTLIER -81.41 -71.31 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.89 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.466 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 51.66 17.97 0.66 Allowed 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.685 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 177.74 28.57 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.96 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.431 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.2 t -137.53 -34.81 0.68 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 120.993 0.425 . . . . 0.0 111.499 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.466 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -51.65 -50.45 60.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.424 0.631 . . . . 0.0 111.346 -179.205 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -41.77 63.72 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.968 -1.015 . . . . 0.0 111.203 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.431 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 28.6 mt-30 -54.72 -29.68 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.282 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -79.44 -22.67 43.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.65 -19.24 15.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.911 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 8.95 26.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.399 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -80.04 131.02 64.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.657 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.66 -59.12 0.15 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.506 2.137 . . . . 0.0 112.812 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -27.32 27.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.344 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -97.66 15.54 23.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.257 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -34.56 87.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.615 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.57 -26.63 61.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.453 ' CZ ' ' CD1' ' A' ' 14' ' ' ILE . 9.0 t80 -75.17 -46.44 34.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.8 mm -70.27 -36.94 69.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.586 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -80.84 24.39 0.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.44 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.18 153.67 71.93 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.481 179.081 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.428 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 12.7 Cg_endo -81.17 -42.55 0.12 Allowed 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.363 2.042 . . . . 0.0 112.053 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.73 -18.11 48.83 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.761 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.44 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -57.42 -53.52 57.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.288 0.565 . . . . 0.0 111.374 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.67 -33.57 70.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.167 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -69.71 -41.71 74.98 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.701 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -60.4 -48.88 79.84 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.868 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -61.42 -48.12 82.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.883 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.3 m -61.28 -43.53 98.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.456 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.93 -31.72 29.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.526 0.679 . . . . 0.0 109.83 178.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . 0.401 ' HB3' ' CD2' ' A' ' 62' ' ' LEU . 0.5 OUTLIER -78.66 -33.7 46.91 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.379 179.387 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.11 57.58 6.81 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.603 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.405 ' CD2' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -119.04 -80.85 0.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 110.651 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.54 167.96 25.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.402 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.411 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.3 p -109.85 137.37 20.43 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.987 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.411 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 32.9 Cg_endo -62.92 -163.26 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.363 2.042 . . . . 0.0 112.118 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 78.4 m80 56.42 35.32 25.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.869 -179.938 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' PGM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.82 0.343 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -157.42 -60.59 0.09 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -161.25 -42.88 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.0 -179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 70.48 22.26 5.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.215 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.85 -19.83 6.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.43 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 12.2 mm-40 -75.29 -6.93 52.38 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.584 -179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mt -116.14 -20.32 9.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.569 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.19 -50.48 37.91 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.172 0.511 . . . . 0.0 111.392 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.4 p -57.21 -22.83 17.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.39 -179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -81.79 -33.32 30.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.63 -179.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.05 -29.02 0.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.426 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.95 -45.56 74.92 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.893 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.24 -28.09 42.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.336 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.435 HG22 ' CG ' ' A' ' 47' ' ' TYR . 2.0 mp -70.21 -63.21 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.75 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mt -69.85 -75.02 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.326 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.03 -64.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.227 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.94 32.83 6.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.303 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -53.68 39.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.208 0.528 . . . . 0.0 111.167 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.52 157.85 0.61 Allowed Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.767 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.28 -179.2 2.54 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.498 2.132 . . . . 0.0 112.155 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.94 129.76 3.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.921 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.12 -28.94 59.08 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.457 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.6 tt0 -54.92 -47.18 74.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.925 0.393 . . . . 0.0 110.948 -179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 48.3 t -54.6 -30.21 54.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.015 -179.913 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.7 t -76.72 -36.31 57.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.524 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.08 -32.01 37.11 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.611 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -65.87 -61.01 2.3 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.993 0.425 . . . . 0.0 111.026 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.402 ' CD1' ' CD2' ' A' ' 62' ' ' LEU . 3.9 pp -50.59 -27.41 6.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.508 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -44.16 67.7 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.704 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.51 -23.83 28.33 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.087 178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -81.08 -71.73 0.46 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.65 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . 0.465 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 49.86 19.06 0.4 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.904 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 179.14 27.8 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.177 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.443 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.3 t -137.4 -34.58 0.7 Allowed 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.916 0.388 . . . . 0.0 111.702 -179.28 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.465 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 1.5 p90 -53.18 -52.28 59.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.389 0.614 . . . . 0.0 111.369 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -51.61 -38.94 56.92 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.233 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.443 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 29.3 mt-30 -56.43 -28.27 58.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.264 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -77.14 -28.2 54.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.006 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -52.62 -24.51 8.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.542 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.77 -23.73 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.175 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -57.94 109.27 1.67 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.036 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -83.79 97.95 0.78 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.699 2.266 . . . . 0.0 112.361 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.96 -45.39 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.816 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -90.1 -62.62 1.42 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.836 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.65 -58.29 3.8 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.777 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -69.57 -13.57 62.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.614 0.245 . . . . 0.0 111.233 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.435 ' CG ' HG22 ' A' ' 14' ' ' ILE . 2.7 t80 -80.07 -55.65 4.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.824 0.345 . . . . 0.0 111.119 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 37.8 mm -66.76 -55.8 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.348 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.64 30.55 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 111.676 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.438 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.71 160.53 66.58 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.701 179.41 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.405 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 11.1 Cg_endo -81.05 -44.2 0.1 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.466 2.111 . . . . 0.0 111.917 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.81 -24.53 38.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.705 -179.283 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.438 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -55.7 -50.21 70.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.204 0.526 . . . . 0.0 111.347 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.1 mtm180 -56.79 -32.49 65.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.219 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -68.02 -40.06 83.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -58.76 -50.92 72.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.876 179.833 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.47 -48.81 76.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 179.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.6 m -63.14 -41.05 99.23 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.442 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.2 t -52.93 -36.15 59.42 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.396 0.617 . . . . 0.0 109.918 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -32.18 37.69 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.104 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.66 53.48 31.23 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.846 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.402 ' CD2' ' CD1' ' A' ' 28' ' ' LEU . 0.0 OUTLIER -112.25 -78.84 0.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.806 0.336 . . . . 0.0 110.786 179.239 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -150.65 -164.28 1.98 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.436 179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.464 ' CG1' ' HD2' ' A' ' 65' ' ' PRO . 33.7 t -137.1 139.19 27.62 Favored Pre-proline 0 N--CA 1.452 -0.373 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.813 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . 0.464 ' HD2' ' CG1' ' A' ' 64' ' ' VAL . 17.9 Cg_endo -56.69 -160.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.54 2.16 . . . . 0.0 112.305 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m80 67.49 43.4 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.012 -179.936 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' PGM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.808 0.337 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 96.2 m -88.29 63.5 7.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.857 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -60.85 107.58 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.868 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -88.2 11.83 15.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.751 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.7 m -109.78 -23.25 11.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.1 -11.18 60.63 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.228 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 2.2 mt -108.59 -17.92 13.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.455 -179.344 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.38 -35.53 19.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.086 0.469 . . . . 0.0 111.236 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 9.1 p -65.05 -24.42 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.281 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.08 -32.07 26.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.435 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.89 -30.08 0.64 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -53.13 -38.44 62.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.691 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.38 -40.01 21.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.19 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ILE . . . . . 0.457 HG12 ' CE1' ' A' ' 47' ' ' TYR . 4.4 mp -66.18 -58.69 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.878 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -53.68 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.463 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 t -70.69 -79.64 0.06 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.19 43.14 0.13 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.445 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.95 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 111.075 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 141.79 0.73 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.889 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_exo -52.01 -179.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.459 2.106 . . . . 0.0 112.297 -179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.22 139.64 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.96 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.76 -25.22 55.52 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -55.25 -48.52 73.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 120.938 0.399 . . . . 0.0 110.965 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.9 t -57.15 -35.97 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.068 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 69.7 m -65.11 -40.49 94.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.912 179.981 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.53 -42.52 98.88 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.748 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -65.09 -61.26 2.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.03 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.505 ' HA ' ' HG3' ' A' ' 31' ' ' GLN . 4.6 pp -51.3 -25.8 6.42 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.45 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -56.16 25.46 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.305 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.55 -25.88 3.07 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.149 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . 0.505 ' HG3' ' HA ' ' A' ' 28' ' ' LEU . 1.4 mt-30 -81.75 -71.9 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.789 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.01 20.66 0.12 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.518 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.21 -81.02 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.9 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' CYS . . . . . 0.522 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.7 t -58.94 -37.92 77.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.189 0.519 . . . . 0.0 110.54 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' PHE . . . . . 0.521 ' CD1' ' C ' ' A' ' 35' ' ' PHE . 0.0 OUTLIER -50.08 -41.68 48.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.152 178.734 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.8 t -75.78 -33.01 60.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.605 178.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLN . . . . . 0.522 HE21 ' HA ' ' A' ' 34' ' ' CYS . 28.1 mt-30 -62.46 -32.64 73.54 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.905 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -59.18 -19.96 49.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -51.32 -25.11 5.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.8 0.333 . . . . 0.0 111.683 -179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.61 -22.33 12.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 51.8 t0 -59.63 114.43 9.5 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.792 179.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.43 3.32 7.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.547 2.165 . . . . 0.0 113.071 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 41.0 p -51.2 -41.13 60.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.819 0.342 . . . . 0.0 111.075 -179.937 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -105.75 -62.2 1.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.762 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.47 -59.45 4.38 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -70.54 -20.57 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.717 0.294 . . . . 0.0 111.138 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.457 ' CE1' HG12 ' A' ' 14' ' ' ILE . 7.2 t80 -74.82 -49.91 19.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.937 0.399 . . . . 0.0 110.865 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.8 mm -68.25 -53.22 30.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.264 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.2 mtt180 -80.64 30.56 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 111.797 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . 0.414 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -80.72 147.59 63.14 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.757 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.3 -42.06 2.16 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.377 2.051 . . . . 0.0 112.281 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -80.15 -18.93 48.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.376 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.414 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -59.08 -55.72 31.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.218 0.533 . . . . 0.0 111.293 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -57.25 -33.9 68.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.124 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -66.7 -49.38 66.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.754 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.42 -48.23 82.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.515 179.539 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.94 -48.14 80.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.674 179.68 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.9 m -61.66 -42.77 99.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.543 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.7 t -51.35 -37.55 48.53 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.48 0.657 . . . . 0.0 109.694 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.57 -39.22 28.04 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.192 178.933 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 59.5 49.97 72.82 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.482 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.444 ' CD1' ' N ' ' A' ' 63' ' ' ALA . 1.7 pp -115.36 -40.88 3.35 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.444 ' N ' ' CD1' ' A' ' 62' ' ' LEU . . . -150.78 175.01 12.39 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.02 0.438 . . . . 0.0 111.628 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.412 HG13 ' CD2' ' A' ' 66' ' ' HIS . 0.4 OUTLIER -146.44 148.14 33.2 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.755 179.917 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -75.9 33.05 0.39 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.196 2.598 . . . . 0.0 113.287 -179.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.412 ' CD2' HG13 ' A' ' 64' ' ' VAL . 87.0 m-70 -128.63 29.72 5.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.682 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.3 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.916 -179.904 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' PGM . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.784 0.326 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.19 32.52 20.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.871 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -149.17 -36.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.31 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.26 -14.83 62.57 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.858 0.361 . . . . 0.0 111.166 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.805 HD21 ' OE1' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -108.57 -20.23 13.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 -179.431 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.87 -43.78 28.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.115 0.483 . . . . 0.0 111.486 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.6 p -56.45 -25.23 20.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.193 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -88.54 -30.78 19.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.61 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.2 -30.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.37 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.1 m -55.04 -35.38 64.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.783 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.41 -43.3 14.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.303 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.549 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.1 mp -60.9 -53.42 49.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 26.9 mt -73.7 -80.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 t -60.22 -75.32 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.946 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.5 37.34 0.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.591 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.22 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.128 0.489 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.99 138.01 3.15 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.831 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.71 -171.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.447 2.098 . . . . 0.0 112.321 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 m -174.39 140.99 0.67 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.82 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.43 -44.22 93.57 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.582 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -48.81 -36.31 16.46 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 120.905 0.383 . . . . 0.0 111.059 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.1 t -53.7 -63.29 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.291 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.425 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 12.2 p -53.48 -25.21 15.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.272 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.47 -38.01 18.83 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -56.5 -50.32 72.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.13 0.49 . . . . 0.0 111.613 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 1.028 HD11 HD13 ' A' ' 62' ' ' LEU . 3.9 pp -51.36 -37.86 50.22 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.337 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.512 ' HD3' HD22 ' A' ' 62' ' ' LEU . 34.5 mmm-85 -54.24 -47.14 72.54 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.395 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.46 -28.44 13.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.304 0.573 . . . . 0.0 109.592 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.805 ' OE1' HD21 ' A' ' 7' ' ' LEU . 2.7 mt-30 -81.93 -74.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.454 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 49.01 19.62 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.615 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -130.08 -82.45 0.28 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.479 ' HA ' ' CG ' ' A' ' 37' ' ' GLN . 3.8 t -61.4 -34.62 75.67 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.417 0.627 . . . . 0.0 110.181 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.974 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -56.31 -37.16 69.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.464 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.22 -51.28 21.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.067 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.479 ' CG ' ' HA ' ' A' ' 34' ' ' CYS . 0.2 OUTLIER -70.59 -23.07 62.51 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.219 -179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.55 -22.49 13.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.742 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.86 -19.55 12.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.758 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -94.65 -23.17 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 111.016 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -57.39 116.32 13.46 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.772 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.67 -44.23 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.523 2.149 . . . . 0.0 112.722 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 p -51.2 -41.84 60.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.228 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -95.77 15.14 20.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.197 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.65 -27.91 62.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.575 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.6 -25.84 62.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.776 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.549 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.3 t80 -75.22 -51.76 12.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.0 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 29.5 mt -69.72 -42.68 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.545 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.82 27.97 0.36 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.499 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.83 164.56 50.39 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.447 179.153 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -81.01 -46.95 0.08 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.443 2.095 . . . . 0.0 111.826 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.513 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -80.89 -17.75 49.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.701 -179.303 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -61.49 -58.96 6.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.178 0.513 . . . . 0.0 111.445 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -57.96 -32.26 67.66 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.067 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -66.27 -44.79 82.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.933 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -60.24 -51.57 68.97 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.847 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.472 HD21 ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -63.8 -44.6 92.84 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.154 0.502 . . . . 0.0 110.787 179.879 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.3 m -63.58 -41.86 98.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.572 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.4 t -51.45 -38.62 54.63 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.534 0.683 . . . . 0.0 109.592 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.526 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.64 -40.63 25.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.362 178.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.19 54.91 31.07 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.104 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 1.028 HD13 HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -109.78 -60.03 1.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.398 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.851 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.77 132.6 15.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 111.602 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.431 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 9.9 p -109.91 137.73 20.55 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.431 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 19.4 Cg_endo -57.19 -160.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.485 2.123 . . . . 0.0 112.246 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 m80 61.97 31.91 17.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.764 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.873 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.885 0.374 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.55 19.19 9.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.347 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.21 -24.93 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.359 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -69.86 -16.59 63.28 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.182 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.74 HD11 ' OE1' ' A' ' 31' ' ' GLN . 1.1 mt -99.99 -24.88 14.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.218 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.07 -38.09 23.25 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.092 0.473 . . . . 0.0 111.329 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.536 HG11 ' OE1' ' A' ' 23' ' ' GLU . 11.1 p -60.86 -25.93 37.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.165 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.65 -32.69 25.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HA ' HD13 ' A' ' 14' ' ' ILE . . . -43.97 -29.24 0.55 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.458 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 71.2 m -53.07 -43.38 66.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.847 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.83 -25.78 34.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.311 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 53' ' ' ALA . 2.4 mp -68.7 -62.01 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.771 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -74.06 -79.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.208 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -62.62 1.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.062 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.5 36.45 4.33 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.432 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.574 ' O ' ' HG3' ' A' ' 19' ' ' LYS . . . -57.63 -79.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.899 0.38 . . . . 0.0 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -158.95 145.9 12.91 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.558 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.08 -174.69 0.81 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.457 2.105 . . . . 0.0 112.201 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.7 p -173.41 138.57 0.71 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.03 -27.67 60.06 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.536 ' OE1' HG11 ' A' ' 9' ' ' VAL . 2.6 tt0 -53.15 -43.09 66.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.895 0.378 . . . . 0.0 111.081 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.628 ' O ' HD23 ' A' ' 28' ' ' LEU . 47.7 t -55.67 -23.51 28.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.393 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.41 ' HA ' HD21 ' A' ' 62' ' ' LEU . 87.6 m -78.02 -45.58 23.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.846 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.95 -35.28 58.14 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -62.67 -60.22 3.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.185 0.517 . . . . 0.0 110.915 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.844 HD13 ' CE2' ' A' ' 35' ' ' PHE . 1.2 pp -54.47 -31.35 55.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.675 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.612 ' HD3' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -59.69 -47.47 85.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.216 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.16 -25.82 3.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.564 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.74 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -81.36 -72.66 0.42 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.3 20.68 0.16 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.588 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.97 -80.49 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.919 -0.657 . . . . 0.0 112.195 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.6 t -59.52 -36.22 75.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.408 0.623 . . . . 0.0 110.416 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.844 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -57.18 -43.96 83.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.441 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.93 -33.94 77.22 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.504 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -59.03 -35.01 72.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.383 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.85 -15.4 54.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.334 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.551 ' HB1' ' HB2' ' A' ' 65' ' ' PRO . . . -47.99 -28.93 3.03 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.938 0.399 . . . . 0.0 111.519 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -118.79 -27.99 5.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.233 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.838 ' OD1' HG23 ' A' ' 43' ' ' THR . 19.0 t0 -60.15 107.51 1.06 Allowed Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.853 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -82.09 38.16 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.917 2.411 . . . . 0.0 112.744 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.838 HG23 ' OD1' ' A' ' 41' ' ' ASP . 16.4 p -67.58 -38.13 83.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.902 0.382 . . . . 0.0 110.736 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -98.31 -55.09 2.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.38 -56.63 5.06 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.622 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -75.7 -21.14 57.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.704 0.288 . . . . 0.0 111.196 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.459 ' CD2' HG21 ' A' ' 14' ' ' ILE . 3.4 t80 -80.02 -51.72 8.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.256 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.9 mm -65.15 -59.24 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.185 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -80.45 31.06 0.28 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.867 0.365 . . . . 0.0 111.541 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.547 ' HB3' ' HB3' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -80.77 147.51 62.72 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 179.548 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -80.12 -42.01 0.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.563 2.176 . . . . 0.0 112.692 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -80.25 -30.23 38.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.834 -179.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.547 ' HB3' ' HB3' ' A' ' 50' ' ' SER . . . -59.25 -54.92 41.32 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.262 0.553 . . . . 0.0 111.466 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -54.73 -35.78 64.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.09 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -68.79 -42.0 77.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.545 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -61.0 -50.85 71.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -62.95 -46.56 87.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.195 0.521 . . . . 0.0 110.631 179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.5 m -62.14 -42.49 99.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.719 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -51.74 -39.52 58.61 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.434 0.635 . . . . 0.0 109.762 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.784 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.67 -34.87 34.44 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.565 179.14 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 56.06 46.59 84.49 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.478 -0.868 . . . . 0.0 111.888 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.968 HD12 ' N ' ' A' ' 63' ' ' ALA . 3.5 pp -109.9 -40.88 4.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.592 0.234 . . . . 0.0 111.502 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.968 ' N ' HD12 ' A' ' 62' ' ' LEU . . . -150.43 159.08 44.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.016 0.436 . . . . 0.0 111.643 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.786 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.5 OUTLIER -150.16 161.69 30.13 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.396 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.786 ' HD2' HG22 ' A' ' 64' ' ' VAL . 65.7 Cg_endo -77.74 31.71 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.012 2.475 . . . . 0.0 113.343 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -132.79 43.17 3.0 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.725 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 23.1 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.977 -179.913 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.836 0.35 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 61.94 31.98 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.061 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 m -122.2 -39.78 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -76.55 -5.07 46.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.477 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.918 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.8 mt -114.37 -19.36 11.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.46 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.41 -52.81 15.72 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.175 0.512 . . . . 0.0 111.424 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.553 HG21 ' OE1' ' A' ' 23' ' ' GLU . 10.3 p -57.35 -22.49 17.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.369 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -88.56 -32.49 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.495 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.03 -30.02 0.68 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.39 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -53.37 -43.64 67.97 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.5 -32.96 48.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.073 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.791 HD13 ' OH ' ' A' ' 47' ' ' TYR . 3.6 mp -70.66 -62.48 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.889 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -68.11 -77.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.228 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.01 -70.2 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.172 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.25 27.22 4.29 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.477 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -77.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.142 0.496 . . . . 0.0 111.103 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.29 143.52 1.56 Allowed Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.858 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.64 -170.8 0.56 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.522 2.148 . . . . 0.0 112.37 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.32 -162.61 0.54 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.423 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -102.5 -27.48 6.78 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.467 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.553 ' OE1' HG21 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -56.85 -50.01 73.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.843 0.354 . . . . 0.0 110.966 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.539 ' SG ' HD23 ' A' ' 28' ' ' LEU . 43.3 t -52.36 -27.87 17.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.163 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 29' ' ' ARG . 60.9 m -67.92 -61.0 2.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.768 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.1 -29.7 56.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.8 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -70.6 -67.67 0.48 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.073 0.463 . . . . 0.0 110.918 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.721 HD11 HD13 ' A' ' 62' ' ' LEU . 3.9 pp -56.26 -28.1 57.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.587 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.761 ' HD3' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.75 -47.26 86.0 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 121.166 0.507 . . . . 0.0 110.41 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.25 -24.23 10.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.265 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.918 ' OE1' HD21 ' A' ' 7' ' ' LEU . 12.3 mt-30 -81.07 -71.86 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.639 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.28 20.03 0.25 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.602 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.7 -81.73 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -59.14 -36.01 74.48 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.391 0.615 . . . . 0.0 110.112 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.652 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -63.71 -40.15 96.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.171 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.88 -55.7 13.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.546 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.5 pp0? -62.81 -24.87 67.97 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.707 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -23.17 14.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.586 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 65' ' ' PRO . . . -55.49 -21.69 17.64 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.687 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.55 15.75 18.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.02 114.04 43.29 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.29 -21.25 13.69 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.529 2.153 . . . . 0.0 112.749 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.78 68.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.722 0.296 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -89.71 -75.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.488 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.02 -55.02 3.09 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.189 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.34 -24.22 65.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 111.005 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.791 ' OH ' HD13 ' A' ' 14' ' ' ILE . 8.1 t80 -76.44 -53.49 8.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.788 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.461 HG21 ' HA ' ' A' ' 39' ' ' ALA . 36.6 mm -69.56 -51.29 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.209 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -80.67 31.0 0.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.842 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.74 148.41 65.22 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.638 179.352 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.32 -44.35 4.91 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.251 1.968 . . . . 0.0 112.01 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -80.22 -17.82 51.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.382 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.671 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -55.37 -50.89 68.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.219 0.533 . . . . 0.0 111.273 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.607 ' NH2' HG23 ' A' ' 64' ' ' VAL . 0.1 OUTLIER -54.86 -47.49 74.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.1 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.11 -41.57 90.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.598 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.5 m -57.51 -37.26 72.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.641 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.695 HD21 ' HD3' ' A' ' 65' ' ' PRO . 0.1 OUTLIER -61.0 -59.39 5.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.774 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -59.46 -44.03 93.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.03 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.0 t -52.4 -29.83 26.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.625 0.726 . . . . 0.0 109.363 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.857 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -74.3 -39.1 63.13 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.901 179.203 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.92 55.66 6.29 Favored Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.843 -0.694 . . . . 0.0 113.387 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.857 HD21 ' SG ' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -134.13 -92.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.789 0.295 . . . . 0.0 111.019 179.109 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.619 ' O ' HD23 ' A' ' 57' ' ' LEU . . . -150.32 178.8 8.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 120.868 0.366 . . . . 0.0 111.388 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.881 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.3 OUTLIER -109.9 147.45 36.22 Favored Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.587 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.881 ' HD2' HG22 ' A' ' 64' ' ' VAL . 43.1 Cg_endo -81.83 32.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.966 2.444 . . . . 0.0 113.8 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.606 ' H ' HG13 ' A' ' 64' ' ' VAL . 45.7 m80 -103.13 32.28 3.83 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.713 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.951 -179.946 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.822 0.344 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 58.16 23.11 9.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.282 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -123.61 -34.68 3.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.105 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.624 ' O ' HD23 ' A' ' 7' ' ' LEU . 2.5 mm100 -86.86 48.45 1.65 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.223 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.663 HD11 ' OE1' ' A' ' 31' ' ' GLN . 49.3 mt -151.99 -39.94 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.341 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -45.97 -44.31 14.81 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.089 0.471 . . . . 0.0 111.667 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.754 HG21 ' OE1' ' A' ' 23' ' ' GLU . 11.5 p -55.62 -24.65 16.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.226 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 t -81.38 -30.31 33.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.41 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.18 -30.48 0.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.351 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -51.47 -34.79 37.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.726 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.33 -31.71 17.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.123 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.612 HG21 ' CG ' ' A' ' 47' ' ' TYR . 4.0 mp -74.26 -65.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.16 -74.38 0.11 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.219 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -69.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.138 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.71 25.55 5.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.56 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -77.06 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.177 0.513 . . . . 0.0 111.033 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.6 157.59 3.62 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.828 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.471 ' HB3' HG23 ' A' ' 56' ' ' THR . 29.9 Cg_endo -63.5 -167.03 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.571 2.181 . . . . 0.0 112.202 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.71 144.63 0.84 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.824 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.54 -26.74 62.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.585 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.754 ' OE1' HG21 ' A' ' 9' ' ' VAL . 0.5 OUTLIER -59.94 -56.29 23.5 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.93 0.395 . . . . 0.0 110.817 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -55.39 -26.05 39.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.168 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.53 -48.49 72.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.855 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.99 -25.08 60.53 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.725 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.77 -62.74 1.39 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.129 0.49 . . . . 0.0 110.972 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.581 HD12 ' HD2' ' A' ' 29' ' ' ARG . 2.8 pp -54.76 -24.87 24.47 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.588 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . 0.96 ' NE ' HD13 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -64.34 -52.44 58.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.19 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.75 -25.39 2.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.477 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.663 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -81.41 -71.6 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.914 179.416 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.76 19.25 0.24 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.694 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.0 -81.87 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.72 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 37' ' ' GLN . 3.7 t -60.7 -33.78 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.43 0.633 . . . . 0.0 110.253 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.441 ' CD1' ' N ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -55.54 -45.75 77.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.671 179.611 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.441 ' N ' ' CD1' ' A' ' 35' ' ' PHE . 4.7 t -64.43 -56.3 15.17 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.937 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.443 ' CG ' ' HA ' ' A' ' 34' ' ' CYS . 3.3 pt20 -66.05 -23.15 66.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.28 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -18.53 31.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HB2' ' HB2' ' A' ' 65' ' ' PRO . . . -51.51 -22.95 3.52 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.284 -0.416 . . . . 0.0 112.031 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -97.53 -24.26 15.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.499 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.46 ' CG ' ' HG1' ' A' ' 43' ' ' THR . 10.4 t70 -57.44 109.1 1.51 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -88.62 -10.07 4.59 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.822 2.348 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.46 ' HG1' ' CG ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER -51.7 -27.77 12.77 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -67.3 -58.92 3.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.897 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.27 80.83 0.74 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.68 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.08 22.46 9.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 0.0 110.865 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.612 ' CG ' HG21 ' A' ' 14' ' ' ILE . 8.4 t80 -65.74 -54.66 24.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.94 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.427 HG13 ' HA ' ' A' ' 39' ' ' ALA . 20.8 mm -71.08 -37.27 66.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.576 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -80.81 25.08 0.46 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.48 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.03 155.79 72.42 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.66 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.432 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 13.1 Cg_endo -81.01 -40.55 0.17 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.365 2.043 . . . . 0.0 111.968 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.489 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.69 -30.83 36.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.593 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.48 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -53.6 -42.02 67.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -65.88 -30.39 70.99 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.785 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.31 -40.1 74.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.707 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.471 HG23 ' HB3' ' A' ' 20' ' ' PRO . 1.3 m -58.06 -49.04 78.27 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.918 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.488 HD22 ' HD3' ' A' ' 65' ' ' PRO . 0.1 OUTLIER -59.14 -50.79 72.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.067 0.461 . . . . 0.0 110.886 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.7 m -60.8 -44.55 96.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.336 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -50.67 -31.28 15.85 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.55 0.69 . . . . 0.0 109.705 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.934 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -76.25 -38.99 55.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.226 179.315 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.61 54.62 5.9 Favored Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.688 -0.768 . . . . 0.0 113.113 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.96 HD13 ' NE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -123.48 -81.0 0.63 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.798 0.332 . . . . 0.0 110.662 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.414 ' O ' HD23 ' A' ' 57' ' ' LEU . . . -150.63 168.45 24.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.503 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.416 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.8 p -109.93 137.94 20.61 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.804 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.559 ' HB2' ' HB2' ' A' ' 39' ' ' ALA . 18.7 Cg_endo -57.73 -160.57 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.34 2.026 . . . . 0.0 112.095 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.3 m80 61.55 31.24 18.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.704 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.026 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.91 179.996 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.834 0.35 . . . . 0.0 110.959 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.36 -27.33 68.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.303 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -27.91 44.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.107 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -70.38 -12.82 61.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.17 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.455 HD21 HE22 ' A' ' 31' ' ' GLN . 0.9 OUTLIER -109.58 -19.09 13.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.245 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.0 -60.98 2.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.175 0.512 . . . . 0.0 111.501 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.827 HG11 ' OE2' ' A' ' 23' ' ' GLU . 8.5 p -51.53 -26.32 6.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.322 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -72.09 -31.81 66.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.533 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.598 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -44.61 -28.78 0.64 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.12 -32.03 9.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.997 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -96.04 -34.52 11.72 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.313 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.884 HD13 ' OH ' ' A' ' 47' ' ' TYR . 5.2 mp -74.74 -59.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.067 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.598 HD12 ' HB1' ' A' ' 11' ' ' ALA . 93.2 mt -74.61 -74.31 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.211 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.9 -54.79 21.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.315 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.06 22.2 25.88 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.526 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.89 -77.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.143 0.497 . . . . 0.0 111.115 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.99 163.95 8.82 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.841 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.44 -164.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.648 2.232 . . . . 0.0 112.42 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -172.41 136.92 0.82 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.13 -35.18 90.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.538 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.827 ' OE2' HG11 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -56.78 -50.55 71.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.883 0.373 . . . . 0.0 110.939 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.7 t -56.95 -26.59 59.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.126 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.9 -51.81 36.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.711 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.87 -39.51 95.57 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.473 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -59.16 -56.76 18.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.288 0.566 . . . . 0.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.56 HD21 ' CG ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -48.66 -30.87 5.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.386 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -53.78 32.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.494 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.93 -25.15 2.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.061 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.455 HE22 HD21 ' A' ' 7' ' ' LEU . 1.9 mt-30 -81.09 -71.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.54 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.45 ' HA ' ' HE1' ' A' ' 35' ' ' PHE . 0.1 OUTLIER 46.39 21.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.754 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 175.52 28.73 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.5 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -135.1 -37.08 0.8 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.998 0.427 . . . . 0.0 111.7 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.56 ' CG ' HD21 ' A' ' 28' ' ' LEU . 17.0 p90 -57.57 -58.29 8.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.403 0.621 . . . . 0.0 111.15 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.3 t -48.12 -33.65 8.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -54.54 -34.18 61.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 111.127 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' TYR . . . . . 0.404 ' CB ' HD11 ' A' ' 48' ' ' ILE . 83.2 m-85 -66.19 -21.17 66.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.968 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.417 ' HA ' ' CD1' ' A' ' 48' ' ' ILE . . . -56.23 -21.7 25.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.728 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.2 -21.07 14.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.23 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -70.83 127.21 92.02 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.802 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.47 -42.62 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.48 2.12 . . . . 0.0 112.525 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -40.11 76.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.964 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -95.18 15.65 18.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.239 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.57 -25.08 76.27 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.642 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -71.36 -27.76 63.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.913 0.387 . . . . 0.0 110.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.884 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.2 t80 -73.38 -46.11 50.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.99 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.417 ' CD1' ' HA ' ' A' ' 39' ' ' ALA . 26.9 mt -71.37 -30.46 39.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.651 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -80.73 22.88 0.56 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.714 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -81.15 149.93 67.15 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.611 179.103 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.55 -44.62 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.322 2.015 . . . . 0.0 112.193 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -80.36 -16.77 53.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.621 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -54.47 -48.89 71.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.204 0.526 . . . . 0.0 111.449 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 43.6 mtm180 -58.6 -38.39 77.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.281 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -67.07 -42.21 85.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.791 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.02 -47.47 85.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.969 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.492 HD23 ' O ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -61.28 -49.85 75.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.978 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -62.02 -42.71 99.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.524 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -52.4 -33.98 46.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.487 0.661 . . . . 0.0 109.952 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.17 -33.46 38.32 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.385 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.54 55.73 16.5 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.549 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.72 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -113.87 -83.57 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 179.49 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.72 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.74 159.63 44.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.239 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.444 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 8.6 p -109.8 138.71 20.76 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.667 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.444 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 17.5 Cg_endo -56.42 -160.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.444 2.096 . . . . 0.0 112.151 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 30.8 m80 59.02 32.09 21.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.544 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.922 -179.811 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.84 0.353 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -83.03 -26.37 31.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 m -67.77 -13.06 61.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.468 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 27' ' ' ASN . 0.4 OUTLIER -83.6 -31.58 26.21 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.111 0.481 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.625 HD11 ' OE1' ' A' ' 31' ' ' GLN . 0.8 OUTLIER -101.79 -13.78 17.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.369 -179.574 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.36 -36.96 23.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.067 0.461 . . . . 0.0 111.295 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 p -59.05 -25.18 29.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.146 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -84.04 -37.52 22.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.4 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.625 ' HB2' ' HE2' ' A' ' 47' ' ' TYR . . . -47.84 -27.88 2.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.536 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -51.43 -29.87 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.416 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ALA . . . . . 0.585 ' HB2' ' H ' ' A' ' 19' ' ' LYS . . . -140.58 21.27 2.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.449 ' CG2' ' HA ' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -80.22 -45.03 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.81 0.338 . . . . 0.0 111.253 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.471 HD23 ' HB3' ' A' ' 46' ' ' GLN . 2.2 mp -80.2 -68.07 0.71 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.1 m -79.43 -64.08 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLY . . . . . 0.503 ' HA2' ' HB1' ' A' ' 13' ' ' ALA . . . 114.09 49.07 0.55 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.497 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.33 99.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.096 0.474 . . . . 0.0 111.216 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.585 ' H ' ' HB2' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -178.97 94.92 0.21 Allowed Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.942 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -67.0 -167.26 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.438 2.092 . . . . 0.0 112.238 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -172.45 144.38 1.5 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.812 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.04 -29.1 61.89 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.604 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -48.39 -31.86 6.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.842 0.353 . . . . 0.0 111.144 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 41.3 t -53.86 -25.11 18.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.342 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.79 -50.57 14.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.677 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.63 -32.83 84.75 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.511 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASN . . . . . 0.405 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 34.5 m120 -66.39 -64.72 0.8 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.918 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.617 HD11 HD22 ' A' ' 62' ' ' LEU . 1.2 pp -50.76 -28.7 9.75 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.43 -42.62 74.43 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.743 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.83 -23.99 20.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.384 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.625 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -80.89 -71.56 0.46 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.536 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.519 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 48.66 19.8 0.28 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.827 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -176.62 26.6 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.163 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.594 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.5 t -135.27 -38.08 0.77 Allowed 'General case' 0 N--CA 1.443 -0.776 0 CA-C-O 120.869 0.366 . . . . 0.0 111.802 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.519 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 4.6 p90 -56.09 -53.17 60.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.495 0.664 . . . . 0.0 111.445 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 t -55.73 -49.61 72.61 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.334 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLN . . . . . 0.594 HE21 ' HA ' ' A' ' 34' ' ' CYS . 23.1 pt20 -67.65 -26.23 66.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.224 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.2 -27.91 67.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.716 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.567 ' HB2' ' CB ' ' A' ' 65' ' ' PRO . . . -56.0 -20.13 15.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.805 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.05 -23.6 20.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.864 0.364 . . . . 0.0 111.23 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.66 112.1 9.42 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.042 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -89.23 105.9 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.918 2.412 . . . . 0.0 112.474 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.75 -45.27 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.059 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -75.54 -62.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 57.52 30.61 62.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.388 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLN . . . . . 0.471 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.7 OUTLIER -164.16 -40.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.995 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.625 ' HE2' ' HB2' ' A' ' 11' ' ' ALA . 1.7 t80 -59.5 -54.03 51.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.935 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.3 mt -74.61 -47.83 37.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.449 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -80.76 28.46 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.884 0.373 . . . . 0.0 111.923 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.485 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -80.94 151.49 70.59 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.539 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.45 -42.48 0.89 Allowed 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.223 1.948 . . . . 0.0 112.185 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.29 -26.36 38.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.492 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.485 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -57.91 -52.47 65.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.193 0.521 . . . . 0.0 111.411 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -54.12 -32.45 55.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.229 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.9 -41.09 71.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.629 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.91 -49.12 78.94 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.455 HD23 HD12 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -59.67 -50.23 74.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.181 0.515 . . . . 0.0 110.872 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.4 m -60.43 -44.27 95.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.576 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.87 -32.51 32.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.484 0.659 . . . . 0.0 109.875 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -80.12 -35.63 36.48 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.314 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.29 58.27 7.45 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.401 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.663 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -116.99 -76.49 0.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.644 0.259 . . . . 0.0 110.988 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.663 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.51 -170.68 3.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.052 0.453 . . . . 0.0 111.684 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.541 HG13 ' HD2' ' A' ' 65' ' ' PRO . 61.7 t -148.21 139.79 13.99 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.849 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.567 ' CB ' ' HB2' ' A' ' 39' ' ' ALA . 17.9 Cg_endo -58.02 -160.66 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.466 2.111 . . . . 0.0 112.145 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 61.2 m80 60.7 35.95 19.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.836 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.946 -179.924 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.481 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 5.9 mt-30 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.681 0.277 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . 71.56 8.68 6.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.611 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 12.69 2.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 111.185 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -81.08 -20.24 41.95 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.834 0.35 . . . . 0.0 111.227 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.642 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.4 mt -96.9 -17.45 20.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.356 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -48.05 -54.04 14.4 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.178 0.513 . . . . 0.0 111.54 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.77 HG11 ' OE1' ' A' ' 23' ' ' GLU . 10.1 p -53.66 -25.46 11.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 t -77.15 -29.84 54.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.61 -30.84 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.438 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.3 t -50.26 -31.24 13.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.994 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.36 -29.78 14.27 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.333 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.84 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.3 mp -76.32 -67.54 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.975 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.11 -77.26 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.308 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -51.78 -59.27 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.183 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.88 28.77 7.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.381 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.36 -78.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.09 0.471 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.14 153.98 1.63 Allowed Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.867 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.62 -177.92 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 0.0 112.233 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -174.76 135.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.23 -26.73 56.7 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.502 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.77 ' OE1' HG11 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -57.05 -48.02 79.56 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.511 ' O ' HD23 ' A' ' 28' ' ' LEU . 53.5 t -54.22 -29.35 46.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.57 -55.88 7.8 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.65 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.39 -31.07 59.41 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.413 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -70.36 -66.21 0.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.074 0.464 . . . . 0.0 111.02 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.631 HD11 ' CD2' ' A' ' 62' ' ' LEU . 3.8 pp -52.98 -25.76 13.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.573 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -44.59 88.12 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.91 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.63 -26.1 12.65 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.318 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.642 ' OE1' HD21 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -81.41 -71.31 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.89 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.478 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 51.66 17.97 0.66 Allowed 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.685 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 177.74 28.57 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.96 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 31' ' ' GLN . 3.2 t -137.53 -34.81 0.68 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 120.993 0.425 . . . . 0.0 111.499 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -51.65 -50.45 60.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.424 0.631 . . . . 0.0 111.346 -179.205 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -41.77 63.72 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.968 -1.015 . . . . 0.0 111.203 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -54.72 -29.68 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.282 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -79.44 -22.67 43.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.65 -19.24 15.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.911 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 8.95 26.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.399 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -80.04 131.02 64.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.657 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.66 -59.12 0.15 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.506 2.137 . . . . 0.0 112.812 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -27.32 27.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.344 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -97.66 15.54 23.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.257 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -34.56 87.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.615 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.57 -26.63 61.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.84 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.0 t80 -75.17 -46.44 34.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.8 mm -70.27 -36.94 69.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.586 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -80.84 24.39 0.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.617 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.18 153.67 71.93 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.481 179.081 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.431 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 12.7 Cg_endo -81.17 -42.55 0.12 Allowed 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.363 2.042 . . . . 0.0 112.053 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.73 -18.11 48.83 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.761 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.617 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -57.42 -53.52 57.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.288 0.565 . . . . 0.0 111.374 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.67 -33.57 70.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.167 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -69.71 -41.71 74.98 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.701 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -60.4 -48.88 79.84 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.868 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.558 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -61.42 -48.12 82.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.883 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.3 m -61.28 -43.53 98.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.456 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.93 -31.72 29.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.526 0.679 . . . . 0.0 109.83 178.889 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.411 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -78.66 -33.7 46.91 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.379 179.387 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.11 57.58 6.81 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.603 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.643 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -119.04 -80.85 0.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 110.651 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.643 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.54 167.96 25.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.402 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.405 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.3 p -109.85 137.37 20.43 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.987 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.405 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 32.9 Cg_endo -62.92 -163.26 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.363 2.042 . . . . 0.0 112.118 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 78.4 m80 56.42 35.32 25.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.869 -179.938 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.746 0.307 . . . . 0.0 111.0 . . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . 70.48 22.26 5.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.215 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.85 -19.83 6.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.43 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLN . . . . . 0.451 ' OE1' ' HB3' ' A' ' 30' ' ' ALA . 12.2 mm-40 -75.29 -6.93 52.38 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.584 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mt -116.14 -20.32 9.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.569 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.19 -50.48 37.91 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.172 0.511 . . . . 0.0 111.392 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.586 HG21 ' OE1' ' A' ' 23' ' ' GLU . 11.4 p -57.21 -22.83 17.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.39 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.464 ' SG ' HG21 ' A' ' 56' ' ' THR . 3.6 t -81.79 -33.32 30.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.63 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.05 -29.02 0.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.426 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.95 -45.56 74.92 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.893 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.24 -28.09 42.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.336 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.529 HD13 ' CZ ' ' A' ' 47' ' ' TYR . 2.0 mp -70.21 -63.21 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.75 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mt -69.85 -75.02 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.326 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.03 -64.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.227 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.94 32.83 6.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.303 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -53.68 39.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.208 0.528 . . . . 0.0 111.167 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.52 157.85 0.61 Allowed Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.767 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.28 -179.2 2.54 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.498 2.132 . . . . 0.0 112.155 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.94 129.76 3.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.921 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.12 -28.94 59.08 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.457 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.586 ' OE1' HG21 ' A' ' 9' ' ' VAL . 1.6 tt0 -54.92 -47.18 74.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.925 0.393 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' CYS . . . . . 0.52 ' O ' HD23 ' A' ' 28' ' ' LEU . 48.3 t -54.6 -30.21 54.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.015 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.7 t -76.72 -36.31 57.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.524 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.08 -32.01 37.11 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.611 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -65.87 -61.01 2.3 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.993 0.425 . . . . 0.0 111.026 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.803 HD11 ' CD2' ' A' ' 62' ' ' LEU . 3.9 pp -50.59 -27.41 6.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.508 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -44.16 67.7 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.704 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.451 ' HB3' ' OE1' ' A' ' 6' ' ' GLN . . . -55.51 -23.83 28.33 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.087 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -81.08 -71.73 0.46 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.65 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLN . . . . . 0.483 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 49.86 19.06 0.4 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.904 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 179.14 27.8 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.177 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.4 -34.58 0.7 Allowed 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.916 0.388 . . . . 0.0 111.702 -179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 1.5 p90 -53.18 -52.28 59.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.389 0.614 . . . . 0.0 111.369 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -51.61 -38.94 56.92 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.233 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -56.43 -28.27 58.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.264 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -77.14 -28.2 54.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.006 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB2' ' CB ' ' A' ' 65' ' ' PRO . . . -52.62 -24.51 8.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.542 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.77 -23.73 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.175 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -57.94 109.27 1.67 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.036 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -83.79 97.95 0.78 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.699 2.266 . . . . 0.0 112.361 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.96 -45.39 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.816 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -90.1 -62.62 1.42 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.836 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.65 -58.29 3.8 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.777 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -69.57 -13.57 62.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.614 0.245 . . . . 0.0 111.233 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.529 ' CZ ' HD13 ' A' ' 14' ' ' ILE . 2.7 t80 -80.07 -55.65 4.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.824 0.345 . . . . 0.0 111.119 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 37.8 mm -66.76 -55.8 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.348 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.64 30.55 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 111.676 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.472 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.71 160.53 66.58 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.701 179.41 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.408 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 11.1 Cg_endo -81.05 -44.2 0.1 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.466 2.111 . . . . 0.0 111.917 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.81 -24.53 38.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.705 -179.283 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.472 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -55.7 -50.21 70.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.204 0.526 . . . . 0.0 111.347 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.1 mtm180 -56.79 -32.49 65.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.219 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -68.02 -40.06 83.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.466 HG21 ' SG ' ' A' ' 24' ' ' CYS . 1.2 m -58.76 -50.92 72.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.876 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.54 HD23 ' O ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.47 -48.81 76.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.6 m -63.14 -41.05 99.23 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.442 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.2 t -52.93 -36.15 59.42 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.396 0.617 . . . . 0.0 109.918 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -32.18 37.69 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.104 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.66 53.48 31.23 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.846 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.803 ' CD2' HD11 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -112.25 -78.84 0.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.806 0.336 . . . . 0.0 110.786 179.239 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.763 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.65 -164.28 1.98 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.436 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.499 HG13 ' HD2' ' A' ' 65' ' ' PRO . 33.7 t -137.1 139.19 27.62 Favored Pre-proline 0 N--CA 1.452 -0.373 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.813 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.499 ' HD2' HG13 ' A' ' 64' ' ' VAL . 17.9 Cg_endo -56.69 -160.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.54 2.16 . . . . 0.0 112.305 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m80 67.49 43.4 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.012 -179.936 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.842 0.353 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -88.2 11.83 15.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.751 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.7 m -109.78 -23.25 11.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.1 -11.18 60.63 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.228 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.861 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.2 mt -108.59 -17.92 13.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.455 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.38 -35.53 19.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.086 0.469 . . . . 0.0 111.236 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' VAL . . . . . 0.514 HG21 ' OE1' ' A' ' 23' ' ' GLU . 9.1 p -65.05 -24.42 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.281 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.08 -32.07 26.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.435 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.89 -30.08 0.64 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -53.13 -38.44 62.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.691 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.38 -40.01 21.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.19 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ILE . . . . . 0.672 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.4 mp -66.18 -58.69 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.878 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -53.68 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.463 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 t -70.69 -79.64 0.06 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.19 43.14 0.13 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.445 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.95 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 111.075 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 141.79 0.73 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.889 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PRO . . . . . 0.562 ' HB3' HG23 ' A' ' 56' ' ' THR . 54.4 Cg_exo -52.01 -179.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.459 2.106 . . . . 0.0 112.297 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.22 139.64 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.96 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.76 -25.22 55.52 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLU . . . . . 0.514 ' OE1' HG21 ' A' ' 9' ' ' VAL . 4.3 tm-20 -55.25 -48.52 73.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 120.938 0.399 . . . . 0.0 110.965 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.9 t -57.15 -35.97 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.068 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.551 ' HA ' HD21 ' A' ' 28' ' ' LEU . 69.7 m -65.11 -40.49 94.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.53 -42.52 98.88 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.748 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -65.09 -61.26 2.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.03 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 25' ' ' CYS . 4.6 pp -51.3 -25.8 6.42 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.45 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -56.16 25.46 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.305 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.55 -25.88 3.07 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.149 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . 0.861 ' OE1' HD21 ' A' ' 7' ' ' LEU . 1.4 mt-30 -81.75 -71.9 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.789 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.01 20.66 0.12 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.518 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.21 -81.02 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.9 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -58.94 -37.92 77.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.189 0.519 . . . . 0.0 110.54 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' PHE . . . . . 0.565 ' HZ ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -50.08 -41.68 48.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.152 178.734 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.8 t -75.78 -33.01 60.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.605 178.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -62.46 -32.64 73.54 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.905 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -59.18 -19.96 49.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.465 ' HB1' ' O ' ' A' ' 65' ' ' PRO . . . -51.32 -25.11 5.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.8 0.333 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.61 -22.33 12.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.829 ' OD1' HG23 ' A' ' 43' ' ' THR . 51.8 t0 -59.63 114.43 9.5 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.792 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.43 3.32 7.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.547 2.165 . . . . 0.0 113.071 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . 0.829 HG23 ' OD1' ' A' ' 41' ' ' ASP . 41.0 p -51.2 -41.13 60.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.819 0.342 . . . . 0.0 111.075 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -105.75 -62.2 1.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.762 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.47 -59.45 4.38 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -70.54 -20.57 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.717 0.294 . . . . 0.0 111.138 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' TYR . . . . . 0.672 ' OH ' HD13 ' A' ' 14' ' ' ILE . 7.2 t80 -74.82 -49.91 19.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.937 0.399 . . . . 0.0 110.865 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.8 mm -68.25 -53.22 30.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.264 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.2 mtt180 -80.64 30.56 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 111.797 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . 0.594 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -80.72 147.59 63.14 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.757 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.3 -42.06 2.16 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.377 2.051 . . . . 0.0 112.281 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -80.15 -18.93 48.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.376 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.594 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -59.08 -55.72 31.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.218 0.533 . . . . 0.0 111.293 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -57.25 -33.9 68.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.124 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -66.7 -49.38 66.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.754 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' THR . . . . . 0.562 HG23 ' HB3' ' A' ' 20' ' ' PRO . 1.2 m -59.42 -48.23 82.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.515 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.565 HD21 ' HZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.94 -48.14 80.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.674 179.68 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.9 m -61.66 -42.77 99.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.543 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.7 t -51.35 -37.55 48.53 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.48 0.657 . . . . 0.0 109.694 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' CYS . . . . . 0.528 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.57 -39.22 28.04 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.192 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 59.5 49.97 72.82 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.482 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . 0.908 HD12 ' N ' ' A' ' 63' ' ' ALA . 1.7 pp -115.36 -40.88 3.35 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . 0.908 ' N ' HD12 ' A' ' 62' ' ' LEU . . . -150.78 175.01 12.39 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.02 0.438 . . . . 0.0 111.628 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.818 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.4 OUTLIER -146.44 148.14 33.2 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.755 179.917 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 65' ' ' PRO . . . . . 0.818 ' HD2' HG22 ' A' ' 64' ' ' VAL . 69.2 Cg_endo -75.9 33.05 0.39 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.196 2.598 . . . . 0.0 113.287 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.4 ' H ' HG13 ' A' ' 64' ' ' VAL . 87.0 m-70 -128.63 29.72 5.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.682 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.3 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.916 -179.904 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.857 0.36 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 3.5 m 59.94 93.88 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.77 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -79.82 -42.25 24.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.022 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.19 32.52 20.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.871 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -149.17 -36.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.31 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.26 -14.83 62.57 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.858 0.361 . . . . 0.0 111.166 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.805 HD21 ' OE1' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -108.57 -20.23 13.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 -179.431 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.87 -43.78 28.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.115 0.483 . . . . 0.0 111.486 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.6 p -56.45 -25.23 20.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.193 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -88.54 -30.78 19.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.61 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.2 -30.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.37 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.1 m -55.04 -35.38 64.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.783 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.41 -43.3 14.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.303 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.549 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.1 mp -60.9 -53.42 49.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 26.9 mt -73.7 -80.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 t -60.22 -75.32 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.946 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.5 37.34 0.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.591 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.22 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.128 0.489 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.99 138.01 3.15 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.831 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.71 -171.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.447 2.098 . . . . 0.0 112.321 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 m -174.39 140.99 0.67 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.82 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.43 -44.22 93.57 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.582 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -48.81 -36.31 16.46 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 120.905 0.383 . . . . 0.0 111.059 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.1 t -53.7 -63.29 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.291 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.425 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 12.2 p -53.48 -25.21 15.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.272 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.47 -38.01 18.83 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -56.5 -50.32 72.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.13 0.49 . . . . 0.0 111.613 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 1.028 HD11 HD13 ' A' ' 62' ' ' LEU . 3.9 pp -51.36 -37.86 50.22 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.337 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.512 ' HD3' HD22 ' A' ' 62' ' ' LEU . 34.5 mmm-85 -54.24 -47.14 72.54 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.395 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.46 -28.44 13.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.304 0.573 . . . . 0.0 109.592 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.805 ' OE1' HD21 ' A' ' 7' ' ' LEU . 2.7 mt-30 -81.93 -74.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.454 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 49.01 19.62 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.615 -179.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -130.08 -82.45 0.28 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.55 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.8 t -61.4 -34.62 75.67 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.417 0.627 . . . . 0.0 110.181 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.974 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -56.31 -37.16 69.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.464 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.22 -51.28 21.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.067 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.55 HE21 ' HA ' ' A' ' 34' ' ' CYS . 5.1 pt20 -70.59 -23.07 62.51 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.219 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.55 -22.49 13.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.742 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.86 -19.55 12.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.758 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -94.65 -23.17 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 111.016 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -57.39 116.32 13.46 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.772 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.67 -44.23 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.523 2.149 . . . . 0.0 112.722 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 p -51.2 -41.84 60.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.228 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.563 ' HD2' HCM1 ' A' ' 68' ' ' PGM . 42.9 m-85 -95.77 15.14 20.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.197 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.65 -27.91 62.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.575 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.6 -25.84 62.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.776 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.793 ' CD2' HCM2 ' A' ' 68' ' ' PGM . 9.3 t80 -75.22 -51.76 12.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.0 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.744 HG23 HCF2 ' A' ' 68' ' ' PGM . 29.5 mt -69.72 -42.68 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.545 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.82 27.97 0.36 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.499 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.83 164.56 50.39 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.447 179.153 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -81.01 -46.95 0.08 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.443 2.095 . . . . 0.0 111.826 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.513 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -80.89 -17.75 49.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.701 -179.303 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -61.49 -58.96 6.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.178 0.513 . . . . 0.0 111.445 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.646 ' CG ' HCC2 ' A' ' 68' ' ' PGM . 6.2 mtt180 -57.96 -32.26 67.66 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.067 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -66.27 -44.79 82.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.933 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -60.24 -51.57 68.97 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.847 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.472 HD21 ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -63.8 -44.6 92.84 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.154 0.502 . . . . 0.0 110.787 179.879 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.3 m -63.58 -41.86 98.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.572 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.4 t -51.45 -38.62 54.63 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.534 0.683 . . . . 0.0 109.592 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.526 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.64 -40.63 25.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.362 178.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.19 54.91 31.07 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.104 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 1.028 HD13 HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -109.78 -60.03 1.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.398 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.851 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.77 132.6 15.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 111.602 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.431 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 9.9 p -109.91 137.73 20.55 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.535 ' HG2' HCB1 ' A' ' 68' ' ' PGM . 19.4 Cg_endo -57.19 -160.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.485 2.123 . . . . 0.0 112.246 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 m80 61.97 31.91 17.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.764 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.873 179.979 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 68' ' ' PGM . . . . . 0.793 HCM2 ' CD2' ' A' ' 47' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.772 0.32 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t -148.49 72.53 1.2 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.919 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -68.41 -34.25 75.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.845 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.55 19.19 9.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.347 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.21 -24.93 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.359 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -69.86 -16.59 63.28 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.182 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.74 HD11 ' OE1' ' A' ' 31' ' ' GLN . 1.1 mt -99.99 -24.88 14.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.218 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.07 -38.09 23.25 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.092 0.473 . . . . 0.0 111.329 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.536 HG11 ' OE1' ' A' ' 23' ' ' GLU . 11.1 p -60.86 -25.93 37.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.165 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.65 -32.69 25.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HA ' HD13 ' A' ' 14' ' ' ILE . . . -43.97 -29.24 0.55 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.458 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 71.2 m -53.07 -43.38 66.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.847 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.83 -25.78 34.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.311 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 53' ' ' ALA . 2.4 mp -68.7 -62.01 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.771 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -74.06 -79.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.208 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -62.62 1.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.062 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.5 36.45 4.33 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.432 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.574 ' O ' ' HG3' ' A' ' 19' ' ' LYS . . . -57.63 -79.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.899 0.38 . . . . 0.0 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -158.95 145.9 12.91 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.558 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.08 -174.69 0.81 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.457 2.105 . . . . 0.0 112.201 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.7 p -173.41 138.57 0.71 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.03 -27.67 60.06 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.536 ' OE1' HG11 ' A' ' 9' ' ' VAL . 2.6 tt0 -53.15 -43.09 66.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.895 0.378 . . . . 0.0 111.081 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.628 ' O ' HD23 ' A' ' 28' ' ' LEU . 47.7 t -55.67 -23.51 28.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.393 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.41 ' HA ' HD21 ' A' ' 62' ' ' LEU . 87.6 m -78.02 -45.58 23.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.846 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.95 -35.28 58.14 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -62.67 -60.22 3.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.185 0.517 . . . . 0.0 110.915 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.844 HD13 ' CE2' ' A' ' 35' ' ' PHE . 1.2 pp -54.47 -31.35 55.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.675 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.612 ' HD3' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -59.69 -47.47 85.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.216 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.16 -25.82 3.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.564 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.74 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -81.36 -72.66 0.42 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.3 20.68 0.16 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.588 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.97 -80.49 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.919 -0.657 . . . . 0.0 112.195 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.6 t -59.52 -36.22 75.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.408 0.623 . . . . 0.0 110.416 179.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.844 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -57.18 -43.96 83.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.441 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.93 -33.94 77.22 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.504 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -59.03 -35.01 72.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.383 -179.743 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.85 -15.4 54.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.334 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.551 ' HB1' ' HB2' ' A' ' 65' ' ' PRO . . . -47.99 -28.93 3.03 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.938 0.399 . . . . 0.0 111.519 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -118.79 -27.99 5.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.233 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.838 ' OD1' HG23 ' A' ' 43' ' ' THR . 19.0 t0 -60.15 107.51 1.06 Allowed Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.853 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -82.09 38.16 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.917 2.411 . . . . 0.0 112.744 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.838 HG23 ' OD1' ' A' ' 41' ' ' ASP . 16.4 p -67.58 -38.13 83.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.902 0.382 . . . . 0.0 110.736 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.649 ' CZ ' HCM1 ' A' ' 68' ' ' PGM . 17.1 m-85 -98.31 -55.09 2.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.38 -56.63 5.06 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.622 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -75.7 -21.14 57.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.704 0.288 . . . . 0.0 111.196 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.678 ' CE1' HCJ1 ' A' ' 68' ' ' PGM . 3.4 t80 -80.02 -51.72 8.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.256 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.786 HG23 HCD2 ' A' ' 68' ' ' PGM . 38.9 mm -65.15 -59.24 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.185 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -80.45 31.06 0.28 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.867 0.365 . . . . 0.0 111.541 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.547 ' HB3' ' HB3' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -80.77 147.51 62.72 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 179.548 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -80.12 -42.01 0.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.563 2.176 . . . . 0.0 112.692 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -80.25 -30.23 38.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.834 -179.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.547 ' HB3' ' HB3' ' A' ' 50' ' ' SER . . . -59.25 -54.92 41.32 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.262 0.553 . . . . 0.0 111.466 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -54.73 -35.78 64.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.09 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -68.79 -42.0 77.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.545 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -61.0 -50.85 71.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -62.95 -46.56 87.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.195 0.521 . . . . 0.0 110.631 179.794 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.5 m -62.14 -42.49 99.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.719 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -51.74 -39.52 58.61 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.434 0.635 . . . . 0.0 109.762 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.784 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.67 -34.87 34.44 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.565 179.14 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 56.06 46.59 84.49 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.478 -0.868 . . . . 0.0 111.888 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.968 HD12 ' N ' ' A' ' 63' ' ' ALA . 3.5 pp -109.9 -40.88 4.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.592 0.234 . . . . 0.0 111.502 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.968 ' N ' HD12 ' A' ' 62' ' ' LEU . . . -150.43 159.08 44.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.016 0.436 . . . . 0.0 111.643 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.786 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.5 OUTLIER -150.16 161.69 30.13 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.396 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.786 ' HD2' HG22 ' A' ' 64' ' ' VAL . 65.7 Cg_endo -77.74 31.71 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.012 2.475 . . . . 0.0 113.343 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -132.79 43.17 3.0 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.725 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 23.1 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.977 -179.913 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 68' ' ' PGM . . . . . 0.786 HCD2 HG23 ' A' ' 48' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.822 0.344 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.1 m -110.78 -57.02 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -156.64 -56.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 61.94 31.98 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.061 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 m -122.2 -39.78 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -76.55 -5.07 46.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.477 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.039 HD13 HCK2 ' A' ' 68' ' ' PGM . 2.8 mt -114.37 -19.36 11.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.46 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.41 -52.81 15.72 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.175 0.512 . . . . 0.0 111.424 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.553 HG21 ' OE1' ' A' ' 23' ' ' GLU . 10.3 p -57.35 -22.49 17.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.369 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -88.56 -32.49 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.495 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.03 -30.02 0.68 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.39 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -53.37 -43.64 67.97 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.5 -32.96 48.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.073 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.791 HD13 ' OH ' ' A' ' 47' ' ' TYR . 3.6 mp -70.66 -62.48 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.889 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -68.11 -77.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.228 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.01 -70.2 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.172 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.25 27.22 4.29 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.477 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -77.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.142 0.496 . . . . 0.0 111.103 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.29 143.52 1.56 Allowed Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.858 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.64 -170.8 0.56 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.522 2.148 . . . . 0.0 112.37 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.32 -162.61 0.54 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.423 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -102.5 -27.48 6.78 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.467 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.553 ' OE1' HG21 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -56.85 -50.01 73.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.843 0.354 . . . . 0.0 110.966 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.539 ' SG ' HD23 ' A' ' 28' ' ' LEU . 43.3 t -52.36 -27.87 17.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.163 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 29' ' ' ARG . 60.9 m -67.92 -61.0 2.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.768 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.1 -29.7 56.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.8 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -70.6 -67.67 0.48 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.073 0.463 . . . . 0.0 110.918 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.721 HD11 HD13 ' A' ' 62' ' ' LEU . 3.9 pp -56.26 -28.1 57.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.587 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.761 ' HD3' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.75 -47.26 86.0 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 121.166 0.507 . . . . 0.0 110.41 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.25 -24.23 10.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.265 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.918 ' OE1' HD21 ' A' ' 7' ' ' LEU . 12.3 mt-30 -81.07 -71.86 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.639 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.28 20.03 0.25 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.602 -179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.7 -81.73 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -59.14 -36.01 74.48 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.391 0.615 . . . . 0.0 110.112 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.652 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -63.71 -40.15 96.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.171 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.88 -55.7 13.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.546 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.5 pp0? -62.81 -24.87 67.97 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.707 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -23.17 14.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.586 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 65' ' ' PRO . . . -55.49 -21.69 17.64 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.687 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.55 15.75 18.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.02 114.04 43.29 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.29 -21.25 13.69 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.529 2.153 . . . . 0.0 112.749 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.78 68.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.722 0.296 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.743 ' CZ ' HCM2 ' A' ' 68' ' ' PGM . 77.6 m-85 -89.71 -75.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.488 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.02 -55.02 3.09 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.189 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.34 -24.22 65.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 111.005 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.815 ' CE2' HCK1 ' A' ' 68' ' ' PGM . 8.1 t80 -76.44 -53.49 8.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.788 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.643 ' CD1' HCG2 ' A' ' 68' ' ' PGM . 36.6 mm -69.56 -51.29 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.209 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -80.67 31.0 0.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.842 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.74 148.41 65.22 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.638 179.352 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.32 -44.35 4.91 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.251 1.968 . . . . 0.0 112.01 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -80.22 -17.82 51.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.382 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.671 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -55.37 -50.89 68.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.219 0.533 . . . . 0.0 111.273 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.607 ' NH2' HG23 ' A' ' 64' ' ' VAL . 0.1 OUTLIER -54.86 -47.49 74.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.1 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.11 -41.57 90.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.598 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.5 m -57.51 -37.26 72.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.641 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.695 HD21 ' HD3' ' A' ' 65' ' ' PRO . 0.1 OUTLIER -61.0 -59.39 5.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.774 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -59.46 -44.03 93.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.03 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.0 t -52.4 -29.83 26.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.625 0.726 . . . . 0.0 109.363 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.857 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -74.3 -39.1 63.13 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.901 179.203 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.92 55.66 6.29 Favored Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.843 -0.694 . . . . 0.0 113.387 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.857 HD21 ' SG ' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -134.13 -92.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.789 0.295 . . . . 0.0 111.019 179.109 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.619 ' O ' HD23 ' A' ' 57' ' ' LEU . . . -150.32 178.8 8.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 120.868 0.366 . . . . 0.0 111.388 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.881 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.3 OUTLIER -109.9 147.45 36.22 Favored Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.587 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.881 ' HD2' HG22 ' A' ' 64' ' ' VAL . 43.1 Cg_endo -81.83 32.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.966 2.444 . . . . 0.0 113.8 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.606 ' H ' HG13 ' A' ' 64' ' ' VAL . 45.7 m80 -103.13 32.28 3.83 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.713 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.951 -179.946 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 68' ' ' PGM . . . . . 1.039 HCK2 HD13 ' A' ' 7' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.791 0.329 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.3 m 59.99 99.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.877 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -36.31 83.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 58.16 23.11 9.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.282 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -123.61 -34.68 3.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.105 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.624 ' O ' HD23 ' A' ' 7' ' ' LEU . 2.5 mm100 -86.86 48.45 1.65 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.223 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.663 HD11 ' OE1' ' A' ' 31' ' ' GLN . 49.3 mt -151.99 -39.94 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.341 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -45.97 -44.31 14.81 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.089 0.471 . . . . 0.0 111.667 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.754 HG21 ' OE1' ' A' ' 23' ' ' GLU . 11.5 p -55.62 -24.65 16.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.226 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 t -81.38 -30.31 33.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.41 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.18 -30.48 0.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.351 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -51.47 -34.79 37.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.726 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.33 -31.71 17.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.123 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.612 HG21 ' CG ' ' A' ' 47' ' ' TYR . 4.0 mp -74.26 -65.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.16 -74.38 0.11 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.219 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -69.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.138 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.71 25.55 5.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.56 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -77.06 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.177 0.513 . . . . 0.0 111.033 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.6 157.59 3.62 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.828 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.471 ' HB3' HG23 ' A' ' 56' ' ' THR . 29.9 Cg_endo -63.5 -167.03 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.571 2.181 . . . . 0.0 112.202 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.71 144.63 0.84 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.824 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.54 -26.74 62.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.585 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.754 ' OE1' HG21 ' A' ' 9' ' ' VAL . 0.5 OUTLIER -59.94 -56.29 23.5 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.93 0.395 . . . . 0.0 110.817 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -55.39 -26.05 39.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.168 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.53 -48.49 72.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.855 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.99 -25.08 60.53 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.725 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.77 -62.74 1.39 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.129 0.49 . . . . 0.0 110.972 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.581 HD12 ' HD2' ' A' ' 29' ' ' ARG . 2.8 pp -54.76 -24.87 24.47 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.588 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . 0.96 ' NE ' HD13 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -64.34 -52.44 58.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.19 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.75 -25.39 2.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.477 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.663 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -81.41 -71.6 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.914 179.416 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 48.76 19.25 0.24 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.694 -179.749 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.0 -81.87 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.72 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.443 ' HA ' ' CG ' ' A' ' 37' ' ' GLN . 3.7 t -60.7 -33.78 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.43 0.633 . . . . 0.0 110.253 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.441 ' CD1' ' N ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -55.54 -45.75 77.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.671 179.611 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.441 ' N ' ' CD1' ' A' ' 35' ' ' PHE . 4.7 t -64.43 -56.3 15.17 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.937 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.443 ' CG ' ' HA ' ' A' ' 34' ' ' CYS . 3.3 pt20 -66.05 -23.15 66.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.28 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -18.53 31.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HB2' ' HB2' ' A' ' 65' ' ' PRO . . . -51.51 -22.95 3.52 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.284 -0.416 . . . . 0.0 112.031 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -97.53 -24.26 15.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.499 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.46 ' CG ' ' HG1' ' A' ' 43' ' ' THR . 10.4 t70 -57.44 109.1 1.51 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -88.62 -10.07 4.59 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.822 2.348 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.46 ' HG1' ' CG ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER -51.7 -27.77 12.77 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.72 ' CZ ' HCM2 ' A' ' 68' ' ' PGM . 24.2 m-85 -67.3 -58.92 3.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.897 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.27 80.83 0.74 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.68 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.08 22.46 9.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 0.0 110.865 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.721 ' CE2' HCN2 ' A' ' 68' ' ' PGM . 8.4 t80 -65.74 -54.66 24.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.94 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.723 HD13 HCG1 ' A' ' 68' ' ' PGM . 20.8 mm -71.08 -37.27 66.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.576 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -80.81 25.08 0.46 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.48 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.03 155.79 72.42 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.66 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.432 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 13.1 Cg_endo -81.01 -40.55 0.17 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.365 2.043 . . . . 0.0 111.968 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.489 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.69 -30.83 36.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.593 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.484 ' HB1' HCE2 ' A' ' 68' ' ' PGM . . . -53.6 -42.02 67.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -65.88 -30.39 70.99 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.785 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.31 -40.1 74.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.707 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.471 HG23 ' HB3' ' A' ' 20' ' ' PRO . 1.3 m -58.06 -49.04 78.27 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.918 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.622 HD13 HCD2 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -59.14 -50.79 72.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.067 0.461 . . . . 0.0 110.886 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.7 m -60.8 -44.55 96.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.336 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -50.67 -31.28 15.85 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.55 0.69 . . . . 0.0 109.705 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.934 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -76.25 -38.99 55.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.226 179.315 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.61 54.62 5.9 Favored Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.688 -0.768 . . . . 0.0 113.113 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.96 HD13 ' NE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -123.48 -81.0 0.63 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.798 0.332 . . . . 0.0 110.662 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.414 ' O ' HD23 ' A' ' 57' ' ' LEU . . . -150.63 168.45 24.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.503 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.416 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.8 p -109.93 137.94 20.61 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.804 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.559 ' HB2' ' HB2' ' A' ' 39' ' ' ALA . 18.7 Cg_endo -57.73 -160.57 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.34 2.026 . . . . 0.0 112.095 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 91.8 m-70 61.55 31.24 18.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.704 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.026 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.91 179.996 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 68' ' ' PGM . . . . . 0.723 HCG1 HD13 ' A' ' 48' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.811 0.339 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.4 p -85.12 62.53 7.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.868 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.62 153.2 40.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.959 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.36 -27.33 68.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.303 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -27.91 44.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.107 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -70.38 -12.82 61.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.17 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.479 HD13 HCJ2 ' A' ' 68' ' ' PGM . 0.9 OUTLIER -109.58 -19.09 13.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.245 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.0 -60.98 2.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.175 0.512 . . . . 0.0 111.501 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.827 HG11 ' OE2' ' A' ' 23' ' ' GLU . 8.5 p -51.53 -26.32 6.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.322 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -72.09 -31.81 66.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.533 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.598 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -44.61 -28.78 0.64 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.12 -32.03 9.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.997 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -96.04 -34.52 11.72 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.313 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.884 HD13 ' OH ' ' A' ' 47' ' ' TYR . 5.2 mp -74.74 -59.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.067 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.598 HD12 ' HB1' ' A' ' 11' ' ' ALA . 93.2 mt -74.61 -74.31 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.211 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.9 -54.79 21.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.315 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.06 22.2 25.88 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.526 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.89 -77.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.143 0.497 . . . . 0.0 111.115 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.99 163.95 8.82 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.841 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.44 -164.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.648 2.232 . . . . 0.0 112.42 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -172.41 136.92 0.82 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.13 -35.18 90.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.538 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.827 ' OE2' HG11 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -56.78 -50.55 71.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.883 0.373 . . . . 0.0 110.939 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.7 t -56.95 -26.59 59.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.126 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.9 -51.81 36.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.711 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.87 -39.51 95.57 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.473 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -59.16 -56.76 18.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.288 0.566 . . . . 0.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.56 HD21 ' CG ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -48.66 -30.87 5.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.386 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.31 -53.78 32.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.494 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.93 -25.15 2.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.061 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.455 HE22 HD21 ' A' ' 7' ' ' LEU . 1.9 mt-30 -81.09 -71.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.54 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.45 ' HA ' ' HE1' ' A' ' 35' ' ' PHE . 0.1 OUTLIER 46.39 21.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.754 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 175.52 28.73 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.5 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -135.1 -37.08 0.8 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.998 0.427 . . . . 0.0 111.7 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.56 ' CG ' HD21 ' A' ' 28' ' ' LEU . 17.0 p90 -57.57 -58.29 8.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.403 0.621 . . . . 0.0 111.15 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.3 t -48.12 -33.65 8.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 71.0 mt-30 -54.54 -34.18 61.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 111.127 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.404 ' CB ' HD11 ' A' ' 48' ' ' ILE . 83.2 m-85 -66.19 -21.17 66.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.968 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.417 ' HA ' ' CD1' ' A' ' 48' ' ' ILE . . . -56.23 -21.7 25.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.728 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.2 -21.07 14.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.23 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -70.83 127.21 92.02 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.802 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.47 -42.62 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.48 2.12 . . . . 0.0 112.525 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -40.11 76.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.964 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.67 ' CD1' HCM2 ' A' ' 68' ' ' PGM . 45.8 m-85 -95.18 15.65 18.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.239 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.57 -25.08 76.27 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.642 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -71.36 -27.76 63.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.913 0.387 . . . . 0.0 110.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.884 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.2 t80 -73.38 -46.11 50.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.99 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 1.054 HG23 HCE2 ' A' ' 68' ' ' PGM . 26.9 mt -71.37 -30.46 39.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.651 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -80.73 22.88 0.56 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.714 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -81.15 149.93 67.15 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.611 179.103 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.55 -44.62 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.322 2.015 . . . . 0.0 112.193 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 5.3 m80 -80.36 -16.77 53.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.621 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -54.47 -48.89 71.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.204 0.526 . . . . 0.0 111.449 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.686 ' CG ' HCB2 ' A' ' 68' ' ' PGM . 43.6 mtm180 -58.6 -38.39 77.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.281 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -67.07 -42.21 85.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.791 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.02 -47.47 85.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.969 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.561 HD11 HCF2 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -61.28 -49.85 75.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.978 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -62.02 -42.71 99.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.524 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -52.4 -33.98 46.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.487 0.661 . . . . 0.0 109.952 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.17 -33.46 38.32 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.385 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.54 55.73 16.5 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.549 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.72 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -113.87 -83.57 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 179.49 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.72 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.74 159.63 44.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.239 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.444 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 8.6 p -109.8 138.71 20.76 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.667 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.69 ' HG3' HCC2 ' A' ' 68' ' ' PGM . 17.5 Cg_endo -56.42 -160.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.444 2.096 . . . . 0.0 112.151 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 30.8 m80 59.02 32.09 21.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.544 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.922 -179.811 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 68' ' ' PGM . . . . . 1.054 HCE2 HG23 ' A' ' 48' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.821 0.343 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 m -106.26 -67.4 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -161.71 108.04 1.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.792 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -83.03 -26.37 31.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 m -67.77 -13.06 61.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.468 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 27' ' ' ASN . 0.4 OUTLIER -83.6 -31.58 26.21 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.111 0.481 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.625 HD11 ' OE1' ' A' ' 31' ' ' GLN . 0.8 OUTLIER -101.79 -13.78 17.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.369 -179.574 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.36 -36.96 23.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.067 0.461 . . . . 0.0 111.295 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 p -59.05 -25.18 29.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.146 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -84.04 -37.52 22.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.4 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.625 ' HB2' ' HE2' ' A' ' 47' ' ' TYR . . . -47.84 -27.88 2.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.536 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -51.43 -29.87 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.416 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ALA . . . . . 0.585 ' HB2' ' H ' ' A' ' 19' ' ' LYS . . . -140.58 21.27 2.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.449 ' CG2' ' HA ' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -80.22 -45.03 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.81 0.338 . . . . 0.0 111.253 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.471 HD23 ' HB3' ' A' ' 46' ' ' GLN . 2.2 mp -80.2 -68.07 0.71 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.1 m -79.43 -64.08 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLY . . . . . 0.503 ' HA2' ' HB1' ' A' ' 13' ' ' ALA . . . 114.09 49.07 0.55 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.497 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.33 99.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.096 0.474 . . . . 0.0 111.216 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.585 ' H ' ' HB2' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -178.97 94.92 0.21 Allowed Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.942 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -67.0 -167.26 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.438 2.092 . . . . 0.0 112.238 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -172.45 144.38 1.5 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.812 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.04 -29.1 61.89 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.604 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -48.39 -31.86 6.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.842 0.353 . . . . 0.0 111.144 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 41.3 t -53.86 -25.11 18.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.342 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.79 -50.57 14.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.677 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.63 -32.83 84.75 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.511 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASN . . . . . 0.405 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 34.5 m120 -66.39 -64.72 0.8 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.918 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.617 HD11 HD22 ' A' ' 62' ' ' LEU . 1.2 pp -50.76 -28.7 9.75 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.43 -42.62 74.43 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.743 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.83 -23.99 20.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.384 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.625 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -80.89 -71.56 0.46 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.536 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.519 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 48.66 19.8 0.28 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.827 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -176.62 26.6 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.163 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.528 ' HA ' ' HG2' ' A' ' 37' ' ' GLN . 3.5 t -135.27 -38.08 0.77 Allowed 'General case' 0 N--CA 1.443 -0.776 0 CA-C-O 120.869 0.366 . . . . 0.0 111.802 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.519 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 4.6 p90 -56.09 -53.17 60.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.495 0.664 . . . . 0.0 111.445 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 t -55.73 -49.61 72.61 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.334 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLN . . . . . 0.528 ' HG2' ' HA ' ' A' ' 34' ' ' CYS . 2.0 pt20 -67.65 -26.23 66.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.224 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.2 -27.91 67.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.716 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.567 ' HB2' ' CB ' ' A' ' 65' ' ' PRO . . . -56.0 -20.13 15.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.805 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.05 -23.6 20.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.864 0.364 . . . . 0.0 111.23 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.66 112.1 9.42 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.042 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -89.23 105.9 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.918 2.412 . . . . 0.0 112.474 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.75 -45.27 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.059 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.654 ' OH ' HCP3 ' A' ' 68' ' ' PGM . 47.9 m-85 -75.54 -62.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 57.52 30.61 62.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.388 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLN . . . . . 0.471 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.7 OUTLIER -164.16 -40.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.995 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.68 ' CE2' HCO1 ' A' ' 68' ' ' PGM . 1.7 t80 -59.5 -54.03 51.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.935 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.694 ' O ' HCF1 ' A' ' 68' ' ' PGM . 15.3 mt -74.61 -47.83 37.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.449 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.406 ' HA ' HCB2 ' A' ' 68' ' ' PGM . 40.5 mtm180 -80.76 28.46 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.884 0.373 . . . . 0.0 111.923 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.485 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -80.94 151.49 70.59 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.539 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.45 -42.48 0.89 Allowed 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.223 1.948 . . . . 0.0 112.185 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.29 -26.36 38.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.492 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.485 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -57.91 -52.47 65.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.193 0.521 . . . . 0.0 111.411 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.735 ' HG3' HCE1 ' A' ' 68' ' ' PGM . 1.5 ttp180 -54.12 -32.45 55.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.229 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.9 -41.09 71.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.629 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.91 -49.12 78.94 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.7 HD13 HCG1 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -59.67 -50.23 74.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.181 0.515 . . . . 0.0 110.872 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.4 m -60.43 -44.27 95.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.576 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.87 -32.51 32.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.484 0.659 . . . . 0.0 109.875 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -80.12 -35.63 36.48 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.314 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.29 58.27 7.45 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.401 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.663 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -116.99 -76.49 0.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.644 0.259 . . . . 0.0 110.988 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.663 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.51 -170.68 3.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.052 0.453 . . . . 0.0 111.684 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.541 HG13 ' HD2' ' A' ' 65' ' ' PRO . 61.7 t -148.21 139.79 13.99 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.849 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.567 ' CB ' ' HB2' ' A' ' 39' ' ' ALA . 17.9 Cg_endo -58.02 -160.66 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.466 2.111 . . . . 0.0 112.145 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 95.1 m-70 60.7 35.95 19.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.836 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.946 -179.924 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 68' ' ' PGM . . . . . 0.735 HCE1 ' HG3' ' A' ' 54' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.831 0.348 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.0 m 61.37 104.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.903 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.481 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 5.9 mt-30 -62.35 -21.54 65.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.177 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . 71.56 8.68 6.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.611 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 12.69 2.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 111.185 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -81.08 -20.24 41.95 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.834 0.35 . . . . 0.0 111.227 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.642 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.4 mt -96.9 -17.45 20.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.356 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -48.05 -54.04 14.4 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.178 0.513 . . . . 0.0 111.54 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.77 HG11 ' OE1' ' A' ' 23' ' ' GLU . 10.1 p -53.66 -25.46 11.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 t -77.15 -29.84 54.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.61 -30.84 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.438 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.3 t -50.26 -31.24 13.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.994 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.36 -29.78 14.27 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.333 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.84 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.3 mp -76.32 -67.54 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.975 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.11 -77.26 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.308 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -51.78 -59.27 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.183 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.88 28.77 7.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.381 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.36 -78.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.09 0.471 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.14 153.98 1.63 Allowed Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.867 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.62 -177.92 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 0.0 112.233 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -174.76 135.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.23 -26.73 56.7 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.502 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.77 ' OE1' HG11 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -57.05 -48.02 79.56 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.511 ' O ' HD23 ' A' ' 28' ' ' LEU . 53.5 t -54.22 -29.35 46.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.57 -55.88 7.8 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.65 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.39 -31.07 59.41 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.413 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -70.36 -66.21 0.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.074 0.464 . . . . 0.0 111.02 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.631 HD11 ' CD2' ' A' ' 62' ' ' LEU . 3.8 pp -52.98 -25.76 13.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.573 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -44.59 88.12 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.91 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.63 -26.1 12.65 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.318 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.642 ' OE1' HD21 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -81.41 -71.31 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.89 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.478 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 51.66 17.97 0.66 Allowed 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.685 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 177.74 28.57 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.96 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' CYS . . . . . 0.402 ' HB3' ' HB3' ' A' ' 31' ' ' GLN . 3.2 t -137.53 -34.81 0.68 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 120.993 0.425 . . . . 0.0 111.499 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -51.65 -50.45 60.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.424 0.631 . . . . 0.0 111.346 -179.205 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -41.77 63.72 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.968 -1.015 . . . . 0.0 111.203 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -54.72 -29.68 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.282 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -79.44 -22.67 43.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.65 -19.24 15.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.911 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 8.95 26.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.399 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -80.04 131.02 64.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.657 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.66 -59.12 0.15 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.506 2.137 . . . . 0.0 112.812 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -27.32 27.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.344 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.672 ' CZ ' HCP2 ' A' ' 68' ' ' PGM . 3.8 m-30 -97.66 15.54 23.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.257 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -34.56 87.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.615 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.57 -26.63 61.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.84 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.0 t80 -75.17 -46.44 34.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.743 ' CD1' HCJ2 ' A' ' 68' ' ' PGM . 24.8 mm -70.27 -36.94 69.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.586 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -80.84 24.39 0.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.617 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.18 153.67 71.93 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.481 179.081 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.431 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 12.7 Cg_endo -81.17 -42.55 0.12 Allowed 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.363 2.042 . . . . 0.0 112.053 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.73 -18.11 48.83 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.761 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.617 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -57.42 -53.52 57.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.288 0.565 . . . . 0.0 111.374 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.67 -33.57 70.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.167 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -69.71 -41.71 74.98 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.701 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -60.4 -48.88 79.84 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.868 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.558 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -61.42 -48.12 82.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.883 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.3 m -61.28 -43.53 98.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.456 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.93 -31.72 29.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.526 0.679 . . . . 0.0 109.83 178.889 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.411 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -78.66 -33.7 46.91 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.379 179.387 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.11 57.58 6.81 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.603 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.643 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -119.04 -80.85 0.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 110.651 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.643 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.54 167.96 25.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.402 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.405 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.3 p -109.85 137.37 20.43 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.987 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.405 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 32.9 Cg_endo -62.92 -163.26 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.363 2.042 . . . . 0.0 112.118 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 78.4 m80 56.42 35.32 25.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.869 -179.938 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 68' ' ' PGM . . . . . 0.743 HCJ2 ' CD1' ' A' ' 48' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.82 0.343 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -157.42 -60.59 0.09 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.4 OUTLIER -161.25 -42.88 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.0 -179.874 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . 70.48 22.26 5.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.215 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.85 -19.83 6.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.43 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLN . . . . . 0.451 ' OE1' ' HB3' ' A' ' 30' ' ' ALA . 12.2 mm-40 -75.29 -6.93 52.38 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.584 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.859 HD13 HCK1 ' A' ' 68' ' ' PGM . 4.0 mt -116.14 -20.32 9.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.569 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.19 -50.48 37.91 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.172 0.511 . . . . 0.0 111.392 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.586 HG21 ' OE1' ' A' ' 23' ' ' GLU . 11.4 p -57.21 -22.83 17.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.39 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.464 ' SG ' HG21 ' A' ' 56' ' ' THR . 3.6 t -81.79 -33.32 30.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.63 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.05 -29.02 0.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.426 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.95 -45.56 74.92 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.893 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.24 -28.09 42.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.336 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.529 HD13 ' CZ ' ' A' ' 47' ' ' TYR . 2.0 mp -70.21 -63.21 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.75 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mt -69.85 -75.02 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.326 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.03 -64.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.227 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.94 32.83 6.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.303 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -53.68 39.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.208 0.528 . . . . 0.0 111.167 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.52 157.85 0.61 Allowed Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.767 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.28 -179.2 2.54 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.498 2.132 . . . . 0.0 112.155 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.94 129.76 3.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.921 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.12 -28.94 59.08 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.457 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.586 ' OE1' HG21 ' A' ' 9' ' ' VAL . 1.6 tt0 -54.92 -47.18 74.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.925 0.393 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.52 ' O ' HD23 ' A' ' 28' ' ' LEU . 48.3 t -54.6 -30.21 54.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.015 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.7 t -76.72 -36.31 57.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.524 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.08 -32.01 37.11 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.611 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -65.87 -61.01 2.3 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.993 0.425 . . . . 0.0 111.026 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.803 HD11 ' CD2' ' A' ' 62' ' ' LEU . 3.9 pp -50.59 -27.41 6.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.508 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -44.16 67.7 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.704 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.451 ' HB3' ' OE1' ' A' ' 6' ' ' GLN . . . -55.51 -23.83 28.33 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.087 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -81.08 -71.73 0.46 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.65 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLN . . . . . 0.483 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 49.86 19.06 0.4 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.904 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 179.14 27.8 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.177 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.4 -34.58 0.7 Allowed 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.916 0.388 . . . . 0.0 111.702 -179.28 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 1.5 p90 -53.18 -52.28 59.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.389 0.614 . . . . 0.0 111.369 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -51.61 -38.94 56.92 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.233 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -56.43 -28.27 58.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.264 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' TYR . . . . . 0.407 ' CG ' HCK2 ' A' ' 68' ' ' PGM . 43.4 m-85 -77.14 -28.2 54.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.006 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB2' ' CB ' ' A' ' 65' ' ' PRO . . . -52.62 -24.51 8.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.542 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.77 -23.73 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.175 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -57.94 109.27 1.67 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.036 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -83.79 97.95 0.78 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.699 2.266 . . . . 0.0 112.361 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.96 -45.39 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.816 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.443 ' CZ ' HCN1 ' A' ' 68' ' ' PGM . 91.0 m-85 -90.1 -62.62 1.42 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.836 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.65 -58.29 3.8 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.777 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -69.57 -13.57 62.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.614 0.245 . . . . 0.0 111.233 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.533 ' CE2' HCN2 ' A' ' 68' ' ' PGM . 2.7 t80 -80.07 -55.65 4.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.824 0.345 . . . . 0.0 111.119 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.604 ' O ' HCC2 ' A' ' 68' ' ' PGM . 37.8 mm -66.76 -55.8 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.348 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.64 30.55 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 111.676 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.472 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.71 160.53 66.58 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.701 179.41 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.408 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 11.1 Cg_endo -81.05 -44.2 0.1 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.466 2.111 . . . . 0.0 111.917 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.81 -24.53 38.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.705 -179.283 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.66 ' HB1' HCD1 ' A' ' 68' ' ' PGM . . . -55.7 -50.21 70.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.204 0.526 . . . . 0.0 111.347 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.1 mtm180 -56.79 -32.49 65.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.219 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -68.02 -40.06 83.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.466 HG21 ' SG ' ' A' ' 24' ' ' CYS . 1.2 m -58.76 -50.92 72.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.876 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.706 ' CD1' HCD2 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -56.47 -48.81 76.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.6 m -63.14 -41.05 99.23 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.442 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.2 t -52.93 -36.15 59.42 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.396 0.617 . . . . 0.0 109.918 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -32.18 37.69 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.104 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.66 53.48 31.23 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.846 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.803 ' CD2' HD11 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -112.25 -78.84 0.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.806 0.336 . . . . 0.0 110.786 179.239 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.763 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.65 -164.28 1.98 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.436 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.499 HG13 ' HD2' ' A' ' 65' ' ' PRO . 33.7 t -137.1 139.19 27.62 Favored Pre-proline 0 N--CA 1.452 -0.373 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.813 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.499 ' HD2' HG13 ' A' ' 64' ' ' VAL . 17.9 Cg_endo -56.69 -160.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.54 2.16 . . . . 0.0 112.305 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.602 ' CE1' HC91 ' A' ' 68' ' ' PGM . 15.8 m80 67.49 43.4 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.012 -179.936 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 68' ' ' PGM . . . . . 0.859 HCK1 HD13 ' A' ' 7' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.808 0.337 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 96.2 m -88.29 63.5 7.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.857 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -60.85 107.58 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.868 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -88.2 11.83 15.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.751 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.7 m -109.78 -23.25 11.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.1 -11.18 60.63 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.228 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.861 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.2 mt -108.59 -17.92 13.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.455 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.38 -35.53 19.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.086 0.469 . . . . 0.0 111.236 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' VAL . . . . . 0.514 HG21 ' OE1' ' A' ' 23' ' ' GLU . 9.1 p -65.05 -24.42 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.281 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.08 -32.07 26.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.435 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.471 ' HB2' HCP3 ' A' ' 68' ' ' PGM . . . -43.89 -30.08 0.64 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.389 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -53.13 -38.44 62.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.691 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.38 -40.01 21.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.19 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ILE . . . . . 0.672 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.4 mp -66.18 -58.69 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.878 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -53.68 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.463 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 t -70.69 -79.64 0.06 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.19 43.14 0.13 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.445 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.95 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 111.075 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 141.79 0.73 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.889 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PRO . . . . . 0.562 ' HB3' HG23 ' A' ' 56' ' ' THR . 54.4 Cg_exo -52.01 -179.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.459 2.106 . . . . 0.0 112.297 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.22 139.64 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.96 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.76 -25.22 55.52 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLU . . . . . 0.514 ' OE1' HG21 ' A' ' 9' ' ' VAL . 4.3 tm-20 -55.25 -48.52 73.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 120.938 0.399 . . . . 0.0 110.965 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.9 t -57.15 -35.97 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.068 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.551 ' HA ' HD21 ' A' ' 28' ' ' LEU . 69.7 m -65.11 -40.49 94.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.53 -42.52 98.88 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.748 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -65.09 -61.26 2.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.03 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 25' ' ' CYS . 4.6 pp -51.3 -25.8 6.42 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.45 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -56.16 25.46 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.305 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.55 -25.88 3.07 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.149 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . 0.861 ' OE1' HD21 ' A' ' 7' ' ' LEU . 1.4 mt-30 -81.75 -71.9 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.789 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.01 20.66 0.12 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.518 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.21 -81.02 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.9 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -58.94 -37.92 77.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.189 0.519 . . . . 0.0 110.54 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' PHE . . . . . 0.565 ' HZ ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -50.08 -41.68 48.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.152 178.734 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.8 t -75.78 -33.01 60.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.605 178.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -62.46 -32.64 73.54 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.905 179.697 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -59.18 -19.96 49.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.465 ' HB1' ' O ' ' A' ' 65' ' ' PRO . . . -51.32 -25.11 5.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.8 0.333 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.61 -22.33 12.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.829 ' OD1' HG23 ' A' ' 43' ' ' THR . 51.8 t0 -59.63 114.43 9.5 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.792 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.43 3.32 7.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.547 2.165 . . . . 0.0 113.071 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . 0.829 HG23 ' OD1' ' A' ' 41' ' ' ASP . 41.0 p -51.2 -41.13 60.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.819 0.342 . . . . 0.0 111.075 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' TYR . . . . . 0.671 ' CE2' HCN1 ' A' ' 68' ' ' PGM . 56.7 m-85 -105.75 -62.2 1.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.762 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.47 -59.45 4.38 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -70.54 -20.57 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.717 0.294 . . . . 0.0 111.138 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.768 ' CE1' HCJ1 ' A' ' 68' ' ' PGM . 7.2 t80 -74.82 -49.91 19.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.937 0.399 . . . . 0.0 110.865 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.451 ' CD1' HCE2 ' A' ' 68' ' ' PGM . 32.8 mm -68.25 -53.22 30.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.264 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.2 mtt180 -80.64 30.56 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 111.797 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . 0.594 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -80.72 147.59 63.14 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.757 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.3 -42.06 2.16 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.377 2.051 . . . . 0.0 112.281 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -80.15 -18.93 48.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.376 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.594 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -59.08 -55.72 31.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.218 0.533 . . . . 0.0 111.293 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -57.25 -33.9 68.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.124 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -66.7 -49.38 66.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.754 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' THR . . . . . 0.562 HG23 ' HB3' ' A' ' 20' ' ' PRO . 1.2 m -59.42 -48.23 82.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.515 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.972 HD13 HCD1 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -62.94 -48.14 80.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.674 179.68 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.9 m -61.66 -42.77 99.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.543 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.7 t -51.35 -37.55 48.53 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.48 0.657 . . . . 0.0 109.694 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' CYS . . . . . 0.528 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.57 -39.22 28.04 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.192 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 59.5 49.97 72.82 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.482 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.908 HD12 ' N ' ' A' ' 63' ' ' ALA . 1.7 pp -115.36 -40.88 3.35 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.908 ' N ' HD12 ' A' ' 62' ' ' LEU . . . -150.78 175.01 12.39 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.02 0.438 . . . . 0.0 111.628 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.818 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.4 OUTLIER -146.44 148.14 33.2 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.755 179.917 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 65' ' ' PRO . . . . . 0.818 ' HD2' HG22 ' A' ' 64' ' ' VAL . 69.2 Cg_endo -75.9 33.05 0.39 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.196 2.598 . . . . 0.0 113.287 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.4 ' H ' HG13 ' A' ' 64' ' ' VAL . 34.0 m80 -128.63 29.72 5.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.682 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.3 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.916 -179.904 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 68' ' ' PGM . . . . . 0.972 HCD1 HD13 ' A' ' 57' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 . . . . . 0 C--O 1.231 0.112 0 CA-C-O 120.784 0.326 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.19 32.52 20.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.871 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -149.17 -36.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.31 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.26 -14.83 62.57 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.858 0.361 . . . . 0.0 111.166 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.805 HD21 ' OE1' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -108.57 -20.23 13.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 -179.431 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.87 -43.78 28.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.115 0.483 . . . . 0.0 111.486 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.6 p -56.45 -25.23 20.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.193 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -88.54 -30.78 19.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.61 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.2 -30.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.37 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.1 m -55.04 -35.38 64.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.783 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.41 -43.3 14.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.303 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.549 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.1 mp -60.9 -53.42 49.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 26.9 mt -73.7 -80.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 t -60.22 -75.32 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.946 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.5 37.34 0.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.591 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.22 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.128 0.489 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.99 138.01 3.15 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.831 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.71 -171.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.447 2.098 . . . . 0.0 112.321 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 m -174.39 140.99 0.67 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.82 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.43 -44.22 93.57 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.582 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -48.81 -36.31 16.46 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 120.905 0.383 . . . . 0.0 111.059 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.1 t -53.7 -63.29 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.291 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.425 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 12.2 p -53.48 -25.21 15.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.272 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.47 -38.01 18.83 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -56.5 -50.32 72.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.13 0.49 . . . . 0.0 111.613 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 1.028 HD11 HD13 ' A' ' 62' ' ' LEU . 3.9 pp -51.36 -37.86 50.22 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.337 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.512 ' HD3' HD22 ' A' ' 62' ' ' LEU . 34.5 mmm-85 -54.24 -47.14 72.54 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.395 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.46 -28.44 13.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.304 0.573 . . . . 0.0 109.592 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.805 ' OE1' HD21 ' A' ' 7' ' ' LEU . 2.7 mt-30 -81.93 -74.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.454 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.429 HE21 ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 49.01 19.62 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.615 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -130.08 -82.45 0.28 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.55 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.8 t -61.4 -34.62 75.67 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.417 0.627 . . . . 0.0 110.181 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.974 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -56.31 -37.16 69.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.464 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.22 -51.28 21.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.067 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.55 HE21 ' HA ' ' A' ' 34' ' ' CYS . 5.1 pt20 -70.59 -23.07 62.51 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.219 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.55 -22.49 13.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.742 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.86 -19.55 12.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.758 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -94.65 -23.17 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 111.016 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -57.39 116.32 13.46 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.772 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.67 -44.23 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.523 2.149 . . . . 0.0 112.722 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 p -51.2 -41.84 60.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.228 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 42.9 m-85 -95.77 15.14 20.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.197 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.65 -27.91 62.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.575 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.6 -25.84 62.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.776 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.549 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.3 t80 -75.22 -51.76 12.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.0 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 29.5 mt -69.72 -42.68 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.545 -179.527 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.82 27.97 0.36 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.499 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.83 164.56 50.39 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.447 179.153 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -81.01 -46.95 0.08 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.443 2.095 . . . . 0.0 111.826 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.513 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -80.89 -17.75 49.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.701 -179.303 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -61.49 -58.96 6.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.178 0.513 . . . . 0.0 111.445 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 6.2 mtt180 -57.96 -32.26 67.66 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.067 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -66.27 -44.79 82.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.933 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -60.24 -51.57 68.97 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.847 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.472 HD21 ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -63.8 -44.6 92.84 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.154 0.502 . . . . 0.0 110.787 179.879 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.3 m -63.58 -41.86 98.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.572 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.4 t -51.45 -38.62 54.63 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.534 0.683 . . . . 0.0 109.592 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.526 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.64 -40.63 25.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.362 178.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.19 54.91 31.07 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.104 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 1.028 HD13 HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -109.78 -60.03 1.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.398 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.851 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.77 132.6 15.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 111.602 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.431 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 9.9 p -109.91 137.73 20.55 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.431 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 19.4 Cg_endo -57.19 -160.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.485 2.123 . . . . 0.0 112.246 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 m80 61.97 31.91 17.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.764 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.873 179.979 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.885 0.374 . . . . 0.0 110.845 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.55 19.19 9.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.347 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.21 -24.93 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.359 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -69.86 -16.59 63.28 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.182 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.74 HD11 ' OE1' ' A' ' 31' ' ' GLN . 1.1 mt -99.99 -24.88 14.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.218 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.07 -38.09 23.25 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.092 0.473 . . . . 0.0 111.329 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.536 HG11 ' OE1' ' A' ' 23' ' ' GLU . 11.1 p -60.86 -25.93 37.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.165 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.65 -32.69 25.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HA ' HD13 ' A' ' 14' ' ' ILE . . . -43.97 -29.24 0.55 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.458 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 71.2 m -53.07 -43.38 66.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.847 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.83 -25.78 34.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.311 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 53' ' ' ALA . 2.4 mp -68.7 -62.01 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.771 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -74.06 -79.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.208 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -62.62 1.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.062 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.5 36.45 4.33 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.432 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.574 ' O ' ' HG3' ' A' ' 19' ' ' LYS . . . -57.63 -79.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.899 0.38 . . . . 0.0 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -158.95 145.9 12.91 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.558 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.08 -174.69 0.81 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.457 2.105 . . . . 0.0 112.201 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.7 p -173.41 138.57 0.71 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.03 -27.67 60.06 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.536 ' OE1' HG11 ' A' ' 9' ' ' VAL . 2.6 tt0 -53.15 -43.09 66.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.895 0.378 . . . . 0.0 111.081 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.628 ' O ' HD23 ' A' ' 28' ' ' LEU . 47.7 t -55.67 -23.51 28.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.393 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.41 ' HA ' HD21 ' A' ' 62' ' ' LEU . 87.6 m -78.02 -45.58 23.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.846 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.95 -35.28 58.14 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -62.67 -60.22 3.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.185 0.517 . . . . 0.0 110.915 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.844 HD13 ' CE2' ' A' ' 35' ' ' PHE . 1.2 pp -54.47 -31.35 55.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.675 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.612 ' HD3' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -59.69 -47.47 85.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.216 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.16 -25.82 3.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.564 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.74 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -81.36 -72.66 0.42 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.3 20.68 0.16 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.588 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.97 -80.49 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.919 -0.657 . . . . 0.0 112.195 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.545 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.6 t -59.52 -36.22 75.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.408 0.623 . . . . 0.0 110.416 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.844 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -57.18 -43.96 83.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.441 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.93 -33.94 77.22 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.504 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.545 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 28.3 mt-30 -59.03 -35.01 72.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.383 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.85 -15.4 54.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.334 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.551 ' HB1' ' HB2' ' A' ' 65' ' ' PRO . . . -47.99 -28.93 3.03 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.938 0.399 . . . . 0.0 111.519 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -118.79 -27.99 5.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.233 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.838 ' OD1' HG23 ' A' ' 43' ' ' THR . 19.0 t0 -60.15 107.51 1.06 Allowed Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.853 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -82.09 38.16 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.917 2.411 . . . . 0.0 112.744 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.838 HG23 ' OD1' ' A' ' 41' ' ' ASP . 16.4 p -67.58 -38.13 83.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.902 0.382 . . . . 0.0 110.736 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -98.31 -55.09 2.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.38 -56.63 5.06 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.622 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -75.7 -21.14 57.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.704 0.288 . . . . 0.0 111.196 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.459 ' CD2' HG21 ' A' ' 14' ' ' ILE . 3.4 t80 -80.02 -51.72 8.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.256 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 38.9 mm -65.15 -59.24 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.185 -179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -80.45 31.06 0.28 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.867 0.365 . . . . 0.0 111.541 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.547 ' HB3' ' HB3' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -80.77 147.51 62.72 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 179.548 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -80.12 -42.01 0.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.563 2.176 . . . . 0.0 112.692 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -80.25 -30.23 38.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.834 -179.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.547 ' HB3' ' HB3' ' A' ' 50' ' ' SER . . . -59.25 -54.92 41.32 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.262 0.553 . . . . 0.0 111.466 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -54.73 -35.78 64.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.09 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -68.79 -42.0 77.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.545 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -61.0 -50.85 71.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -62.95 -46.56 87.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.195 0.521 . . . . 0.0 110.631 179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.5 m -62.14 -42.49 99.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.719 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -51.74 -39.52 58.61 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.434 0.635 . . . . 0.0 109.762 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.784 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.67 -34.87 34.44 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.565 179.14 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 56.06 46.59 84.49 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.478 -0.868 . . . . 0.0 111.888 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.968 HD12 ' N ' ' A' ' 63' ' ' ALA . 3.5 pp -109.9 -40.88 4.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.592 0.234 . . . . 0.0 111.502 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.968 ' N ' HD12 ' A' ' 62' ' ' LEU . . . -150.43 159.08 44.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.016 0.436 . . . . 0.0 111.643 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.786 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.5 OUTLIER -150.16 161.69 30.13 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.396 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.786 ' HD2' HG22 ' A' ' 64' ' ' VAL . 65.7 Cg_endo -77.74 31.71 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.012 2.475 . . . . 0.0 113.343 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -132.79 43.17 3.0 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.725 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 23.1 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.977 -179.913 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.836 0.35 . . . . 0.0 110.952 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 61.94 31.98 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.061 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 m -122.2 -39.78 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -76.55 -5.07 46.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.477 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.918 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.8 mt -114.37 -19.36 11.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.46 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.41 -52.81 15.72 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.175 0.512 . . . . 0.0 111.424 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.553 HG21 ' OE1' ' A' ' 23' ' ' GLU . 10.3 p -57.35 -22.49 17.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.369 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -88.56 -32.49 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.495 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.03 -30.02 0.68 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.39 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -53.37 -43.64 67.97 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.5 -32.96 48.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.073 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.791 HD13 ' OH ' ' A' ' 47' ' ' TYR . 3.6 mp -70.66 -62.48 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.889 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -68.11 -77.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.228 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.01 -70.2 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.172 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.25 27.22 4.29 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.477 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -77.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.142 0.496 . . . . 0.0 111.103 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.29 143.52 1.56 Allowed Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.858 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.64 -170.8 0.56 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.522 2.148 . . . . 0.0 112.37 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.32 -162.61 0.54 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.423 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -102.5 -27.48 6.78 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.467 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.553 ' OE1' HG21 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -56.85 -50.01 73.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.843 0.354 . . . . 0.0 110.966 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.539 ' SG ' HD23 ' A' ' 28' ' ' LEU . 43.3 t -52.36 -27.87 17.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.163 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 29' ' ' ARG . 60.9 m -67.92 -61.0 2.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.768 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.1 -29.7 56.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.8 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -70.6 -67.67 0.48 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.073 0.463 . . . . 0.0 110.918 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.721 HD11 HD13 ' A' ' 62' ' ' LEU . 3.9 pp -56.26 -28.1 57.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.587 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.761 ' HD3' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.75 -47.26 86.0 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 121.166 0.507 . . . . 0.0 110.41 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.25 -24.23 10.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.265 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.918 ' OE1' HD21 ' A' ' 7' ' ' LEU . 12.3 mt-30 -81.07 -71.86 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.639 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.446 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 48.28 20.03 0.25 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.602 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.7 -81.73 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -59.14 -36.01 74.48 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.391 0.615 . . . . 0.0 110.112 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.652 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -63.71 -40.15 96.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.171 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.88 -55.7 13.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.546 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.5 pp0? -62.81 -24.87 67.97 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.707 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -23.17 14.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.586 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 65' ' ' PRO . . . -55.49 -21.69 17.64 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.687 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.55 15.75 18.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.02 114.04 43.29 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.29 -21.25 13.69 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.529 2.153 . . . . 0.0 112.749 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.78 68.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.722 0.296 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -89.71 -75.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.488 179.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.02 -55.02 3.09 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.189 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.34 -24.22 65.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 111.005 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.791 ' OH ' HD13 ' A' ' 14' ' ' ILE . 8.1 t80 -76.44 -53.49 8.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.788 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.461 HG21 ' HA ' ' A' ' 39' ' ' ALA . 36.6 mm -69.56 -51.29 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.209 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -80.67 31.0 0.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.842 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.74 148.41 65.22 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.638 179.352 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.32 -44.35 4.91 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.251 1.968 . . . . 0.0 112.01 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -80.22 -17.82 51.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.382 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.671 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -55.37 -50.89 68.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.219 0.533 . . . . 0.0 111.273 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.607 ' NH2' HG23 ' A' ' 64' ' ' VAL . 0.1 OUTLIER -54.86 -47.49 74.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.1 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.11 -41.57 90.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.598 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.5 m -57.51 -37.26 72.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.641 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.695 HD21 ' HD3' ' A' ' 65' ' ' PRO . 0.1 OUTLIER -61.0 -59.39 5.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.774 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -59.46 -44.03 93.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.03 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.0 t -52.4 -29.83 26.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.625 0.726 . . . . 0.0 109.363 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.857 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -74.3 -39.1 63.13 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.901 179.203 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.92 55.66 6.29 Favored Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.843 -0.694 . . . . 0.0 113.387 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.857 HD21 ' SG ' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -134.13 -92.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.789 0.295 . . . . 0.0 111.019 179.109 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.619 ' O ' HD23 ' A' ' 57' ' ' LEU . . . -150.32 178.8 8.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 120.868 0.366 . . . . 0.0 111.388 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.881 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.3 OUTLIER -109.9 147.45 36.22 Favored Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.587 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.881 ' HD2' HG22 ' A' ' 64' ' ' VAL . 43.1 Cg_endo -81.83 32.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.966 2.444 . . . . 0.0 113.8 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.606 ' H ' HG13 ' A' ' 64' ' ' VAL . 45.7 m80 -103.13 32.28 3.83 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.713 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.951 -179.946 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.142 0 CA-C-O 120.822 0.344 . . . . 0.0 110.921 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 58.16 23.11 9.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.282 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -123.61 -34.68 3.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.105 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.624 ' O ' HD23 ' A' ' 7' ' ' LEU . 3.1 mm-40 -86.86 48.45 1.65 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.223 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.663 HD11 ' OE1' ' A' ' 31' ' ' GLN . 49.3 mt -151.99 -39.94 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.341 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -45.97 -44.31 14.81 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.089 0.471 . . . . 0.0 111.667 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.754 HG21 ' OE1' ' A' ' 23' ' ' GLU . 11.5 p -55.62 -24.65 16.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.226 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 t -81.38 -30.31 33.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.41 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.18 -30.48 0.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.351 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -51.47 -34.79 37.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.726 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.33 -31.71 17.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.123 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.612 HG21 ' CG ' ' A' ' 47' ' ' TYR . 4.0 mp -74.26 -65.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.16 -74.38 0.11 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.219 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -69.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.138 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.71 25.55 5.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.56 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -77.06 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.177 0.513 . . . . 0.0 111.033 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.6 157.59 3.62 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.828 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.471 ' HB3' HG23 ' A' ' 56' ' ' THR . 29.9 Cg_endo -63.5 -167.03 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.571 2.181 . . . . 0.0 112.202 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.71 144.63 0.84 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.824 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.54 -26.74 62.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.585 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.754 ' OE1' HG21 ' A' ' 9' ' ' VAL . 0.5 OUTLIER -59.94 -56.29 23.5 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.93 0.395 . . . . 0.0 110.817 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -55.39 -26.05 39.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.168 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.53 -48.49 72.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.855 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.99 -25.08 60.53 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.725 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.77 -62.74 1.39 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.129 0.49 . . . . 0.0 110.972 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.581 HD12 ' HD2' ' A' ' 29' ' ' ARG . 2.8 pp -54.76 -24.87 24.47 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.588 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.96 ' NE ' HD13 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -64.34 -52.44 58.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.19 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.75 -25.39 2.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.477 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.663 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -81.41 -71.6 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.914 179.416 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.442 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 48.76 19.25 0.24 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.694 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.0 -81.87 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.72 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.599 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.7 t -60.7 -33.78 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.43 0.633 . . . . 0.0 110.253 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.441 ' CD1' ' N ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -55.54 -45.75 77.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.671 179.611 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.441 ' N ' ' CD1' ' A' ' 35' ' ' PHE . 4.7 t -64.43 -56.3 15.17 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.937 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.599 HE21 ' HA ' ' A' ' 34' ' ' CYS . 15.3 pt20 -66.05 -23.15 66.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.28 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -18.53 31.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HB2' ' HB2' ' A' ' 65' ' ' PRO . . . -51.51 -22.95 3.52 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.284 -0.416 . . . . 0.0 112.031 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -97.53 -24.26 15.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.499 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.46 ' CG ' ' HG1' ' A' ' 43' ' ' THR . 10.4 t70 -57.44 109.1 1.51 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -88.62 -10.07 4.59 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.822 2.348 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.46 ' HG1' ' CG ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER -51.7 -27.77 12.77 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 24.2 m-85 -67.3 -58.92 3.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.897 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.27 80.83 0.74 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.68 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.08 22.46 9.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 0.0 110.865 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.612 ' CG ' HG21 ' A' ' 14' ' ' ILE . 8.4 t80 -65.74 -54.66 24.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.94 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.427 HG13 ' HA ' ' A' ' 39' ' ' ALA . 20.8 mm -71.08 -37.27 66.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.576 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -80.81 25.08 0.46 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.48 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.03 155.79 72.42 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.66 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.432 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 13.1 Cg_endo -81.01 -40.55 0.17 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.365 2.043 . . . . 0.0 111.968 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.489 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.69 -30.83 36.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.593 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.48 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -53.6 -42.02 67.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -65.88 -30.39 70.99 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.785 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.31 -40.1 74.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.707 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.471 HG23 ' HB3' ' A' ' 20' ' ' PRO . 1.3 m -58.06 -49.04 78.27 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.918 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.488 HD22 ' HD3' ' A' ' 65' ' ' PRO . 0.1 OUTLIER -59.14 -50.79 72.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.067 0.461 . . . . 0.0 110.886 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.7 m -60.8 -44.55 96.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.336 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -50.67 -31.28 15.85 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.55 0.69 . . . . 0.0 109.705 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.934 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -76.25 -38.99 55.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.226 179.315 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.61 54.62 5.9 Favored Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.688 -0.768 . . . . 0.0 113.113 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.96 HD13 ' NE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -123.48 -81.0 0.63 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.798 0.332 . . . . 0.0 110.662 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.414 ' O ' HD23 ' A' ' 57' ' ' LEU . . . -150.63 168.45 24.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.503 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.416 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.8 p -109.93 137.94 20.61 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.804 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.559 ' HB2' ' HB2' ' A' ' 39' ' ' ALA . 18.7 Cg_endo -57.73 -160.57 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.34 2.026 . . . . 0.0 112.095 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.3 m80 61.55 31.24 18.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.704 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.026 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.91 179.996 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.834 0.35 . . . . 0.0 110.959 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.36 -27.33 68.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.303 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -27.91 44.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.107 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -70.38 -12.82 61.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.17 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.455 HD21 HE22 ' A' ' 31' ' ' GLN . 0.9 OUTLIER -109.58 -19.09 13.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.245 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.0 -60.98 2.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.175 0.512 . . . . 0.0 111.501 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.827 HG11 ' OE2' ' A' ' 23' ' ' GLU . 8.5 p -51.53 -26.32 6.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.322 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -72.09 -31.81 66.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.533 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.598 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -44.61 -28.78 0.64 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.12 -32.03 9.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.997 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -96.04 -34.52 11.72 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.313 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.884 HD13 ' OH ' ' A' ' 47' ' ' TYR . 5.2 mp -74.74 -59.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.067 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.598 HD12 ' HB1' ' A' ' 11' ' ' ALA . 93.2 mt -74.61 -74.31 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.211 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.9 -54.79 21.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.315 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.4 ' HA2' ' CD2' ' A' ' 52' ' ' HIS . . . 94.06 22.2 25.88 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.526 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.89 -77.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.143 0.497 . . . . 0.0 111.115 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.99 163.95 8.82 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.841 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.44 -164.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.648 2.232 . . . . 0.0 112.42 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -172.41 136.92 0.82 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.13 -35.18 90.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.538 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.827 ' OE2' HG11 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -56.78 -50.55 71.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.883 0.373 . . . . 0.0 110.939 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.7 t -56.95 -26.59 59.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.126 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.9 -51.81 36.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.711 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.87 -39.51 95.57 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.473 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -59.16 -56.76 18.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.288 0.566 . . . . 0.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.56 HD21 ' CG ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -48.66 -30.87 5.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.386 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . 0.509 ' HA ' ' NE2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -66.31 -53.78 32.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.494 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.93 -25.15 2.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.061 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.455 HE22 HD21 ' A' ' 7' ' ' LEU . 1.9 mt-30 -81.09 -71.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.54 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.509 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 46.39 21.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.754 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 175.52 28.73 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.5 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.536 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.3 t -135.1 -37.08 0.8 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.998 0.427 . . . . 0.0 111.7 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.56 ' CG ' HD21 ' A' ' 28' ' ' LEU . 17.0 p90 -57.57 -58.29 8.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.403 0.621 . . . . 0.0 111.15 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.3 t -48.12 -33.65 8.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.536 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 29.5 mt-30 -54.54 -34.18 61.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 111.127 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . 0.404 ' CB ' HD11 ' A' ' 48' ' ' ILE . 83.2 m-85 -66.19 -21.17 66.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.968 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.417 ' HA ' ' CD1' ' A' ' 48' ' ' ILE . . . -56.23 -21.7 25.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.728 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.2 -21.07 14.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.23 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -70.83 127.21 92.02 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.802 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.47 -42.62 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.48 2.12 . . . . 0.0 112.525 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -40.11 76.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.964 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 45.8 m-85 -95.18 15.65 18.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.239 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.57 -25.08 76.27 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.642 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -71.36 -27.76 63.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.913 0.387 . . . . 0.0 110.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.884 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.2 t80 -73.38 -46.11 50.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.99 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.417 ' CD1' ' HA ' ' A' ' 39' ' ' ALA . 26.9 mt -71.37 -30.46 39.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.651 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -80.73 22.88 0.56 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.714 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -81.15 149.93 67.15 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.611 179.103 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.55 -44.62 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.322 2.015 . . . . 0.0 112.193 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.4 ' CD2' ' HA2' ' A' ' 17' ' ' GLY . 13.0 m-70 -80.36 -16.77 53.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.621 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -54.47 -48.89 71.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.204 0.526 . . . . 0.0 111.449 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 43.6 mtm180 -58.6 -38.39 77.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.281 -179.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -67.07 -42.21 85.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.791 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.02 -47.47 85.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.969 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.492 HD23 ' O ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -61.28 -49.85 75.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.978 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -62.02 -42.71 99.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.524 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -52.4 -33.98 46.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.487 0.661 . . . . 0.0 109.952 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.17 -33.46 38.32 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.385 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.54 55.73 16.5 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.549 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.72 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -113.87 -83.57 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 179.49 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.72 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.74 159.63 44.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.239 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.444 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 8.6 p -109.8 138.71 20.76 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.667 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.444 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 17.5 Cg_endo -56.42 -160.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.444 2.096 . . . . 0.0 112.151 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 30.8 m80 59.02 32.09 21.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.544 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.922 -179.811 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.84 0.353 . . . . 0.0 110.792 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -83.03 -26.37 31.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 m -67.77 -13.06 61.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.468 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 27' ' ' ASN . 0.4 OUTLIER -83.6 -31.58 26.21 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.111 0.481 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.625 HD11 ' OE1' ' A' ' 31' ' ' GLN . 0.8 OUTLIER -101.79 -13.78 17.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.369 -179.574 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.36 -36.96 23.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.067 0.461 . . . . 0.0 111.295 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 p -59.05 -25.18 29.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.146 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -84.04 -37.52 22.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.4 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.625 ' HB2' ' HE2' ' A' ' 47' ' ' TYR . . . -47.84 -27.88 2.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.536 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -51.43 -29.87 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.416 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . 0.585 ' HB2' ' H ' ' A' ' 19' ' ' LYS . . . -140.58 21.27 2.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.449 ' CG2' ' HA ' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -80.22 -45.03 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.81 0.338 . . . . 0.0 111.253 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.471 HD23 ' HB3' ' A' ' 46' ' ' GLN . 2.2 mp -80.2 -68.07 0.71 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.1 m -79.43 -64.08 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . 0.503 ' HA2' ' HB1' ' A' ' 13' ' ' ALA . . . 114.09 49.07 0.55 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.497 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.33 99.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.096 0.474 . . . . 0.0 111.216 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.585 ' H ' ' HB2' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -178.97 94.92 0.21 Allowed Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.942 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -67.0 -167.26 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.438 2.092 . . . . 0.0 112.238 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -172.45 144.38 1.5 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.812 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.04 -29.1 61.89 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.604 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -48.39 -31.86 6.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.842 0.353 . . . . 0.0 111.144 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 41.3 t -53.86 -25.11 18.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.342 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.79 -50.57 14.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.677 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.63 -32.83 84.75 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.511 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . 0.405 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 34.5 m120 -66.39 -64.72 0.8 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.918 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.617 HD11 HD22 ' A' ' 62' ' ' LEU . 1.2 pp -50.76 -28.7 9.75 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.43 -42.62 74.43 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.743 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.83 -23.99 20.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.384 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.625 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -80.89 -71.56 0.46 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.536 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.519 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 48.66 19.8 0.28 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.827 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -176.62 26.6 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.163 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.594 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.5 t -135.27 -38.08 0.77 Allowed 'General case' 0 N--CA 1.443 -0.776 0 CA-C-O 120.869 0.366 . . . . 0.0 111.802 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.519 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 4.6 p90 -56.09 -53.17 60.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.495 0.664 . . . . 0.0 111.445 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 t -55.73 -49.61 72.61 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.334 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.594 HE21 ' HA ' ' A' ' 34' ' ' CYS . 23.1 pt20 -67.65 -26.23 66.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.224 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.2 -27.91 67.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.716 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.567 ' HB2' ' CB ' ' A' ' 65' ' ' PRO . . . -56.0 -20.13 15.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.805 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.05 -23.6 20.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.864 0.364 . . . . 0.0 111.23 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.66 112.1 9.42 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.042 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -89.23 105.9 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.918 2.412 . . . . 0.0 112.474 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.75 -45.27 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.059 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -75.54 -62.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 57.52 30.61 62.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.388 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . 0.471 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.7 OUTLIER -164.16 -40.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.995 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.625 ' HE2' ' HB2' ' A' ' 11' ' ' ALA . 1.7 t80 -59.5 -54.03 51.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.935 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 15.3 mt -74.61 -47.83 37.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.449 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.5 mtm180 -80.76 28.46 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.884 0.373 . . . . 0.0 111.923 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.485 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -80.94 151.49 70.59 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.539 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.45 -42.48 0.89 Allowed 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.223 1.948 . . . . 0.0 112.185 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.29 -26.36 38.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.492 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.485 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -57.91 -52.47 65.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.193 0.521 . . . . 0.0 111.411 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.5 ttp180 -54.12 -32.45 55.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.229 -179.745 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.9 -41.09 71.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.629 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.91 -49.12 78.94 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.455 HD23 HD12 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -59.67 -50.23 74.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.181 0.515 . . . . 0.0 110.872 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.4 m -60.43 -44.27 95.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.576 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.87 -32.51 32.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.484 0.659 . . . . 0.0 109.875 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -80.12 -35.63 36.48 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.314 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.29 58.27 7.45 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.401 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.663 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -116.99 -76.49 0.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.644 0.259 . . . . 0.0 110.988 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.663 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.51 -170.68 3.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.052 0.453 . . . . 0.0 111.684 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.541 HG13 ' HD2' ' A' ' 65' ' ' PRO . 61.7 t -148.21 139.79 13.99 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.849 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.567 ' CB ' ' HB2' ' A' ' 39' ' ' ALA . 17.9 Cg_endo -58.02 -160.66 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.466 2.111 . . . . 0.0 112.145 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 61.2 m80 60.7 35.95 19.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.836 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.946 -179.924 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.481 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 5.9 mt-30 . . . . . 0 C--O 1.232 0.151 0 CA-C-O 120.681 0.277 . . . . 0.0 111.177 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . 71.56 8.68 6.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.611 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 12.69 2.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 111.185 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -81.08 -20.24 41.95 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.834 0.35 . . . . 0.0 111.227 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.642 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.4 mt -96.9 -17.45 20.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.356 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -48.05 -54.04 14.4 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.178 0.513 . . . . 0.0 111.54 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.77 HG11 ' OE1' ' A' ' 23' ' ' GLU . 10.1 p -53.66 -25.46 11.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 t -77.15 -29.84 54.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.61 -30.84 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.438 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.3 t -50.26 -31.24 13.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.994 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.36 -29.78 14.27 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.333 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.84 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.3 mp -76.32 -67.54 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.975 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.11 -77.26 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.308 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -51.78 -59.27 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.183 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.88 28.77 7.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.381 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.36 -78.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.09 0.471 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.14 153.98 1.63 Allowed Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.867 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.62 -177.92 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 0.0 112.233 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -174.76 135.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.23 -26.73 56.7 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.502 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.77 ' OE1' HG11 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -57.05 -48.02 79.56 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.511 ' O ' HD23 ' A' ' 28' ' ' LEU . 53.5 t -54.22 -29.35 46.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.57 -55.88 7.8 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.65 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.39 -31.07 59.41 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.413 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -70.36 -66.21 0.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.074 0.464 . . . . 0.0 111.02 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.631 HD11 ' CD2' ' A' ' 62' ' ' LEU . 3.8 pp -52.98 -25.76 13.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.573 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -44.59 88.12 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.91 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.63 -26.1 12.65 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.318 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.642 ' OE1' HD21 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -81.41 -71.31 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.89 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.478 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 51.66 17.97 0.66 Allowed 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.685 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 177.74 28.57 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.96 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.463 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.2 t -137.53 -34.81 0.68 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 120.993 0.425 . . . . 0.0 111.499 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -51.65 -50.45 60.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.424 0.631 . . . . 0.0 111.346 -179.205 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -41.77 63.72 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.968 -1.015 . . . . 0.0 111.203 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.463 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 28.6 mt-30 -54.72 -29.68 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.282 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -79.44 -22.67 43.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.65 -19.24 15.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.911 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 8.95 26.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.399 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -80.04 131.02 64.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.657 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.66 -59.12 0.15 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.506 2.137 . . . . 0.0 112.812 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -27.32 27.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.344 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 3.8 m-30 -97.66 15.54 23.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.257 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -34.56 87.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.615 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.57 -26.63 61.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.84 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.0 t80 -75.17 -46.44 34.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 24.8 mm -70.27 -36.94 69.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.586 -179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -80.84 24.39 0.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.617 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.18 153.67 71.93 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.481 179.081 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.431 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 12.7 Cg_endo -81.17 -42.55 0.12 Allowed 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.363 2.042 . . . . 0.0 112.053 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.73 -18.11 48.83 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.761 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.617 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -57.42 -53.52 57.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.288 0.565 . . . . 0.0 111.374 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.67 -33.57 70.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.167 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -69.71 -41.71 74.98 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.701 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -60.4 -48.88 79.84 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.868 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.558 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -61.42 -48.12 82.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.883 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.3 m -61.28 -43.53 98.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.456 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.93 -31.72 29.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.526 0.679 . . . . 0.0 109.83 178.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.411 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -78.66 -33.7 46.91 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.379 179.387 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.11 57.58 6.81 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.603 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.643 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -119.04 -80.85 0.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 110.651 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.643 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.54 167.96 25.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.402 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.405 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.3 p -109.85 137.37 20.43 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.987 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.405 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 32.9 Cg_endo -62.92 -163.26 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.363 2.042 . . . . 0.0 112.118 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 78.4 m80 56.42 35.32 25.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.869 -179.938 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.4 OUTLIER . . . . . 0 N--CA 1.457 -0.103 0 CA-C-O 120.746 0.307 . . . . 0.0 111.0 . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . 70.48 22.26 5.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.215 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.85 -19.83 6.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.43 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . 0.451 ' OE1' ' HB3' ' A' ' 30' ' ' ALA . 12.2 mm-40 -75.29 -6.93 52.38 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.584 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 4.0 mt -116.14 -20.32 9.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.569 -179.332 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.19 -50.48 37.91 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.172 0.511 . . . . 0.0 111.392 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.586 HG21 ' OE1' ' A' ' 23' ' ' GLU . 11.4 p -57.21 -22.83 17.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.39 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.464 ' SG ' HG21 ' A' ' 56' ' ' THR . 3.6 t -81.79 -33.32 30.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.63 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.05 -29.02 0.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.426 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.95 -45.56 74.92 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.893 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.24 -28.09 42.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.336 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.529 HD13 ' CZ ' ' A' ' 47' ' ' TYR . 2.0 mp -70.21 -63.21 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.75 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mt -69.85 -75.02 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.326 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.03 -64.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.227 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.94 32.83 6.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.303 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -53.68 39.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.208 0.528 . . . . 0.0 111.167 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.52 157.85 0.61 Allowed Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.767 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.28 -179.2 2.54 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.498 2.132 . . . . 0.0 112.155 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.94 129.76 3.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.921 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.12 -28.94 59.08 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.457 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.586 ' OE1' HG21 ' A' ' 9' ' ' VAL . 1.6 tt0 -54.92 -47.18 74.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.925 0.393 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . 0.52 ' O ' HD23 ' A' ' 28' ' ' LEU . 48.3 t -54.6 -30.21 54.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.015 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.7 t -76.72 -36.31 57.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.524 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.08 -32.01 37.11 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.611 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -65.87 -61.01 2.3 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.993 0.425 . . . . 0.0 111.026 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.803 HD11 ' CD2' ' A' ' 62' ' ' LEU . 3.9 pp -50.59 -27.41 6.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.508 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -44.16 67.7 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.704 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.451 ' HB3' ' OE1' ' A' ' 6' ' ' GLN . . . -55.51 -23.83 28.33 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.087 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -81.08 -71.73 0.46 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.65 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . 0.483 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 49.86 19.06 0.4 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.904 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 179.14 27.8 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.177 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.472 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.3 t -137.4 -34.58 0.7 Allowed 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.916 0.388 . . . . 0.0 111.702 -179.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 1.5 p90 -53.18 -52.28 59.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.389 0.614 . . . . 0.0 111.369 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -51.61 -38.94 56.92 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.233 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.472 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 29.3 mt-30 -56.43 -28.27 58.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.264 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -77.14 -28.2 54.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.006 -179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB2' ' CB ' ' A' ' 65' ' ' PRO . . . -52.62 -24.51 8.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.542 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.77 -23.73 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.175 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -57.94 109.27 1.67 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.036 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -83.79 97.95 0.78 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.699 2.266 . . . . 0.0 112.361 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.96 -45.39 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.816 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 91.0 m-85 -90.1 -62.62 1.42 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.836 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.65 -58.29 3.8 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.777 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -69.57 -13.57 62.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.614 0.245 . . . . 0.0 111.233 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.529 ' CZ ' HD13 ' A' ' 14' ' ' ILE . 2.7 t80 -80.07 -55.65 4.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.824 0.345 . . . . 0.0 111.119 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 37.8 mm -66.76 -55.8 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.348 -179.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.64 30.55 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 111.676 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.472 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.71 160.53 66.58 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.701 179.41 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.408 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 11.1 Cg_endo -81.05 -44.2 0.1 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.466 2.111 . . . . 0.0 111.917 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.81 -24.53 38.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.705 -179.283 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.472 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -55.7 -50.21 70.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.204 0.526 . . . . 0.0 111.347 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.1 mtm180 -56.79 -32.49 65.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.219 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -68.02 -40.06 83.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.466 HG21 ' SG ' ' A' ' 24' ' ' CYS . 1.2 m -58.76 -50.92 72.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.876 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.54 HD23 ' O ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -56.47 -48.81 76.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.6 m -63.14 -41.05 99.23 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.442 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.2 t -52.93 -36.15 59.42 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.396 0.617 . . . . 0.0 109.918 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -32.18 37.69 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.104 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.66 53.48 31.23 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.846 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.803 ' CD2' HD11 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -112.25 -78.84 0.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.806 0.336 . . . . 0.0 110.786 179.239 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.763 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.65 -164.28 1.98 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.436 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.499 HG13 ' HD2' ' A' ' 65' ' ' PRO . 33.7 t -137.1 139.19 27.62 Favored Pre-proline 0 N--CA 1.452 -0.373 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.813 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.499 ' HD2' HG13 ' A' ' 64' ' ' VAL . 17.9 Cg_endo -56.69 -160.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.54 2.16 . . . . 0.0 112.305 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 15.8 m80 67.49 43.4 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 -179.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.012 -179.936 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.842 0.353 . . . . 0.0 110.868 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -88.2 11.83 15.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.751 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.7 m -109.78 -23.25 11.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.1 -11.18 60.63 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.228 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.861 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.2 mt -108.59 -17.92 13.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.455 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.38 -35.53 19.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.086 0.469 . . . . 0.0 111.236 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' VAL . . . . . 0.514 HG21 ' OE1' ' A' ' 23' ' ' GLU . 9.1 p -65.05 -24.42 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.281 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.08 -32.07 26.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.435 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.89 -30.08 0.64 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.389 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -53.13 -38.44 62.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.691 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.38 -40.01 21.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.19 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ILE . . . . . 0.672 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.4 mp -66.18 -58.69 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.878 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -53.68 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.463 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 t -70.69 -79.64 0.06 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.19 43.14 0.13 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.445 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.95 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 111.075 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 141.79 0.73 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.889 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PRO . . . . . 0.562 ' HB3' HG23 ' A' ' 56' ' ' THR . 54.4 Cg_exo -52.01 -179.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.459 2.106 . . . . 0.0 112.297 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.22 139.64 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.96 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.76 -25.22 55.52 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLU . . . . . 0.514 ' OE1' HG21 ' A' ' 9' ' ' VAL . 4.3 tm-20 -55.25 -48.52 73.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 120.938 0.399 . . . . 0.0 110.965 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.9 t -57.15 -35.97 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.068 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.551 ' HA ' HD21 ' A' ' 28' ' ' LEU . 69.7 m -65.11 -40.49 94.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.53 -42.52 98.88 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.748 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -65.09 -61.26 2.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.03 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 25' ' ' CYS . 4.6 pp -51.3 -25.8 6.42 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.45 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -56.16 25.46 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.305 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.55 -25.88 3.07 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.149 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . 0.861 ' OE1' HD21 ' A' ' 7' ' ' LEU . 1.4 mt-30 -81.75 -71.9 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.789 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.01 20.66 0.12 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.518 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.21 -81.02 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.9 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' CYS . . . . . 0.561 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.7 t -58.94 -37.92 77.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.189 0.519 . . . . 0.0 110.54 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' PHE . . . . . 0.565 ' HZ ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -50.08 -41.68 48.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.152 178.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.8 t -75.78 -33.01 60.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.605 178.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLN . . . . . 0.561 HE21 ' HA ' ' A' ' 34' ' ' CYS . 28.1 mt-30 -62.46 -32.64 73.54 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.905 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -59.18 -19.96 49.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.465 ' HB1' ' O ' ' A' ' 65' ' ' PRO . . . -51.32 -25.11 5.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.8 0.333 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.61 -22.33 12.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.829 ' OD1' HG23 ' A' ' 43' ' ' THR . 51.8 t0 -59.63 114.43 9.5 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.792 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.43 3.32 7.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.547 2.165 . . . . 0.0 113.071 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . 0.829 HG23 ' OD1' ' A' ' 41' ' ' ASP . 41.0 p -51.2 -41.13 60.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.819 0.342 . . . . 0.0 111.075 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' TYR . . . . . . . . . . . . . 56.7 m-85 -105.75 -62.2 1.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.762 179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.47 -59.45 4.38 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -70.54 -20.57 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.717 0.294 . . . . 0.0 111.138 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' TYR . . . . . 0.672 ' OH ' HD13 ' A' ' 14' ' ' ILE . 7.2 t80 -74.82 -49.91 19.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.937 0.399 . . . . 0.0 110.865 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 32.8 mm -68.25 -53.22 30.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.264 -179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.2 mtt180 -80.64 30.56 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 111.797 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . 0.594 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -80.72 147.59 63.14 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.757 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.3 -42.06 2.16 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.377 2.051 . . . . 0.0 112.281 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -80.15 -18.93 48.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.376 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.594 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -59.08 -55.72 31.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.218 0.533 . . . . 0.0 111.293 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -57.25 -33.9 68.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.124 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -66.7 -49.38 66.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.754 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' THR . . . . . 0.562 HG23 ' HB3' ' A' ' 20' ' ' PRO . 1.2 m -59.42 -48.23 82.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.515 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.565 HD21 ' HZ ' ' A' ' 35' ' ' PHE . 0.1 OUTLIER -62.94 -48.14 80.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.674 179.68 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.9 m -61.66 -42.77 99.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.543 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.7 t -51.35 -37.55 48.53 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.48 0.657 . . . . 0.0 109.694 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' CYS . . . . . 0.528 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.57 -39.22 28.04 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.192 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 59.5 49.97 72.82 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.482 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . 0.908 HD12 ' N ' ' A' ' 63' ' ' ALA . 1.7 pp -115.36 -40.88 3.35 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . 0.908 ' N ' HD12 ' A' ' 62' ' ' LEU . . . -150.78 175.01 12.39 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.02 0.438 . . . . 0.0 111.628 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.818 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.4 OUTLIER -146.44 148.14 33.2 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.755 179.917 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' PRO . . . . . 0.818 ' HD2' HG22 ' A' ' 64' ' ' VAL . 69.2 Cg_endo -75.9 33.05 0.39 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.196 2.598 . . . . 0.0 113.287 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.4 ' H ' HG13 ' A' ' 64' ' ' VAL . 87.0 m-70 -128.63 29.72 5.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.682 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.3 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.916 -179.904 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.857 0.36 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 3.5 m 59.94 93.88 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.145 -0.479 . . . . 0.0 110.77 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -79.82 -42.25 24.72 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.18 -0.464 . . . . 0.0 111.022 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.19 32.52 20.9 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.321 -0.4 . . . . 0.0 110.871 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 1.4 m -149.17 -36.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.31 -179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 32.5 mt-30 -66.26 -14.83 62.57 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 120.858 0.361 . . . . 0.0 111.166 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.805 HD21 ' OE1' ' A' ' 31' ' ' GLN . 0.5 OUTLIER -108.57 -20.23 13.17 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.128 -0.487 . . . . 0.0 111.257 -179.431 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.87 -43.78 28.75 Favored 'General case' 0 C--N 1.333 -0.118 0 CA-C-O 121.115 0.483 . . . . 0.0 111.486 -179.847 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.6 p -56.45 -25.23 20.31 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 CA-C-N 115.589 -0.732 . . . . 0.0 111.193 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -88.54 -30.78 19.06 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.872 -0.604 . . . . 0.0 110.61 -179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.2 -30.65 0.5 Allowed 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.37 -179.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 24.1 m -55.04 -35.38 64.41 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.783 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -84.41 -43.3 14.82 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 115.99 -0.55 . . . . 0.0 111.303 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.549 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.1 mp -60.9 -53.42 49.39 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.214 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.894 179.973 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 26.9 mt -73.7 -80.83 0.07 Allowed 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.134 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 15.3 t -60.22 -75.32 0.06 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.409 -0.36 . . . . 0.0 110.946 -179.773 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 121.5 37.34 0.69 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.71 -0.757 . . . . 0.0 112.591 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.22 -76.94 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.128 0.489 . . . . 0.0 111.11 179.947 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.99 138.01 3.15 Favored Pre-proline 0 C--N 1.321 -0.658 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.831 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.71 -171.99 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.447 2.098 . . . . 0.0 112.321 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.2 m -174.39 140.99 0.67 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.132 -0.485 . . . . 0.0 110.82 179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -65.43 -44.22 93.57 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.582 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -48.81 -36.31 16.46 Favored 'General case' 0 N--CA 1.451 -0.384 0 CA-C-O 120.905 0.383 . . . . 0.0 111.059 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 40.1 t -53.7 -63.29 1.2 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.978 -0.556 . . . . 0.0 111.291 -179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.425 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 12.2 p -53.48 -25.21 15.47 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.54 -0.754 . . . . 0.0 111.272 -179.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.47 -38.01 18.83 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.716 -0.754 . . . . 0.0 112.542 179.813 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.6 m120 -56.5 -50.32 72.15 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 121.13 0.49 . . . . 0.0 111.613 -179.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 1.028 HD11 HD13 ' A' ' 62' ' ' LEU . 3.9 pp -51.36 -37.86 50.22 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-N 115.637 -0.711 . . . . 0.0 111.337 -179.5 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.512 ' HD3' HD22 ' A' ' 62' ' ' LEU . 34.5 mmm-85 -54.24 -47.14 72.54 Favored 'General case' 0 CA--C 1.511 -0.522 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.395 -179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.46 -28.44 13.19 Favored 'General case' 0 C--N 1.318 -0.774 0 CA-C-O 121.304 0.573 . . . . 0.0 109.592 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.805 ' OE1' HD21 ' A' ' 7' ' ' LEU . 2.7 mt-30 -81.93 -74.17 0.35 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.454 178.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.429 HE21 ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 49.01 19.62 0.3 Allowed 'General case' 0 C--N 1.333 -0.146 0 CA-C-N 115.65 -0.704 . . . . 0.0 111.615 -179.872 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -130.08 -82.45 0.28 Allowed Glycine 0 N--CA 1.45 -0.37 0 N-CA-C 111.51 -0.636 . . . . 0.0 111.51 179.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.55 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.8 t -61.4 -34.62 75.67 Favored 'General case' 0 N--CA 1.451 -0.403 0 CA-C-O 121.417 0.627 . . . . 0.0 110.181 179.15 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.974 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -56.31 -37.16 69.54 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.035 -0.984 . . . . 0.0 110.464 179.472 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -72.22 -51.28 21.78 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.067 179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.55 HE21 ' HA ' ' A' ' 34' ' ' CYS . 5.1 pt20 -70.59 -23.07 62.51 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 116.313 -0.403 . . . . 0.0 111.219 -179.795 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -54.55 -22.49 13.3 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.742 179.618 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -55.86 -19.55 12.22 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.758 -179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -94.65 -23.17 17.72 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.923 0.392 . . . . 0.0 111.016 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 8.0 t0 -57.39 116.32 13.46 Favored Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 115.998 -0.546 . . . . 0.0 110.772 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -75.67 -44.23 0.3 Allowed 'Trans proline' 0 C--N 1.348 0.509 0 C-N-CA 122.523 2.149 . . . . 0.0 112.722 -179.625 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 21.4 p -51.2 -41.84 60.52 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.228 -179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.563 ' HD2' HCM1 ' A' ' 68' ' ' PGM . 42.9 m-85 -95.77 15.14 20.99 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.197 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.65 -27.91 62.01 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.73 -0.748 . . . . 0.0 112.575 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -71.6 -25.84 62.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.827 0.346 . . . . 0.0 110.776 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.793 ' CD2' HCM2 ' A' ' 68' ' ' PGM . 9.3 t80 -75.22 -51.76 12.56 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.0 -179.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.744 HG23 HCF2 ' A' ' 68' ' ' PGM . 29.5 mt -69.72 -42.68 80.31 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.545 -179.527 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 60.1 mtt180 -80.82 27.97 0.36 Allowed 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 112.157 0.428 . . . . 0.0 112.157 -179.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.499 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.83 164.56 50.39 Favored Pre-proline 0 C--N 1.323 -0.578 0 CA-C-N 116.283 -0.417 . . . . 0.0 110.447 179.153 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -81.01 -46.95 0.08 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.752 0 C-N-CA 122.443 2.095 . . . . 0.0 111.826 179.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.513 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.0 OUTLIER -80.89 -17.75 49.55 Favored 'General case' 0 C--N 1.325 -0.461 0 CA-C-N 115.217 -0.901 . . . . 0.0 111.701 -179.303 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.499 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -61.49 -58.96 6.08 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 121.178 0.513 . . . . 0.0 111.445 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.646 ' CG ' HCC2 ' A' ' 68' ' ' PGM . 6.2 mtt180 -57.96 -32.26 67.66 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.067 -179.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -66.27 -44.79 82.62 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 115.916 -0.584 . . . . 0.0 110.933 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -60.24 -51.57 68.97 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 115.714 -0.675 . . . . 0.0 110.847 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.472 HD21 ' CZ ' ' A' ' 35' ' ' PHE . 0.2 OUTLIER -63.8 -44.6 92.84 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.154 0.502 . . . . 0.0 110.787 179.879 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 96.3 m -63.58 -41.86 98.33 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.543 -0.753 . . . . 0.0 110.572 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.4 t -51.45 -38.62 54.63 Favored 'General case' 0 N--CA 1.45 -0.437 0 CA-C-O 121.534 0.683 . . . . 0.0 109.592 178.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.526 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.64 -40.63 25.25 Favored 'General case' 0 N--CA 1.445 -0.696 0 CA-C-N 114.769 -1.105 . . . . 0.0 110.362 178.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 62.19 54.91 31.07 Favored Glycine 0 N--CA 1.447 -0.573 0 C-N-CA 120.609 -0.805 . . . . 0.0 112.104 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 1.028 HD13 HD11 ' A' ' 28' ' ' LEU . 0.2 OUTLIER -109.78 -60.03 1.84 Allowed 'General case' 0 C--N 1.331 -0.237 0 C-N-CA 121.028 -0.269 . . . . 0.0 111.398 179.895 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.851 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.77 132.6 15.04 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-O 120.869 0.366 . . . . 0.0 111.602 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.431 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 9.9 p -109.91 137.73 20.55 Favored Pre-proline 0 N--CA 1.45 -0.461 0 CA-C-N 116.107 -0.497 . . . . 0.0 110.572 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.535 ' HG2' HCB1 ' A' ' 68' ' ' PGM . 19.4 Cg_endo -57.19 -160.42 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.346 0 C-N-CA 122.485 2.123 . . . . 0.0 112.246 -179.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 60.0 m80 61.97 31.91 17.93 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 0.0 110.764 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.05 0 CA-C-O 118.218 -0.896 . . . . 0.0 110.873 179.979 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' PGM . . . . . 0.793 HCM2 ' CD2' ' A' ' 47' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.772 0.32 . . . . 0.0 111.02 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.8 t -148.49 72.53 1.2 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.232 -0.44 . . . . 0.0 110.919 179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -68.41 -34.25 75.68 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.845 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 60.55 19.19 9.04 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.138 -0.483 . . . . 0.0 111.347 -179.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -128.21 -24.93 3.05 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.397 -0.365 . . . . 0.0 111.359 -179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -69.86 -16.59 63.28 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 120.827 0.346 . . . . 0.0 111.182 -179.801 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.74 HD11 ' OE1' ' A' ' 31' ' ' GLN . 1.1 mt -99.99 -24.88 14.5 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.234 -0.439 . . . . 0.0 111.218 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.07 -38.09 23.25 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.092 0.473 . . . . 0.0 111.329 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.536 HG11 ' OE1' ' A' ' 23' ' ' GLU . 11.1 p -60.86 -25.93 37.08 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.557 0 CA-C-N 115.707 -0.679 . . . . 0.0 111.165 179.854 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.65 -32.69 25.52 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.36 179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.453 ' HA ' HD13 ' A' ' 14' ' ' ILE . . . -43.97 -29.24 0.55 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.447 -0.797 . . . . 0.0 111.458 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 71.2 m -53.07 -43.38 66.68 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 115.744 -0.662 . . . . 0.0 110.847 179.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -81.83 -25.78 34.87 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.0 -0.546 . . . . 0.0 111.311 179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 53' ' ' ALA . 2.4 mp -68.7 -62.01 1.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.771 179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 14.6 mt -74.06 -79.5 0.08 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.208 -179.583 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -55.97 -62.62 1.58 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.306 -0.406 . . . . 0.0 111.062 -179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 99.5 36.45 4.33 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.709 -0.757 . . . . 0.0 112.432 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.574 ' O ' ' HG3' ' A' ' 19' ' ' LYS . . . -57.63 -79.1 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.899 0.38 . . . . 0.0 111.13 179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.574 ' HG3' ' O ' ' A' ' 18' ' ' ALA . 0.7 OUTLIER -158.95 145.9 12.91 Favored Pre-proline 0 C--N 1.323 -0.555 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.558 179.884 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.5 Cg_endo -69.08 -174.69 0.81 Allowed 'Trans proline' 0 C--N 1.344 0.304 0 C-N-CA 122.457 2.105 . . . . 0.0 112.201 179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.7 p -173.41 138.57 0.71 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.258 -0.428 . . . . 0.0 110.893 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.03 -27.67 60.06 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.725 -0.75 . . . . 0.0 112.506 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.536 ' OE1' HG11 ' A' ' 9' ' ' VAL . 2.6 tt0 -53.15 -43.09 66.75 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-O 120.895 0.378 . . . . 0.0 111.081 -179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.628 ' O ' HD23 ' A' ' 28' ' ' LEU . 47.7 t -55.67 -23.51 28.81 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.066 -0.515 . . . . 0.0 111.393 -179.765 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.41 ' HA ' HD21 ' A' ' 62' ' ' LEU . 87.6 m -78.02 -45.58 23.29 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.291 -0.413 . . . . 0.0 110.846 179.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.95 -35.28 58.14 Favored Glycine 0 N--CA 1.451 -0.365 0 C-N-CA 120.771 -0.728 . . . . 0.0 112.588 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 33.6 m120 -62.67 -60.22 3.81 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-O 121.185 0.517 . . . . 0.0 110.915 -179.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.844 HD13 ' CE2' ' A' ' 35' ' ' PHE . 1.2 pp -54.47 -31.35 55.53 Favored 'General case' 0 C--N 1.319 -0.727 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.675 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.612 ' HD3' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -59.69 -47.47 85.51 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.216 179.979 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.16 -25.82 3.95 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 115.791 -0.64 . . . . 0.0 110.564 179.486 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.74 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -81.36 -72.66 0.42 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.857 179.488 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.3 20.68 0.16 Allowed 'General case' 0 C--N 1.333 -0.137 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.588 -179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -144.97 -80.49 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.402 0 C-N-CA 120.919 -0.657 . . . . 0.0 112.195 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.545 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.6 t -59.52 -36.22 75.69 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.408 0.623 . . . . 0.0 110.416 179.767 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.844 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -57.18 -43.96 83.14 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.042 -0.981 . . . . 0.0 110.441 179.766 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 40.0 t -64.93 -33.94 77.22 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.552 -0.749 . . . . 0.0 110.504 179.432 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.545 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 28.3 mt-30 -59.03 -35.01 72.57 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.383 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -62.85 -15.4 54.33 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.334 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.551 ' HB1' ' HB2' ' A' ' 65' ' ' PRO . . . -47.99 -28.93 3.03 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 120.938 0.399 . . . . 0.0 111.519 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.2 mtmt -118.79 -27.99 5.7 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.233 -179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.838 ' OD1' HG23 ' A' ' 43' ' ' THR . 19.0 t0 -60.15 107.51 1.06 Allowed Pre-proline 0 C--N 1.326 -0.442 0 CA-C-N 116.123 -0.489 . . . . 0.0 110.853 179.924 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -82.09 38.16 0.73 Allowed 'Trans proline' 0 C--N 1.347 0.497 0 C-N-CA 122.917 2.411 . . . . 0.0 112.744 -179.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.838 HG23 ' OD1' ' A' ' 41' ' ' ASP . 16.4 p -67.58 -38.13 83.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.902 0.382 . . . . 0.0 110.736 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.649 ' CZ ' HCM1 ' A' ' 68' ' ' PGM . 17.1 m-85 -98.31 -55.09 2.86 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.114 -0.493 . . . . 0.0 110.763 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 83.38 -56.63 5.06 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.78 -0.724 . . . . 0.0 112.622 179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -75.7 -21.14 57.86 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.704 0.288 . . . . 0.0 111.196 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.678 ' CE1' HCJ1 ' A' ' 68' ' ' PGM . 3.4 t80 -80.02 -51.72 8.7 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.351 -0.386 . . . . 0.0 111.256 -179.832 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.786 HG23 HCD2 ' A' ' 68' ' ' PGM . 38.9 mm -65.15 -59.24 4.42 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.299 -0.41 . . . . 0.0 111.185 -179.742 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 27.3 mtt-85 -80.45 31.06 0.28 Allowed 'General case' 0 C--N 1.327 -0.372 0 CA-C-O 120.867 0.365 . . . . 0.0 111.541 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.547 ' HB3' ' HB3' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -80.77 147.51 62.72 Favored Pre-proline 0 C--N 1.326 -0.441 0 CA-C-N 116.164 -0.471 . . . . 0.0 110.894 179.548 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 93.6 Cg_endo -80.12 -42.01 0.16 Allowed 'Trans proline' 0 N--CA 1.463 -0.272 0 C-N-CA 122.563 2.176 . . . . 0.0 112.692 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 22.3 m-70 -80.25 -30.23 38.45 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.834 -179.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.547 ' HB3' ' HB3' ' A' ' 50' ' ' SER . . . -59.25 -54.92 41.32 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.262 0.553 . . . . 0.0 111.466 -179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 8.2 mtp180 -54.73 -35.78 64.07 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.09 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.7 t70 -68.79 -42.0 77.96 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.545 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -61.0 -50.85 71.69 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.804 179.656 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.498 HD23 ' O ' ' A' ' 63' ' ' ALA . 0.1 OUTLIER -62.95 -46.56 87.16 Favored 'General case' 0 N--CA 1.45 -0.431 0 CA-C-O 121.195 0.521 . . . . 0.0 110.631 179.794 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 80.5 m -62.14 -42.49 99.31 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.719 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 3.5 t -51.74 -39.52 58.61 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 121.434 0.635 . . . . 0.0 109.762 179.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.784 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.67 -34.87 34.44 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.924 -1.035 . . . . 0.0 110.565 179.14 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 56.06 46.59 84.49 Favored Glycine 0 C--N 1.334 0.437 0 C-N-CA 120.478 -0.868 . . . . 0.0 111.888 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.968 HD12 ' N ' ' A' ' 63' ' ' ALA . 3.5 pp -109.9 -40.88 4.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.592 0.234 . . . . 0.0 111.502 -179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.968 ' N ' HD12 ' A' ' 62' ' ' LEU . . . -150.43 159.08 44.73 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-O 121.016 0.436 . . . . 0.0 111.643 -179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.786 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.5 OUTLIER -150.16 161.69 30.13 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.396 179.808 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.786 ' HD2' HG22 ' A' ' 64' ' ' VAL . 65.7 Cg_endo -77.74 31.71 0.44 Allowed 'Trans proline' 0 C--N 1.346 0.415 0 C-N-CA 123.012 2.475 . . . . 0.0 113.343 -179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -132.79 43.17 3.0 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.725 179.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 23.1 m . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.285 -0.864 . . . . 0.0 110.977 -179.913 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' PGM . . . . . 0.786 HCD2 HG23 ' A' ' 48' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.325 0 CA-C-O 120.822 0.344 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 1.1 m -110.78 -57.02 2.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.9 -179.954 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -156.64 -56.45 0.09 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.952 -179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 61.94 31.98 17.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.061 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.5 m -122.2 -39.78 2.55 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.223 -0.444 . . . . 0.0 111.041 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -76.55 -5.07 46.06 Favored 'General case' 0 N--CA 1.45 -0.453 0 CA-C-N 116.258 -0.428 . . . . 0.0 111.477 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.039 HD13 HCK2 ' A' ' 68' ' ' PGM . 2.8 mt -114.37 -19.36 11.26 Favored 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.614 -0.266 . . . . 0.0 111.46 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.41 -52.81 15.72 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-O 121.175 0.512 . . . . 0.0 111.424 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.553 HG21 ' OE1' ' A' ' 23' ' ' GLU . 10.3 p -57.35 -22.49 17.34 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 CA-C-N 115.42 -0.809 . . . . 0.0 111.369 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -88.56 -32.49 18.12 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.477 . . . . 0.0 110.495 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -44.03 -30.02 0.68 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.455 -0.793 . . . . 0.0 111.39 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 5.5 t -53.37 -43.64 67.97 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.789 179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -78.5 -32.96 48.42 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 115.962 -0.563 . . . . 0.0 111.073 179.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.791 HD13 ' OH ' ' A' ' 47' ' ' TYR . 3.6 mp -70.66 -62.48 1.27 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.466 . . . . 0.0 110.889 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 47.3 mt -68.11 -77.85 0.07 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.228 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -54.01 -70.2 0.1 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.221 -0.445 . . . . 0.0 111.172 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 111.25 27.22 4.29 Favored Glycine 0 N--CA 1.451 -0.339 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.477 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -58.6 -77.83 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 121.142 0.496 . . . . 0.0 111.103 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -171.29 143.52 1.56 Allowed Pre-proline 0 C--N 1.321 -0.663 0 CA-C-N 115.591 -0.731 . . . . 0.0 110.858 179.887 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 58.9 Cg_endo -71.64 -170.8 0.56 Allowed 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 122.522 2.148 . . . . 0.0 112.37 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -166.32 -162.61 0.54 Allowed 'General case' 0 N--CA 1.451 -0.409 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.423 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -102.5 -27.48 6.78 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.825 -0.702 . . . . 0.0 112.467 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.553 ' OE1' HG21 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -56.85 -50.01 73.73 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-O 120.843 0.354 . . . . 0.0 110.966 -179.793 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.539 ' SG ' HD23 ' A' ' 28' ' ' LEU . 43.3 t -52.36 -27.87 17.23 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.129 -0.487 . . . . 0.0 111.163 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.423 ' O ' ' HB2' ' A' ' 29' ' ' ARG . 60.9 m -67.92 -61.0 2.08 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.768 179.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.1 -29.7 56.32 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.84 -0.695 . . . . 0.0 112.8 -179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 35.1 m120 -70.6 -67.67 0.48 Allowed 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 121.073 0.463 . . . . 0.0 110.918 -179.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.721 HD11 HD13 ' A' ' 62' ' ' LEU . 3.9 pp -56.26 -28.1 57.44 Favored 'General case' 0 C--N 1.319 -0.752 0 CA-C-N 115.6 -0.727 . . . . 0.0 110.587 179.953 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.761 ' HD3' HD22 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -61.75 -47.26 86.0 Favored 'General case' 0 CA--C 1.513 -0.448 0 CA-C-O 121.166 0.507 . . . . 0.0 110.41 179.396 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -53.25 -24.23 10.82 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.521 -0.763 . . . . 0.0 110.265 179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.918 ' OE1' HD21 ' A' ' 7' ' ' LEU . 12.3 mt-30 -81.07 -71.86 0.45 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.639 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.446 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 48.28 20.03 0.25 Allowed 'General case' 0 CA--C 1.529 0.157 0 CA-C-N 116.046 -0.524 . . . . 0.0 111.602 -179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -137.7 -81.73 0.1 OUTLIER Glycine 0 N--CA 1.45 -0.373 0 N-CA-C 111.542 -0.623 . . . . 0.0 111.542 179.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . . . . . . . . . 3.7 t -59.14 -36.01 74.48 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-O 121.391 0.615 . . . . 0.0 110.112 179.113 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.652 ' CE2' HD13 ' A' ' 28' ' ' LEU . 0.1 OUTLIER -63.71 -40.15 96.07 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.032 -0.985 . . . . 0.0 110.171 179.52 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -66.88 -55.7 13.57 Favored 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.45 -0.795 . . . . 0.0 110.546 179.587 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 5.5 pp0? -62.81 -24.87 67.97 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 116.084 -0.507 . . . . 0.0 110.707 179.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -23.17 14.15 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.586 179.428 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.575 ' HB2' ' HB2' ' A' ' 65' ' ' PRO . . . -55.49 -21.69 17.64 Favored 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 116.136 -0.484 . . . . 0.0 111.687 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.55 15.75 18.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.333 -0.394 . . . . 0.0 111.086 179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -80.02 114.04 43.29 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-N 116.257 -0.429 . . . . 0.0 110.801 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -76.29 -21.25 13.69 Favored 'Trans proline' 0 C--N 1.346 0.444 0 C-N-CA 122.529 2.153 . . . . 0.0 112.749 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -53.19 -47.78 68.58 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.722 0.296 . . . . 0.0 111.101 -179.913 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.743 ' CZ ' HCM2 ' A' ' 68' ' ' PGM . 77.6 m-85 -89.71 -75.93 0.43 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.296 -0.411 . . . . 0.0 110.488 179.698 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 76.02 -55.02 3.09 Favored Glycine 0 N--CA 1.452 -0.235 0 C-N-CA 120.818 -0.706 . . . . 0.0 113.189 179.472 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 8.5 pt20 -67.34 -24.22 65.7 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.844 0.354 . . . . 0.0 111.005 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.815 ' CE2' HCK1 ' A' ' 68' ' ' PGM . 8.1 t80 -76.44 -53.49 8.06 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.788 -179.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.643 ' CD1' HCG2 ' A' ' 68' ' ' PGM . 36.6 mm -69.56 -51.29 43.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.209 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 56.2 mtm180 -80.67 31.0 0.3 Allowed 'General case' 0 C--N 1.331 -0.23 0 CA-C-N 116.427 -0.351 . . . . 0.0 111.842 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.671 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.74 148.41 65.22 Favored Pre-proline 0 C--N 1.324 -0.511 0 CA-C-N 116.253 -0.43 . . . . 0.0 110.638 179.352 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_endo -67.32 -44.35 4.91 Favored 'Trans proline' 0 C--N 1.342 0.235 0 C-N-CA 122.251 1.968 . . . . 0.0 112.01 179.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 9.3 m-70 -80.22 -17.82 51.24 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.382 -179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.671 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -55.37 -50.89 68.52 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.219 0.533 . . . . 0.0 111.273 -179.667 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.607 ' NH2' HG23 ' A' ' 64' ' ' VAL . 0.1 OUTLIER -54.86 -47.49 74.14 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.397 -0.82 . . . . 0.0 111.1 -179.833 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -66.11 -41.57 90.38 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.614 -0.721 . . . . 0.0 110.598 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 85.5 m -57.51 -37.26 72.69 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 115.505 -0.77 . . . . 0.0 110.641 179.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.695 HD21 ' HD3' ' A' ' 65' ' ' PRO . 0.1 OUTLIER -61.0 -59.39 5.45 Favored 'General case' 0 N--CA 1.45 -0.432 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.603 179.774 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 3.1 m -59.46 -44.03 93.08 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.03 179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.0 t -52.4 -29.83 26.18 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 121.625 0.726 . . . . 0.0 109.363 178.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.857 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.1 OUTLIER -74.3 -39.1 63.13 Favored 'General case' 0 N--CA 1.442 -0.838 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.901 179.203 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 72.92 55.66 6.29 Favored Glycine 0 C--N 1.333 0.415 0 C-N-CA 120.843 -0.694 . . . . 0.0 113.387 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.857 HD21 ' SG ' ' A' ' 60' ' ' CYS . 0.0 OUTLIER -134.13 -92.32 0.33 Allowed 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.789 0.295 . . . . 0.0 111.019 179.109 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.619 ' O ' HD23 ' A' ' 57' ' ' LEU . . . -150.32 178.8 8.67 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-O 120.868 0.366 . . . . 0.0 111.388 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.881 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.3 OUTLIER -109.9 147.45 36.22 Favored Pre-proline 0 N--CA 1.451 -0.392 0 CA-C-N 116.0 -0.545 . . . . 0.0 110.587 179.95 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.881 ' HD2' HG22 ' A' ' 64' ' ' VAL . 43.1 Cg_endo -81.83 32.28 0.52 Allowed 'Trans proline' 0 C--N 1.347 0.476 0 C-N-CA 122.966 2.444 . . . . 0.0 113.8 -178.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.606 ' H ' HG13 ' A' ' 64' ' ' VAL . 45.7 m80 -103.13 32.28 3.83 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.891 -0.595 . . . . 0.0 110.713 179.385 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.5 p . . . . . 0 C--O 1.248 1.02 0 CA-C-O 118.233 -0.889 . . . . 0.0 110.951 -179.946 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' PGM . . . . . 1.039 HCK2 HD13 ' A' ' 7' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.353 0 CA-C-O 120.791 0.329 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 10.3 m 59.99 99.35 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.877 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.66 -36.31 83.4 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.921 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . 58.16 23.11 9.83 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.282 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 83.3 p -123.61 -34.68 3.02 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.321 -0.4 . . . . 0.0 111.105 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.624 ' O ' HD23 ' A' ' 7' ' ' LEU . 3.1 mm-40 -86.86 48.45 1.65 Allowed 'General case' 0 N--CA 1.449 -0.489 0 CA-C-N 116.349 -0.387 . . . . 0.0 111.223 -179.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.663 HD11 ' OE1' ' A' ' 31' ' ' GLN . 49.3 mt -151.99 -39.94 0.11 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.396 -0.365 . . . . 0.0 111.341 -179.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -45.97 -44.31 14.81 Favored 'General case' 0 C--N 1.333 -0.14 0 CA-C-O 121.089 0.471 . . . . 0.0 111.667 -179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.754 HG21 ' OE1' ' A' ' 23' ' ' GLU . 11.5 p -55.62 -24.65 16.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.712 -0.676 . . . . 0.0 111.226 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.4 t -81.38 -30.31 33.73 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.912 -0.585 . . . . 0.0 110.41 179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -43.18 -30.48 0.48 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.364 -0.834 . . . . 0.0 111.351 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 4.7 m -51.47 -34.79 37.1 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.628 -0.714 . . . . 0.0 110.726 179.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -89.33 -31.71 17.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-N 116.023 -0.535 . . . . 0.0 111.123 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.612 HG21 ' CG ' ' A' ' 47' ' ' TYR . 4.0 mp -74.26 -65.85 0.64 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 90.2 mt -65.16 -74.38 0.11 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.121 -0.491 . . . . 0.0 111.219 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.31 -69.76 0.12 Allowed 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.138 -179.834 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 110.71 25.55 5.13 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.673 -0.775 . . . . 0.0 112.56 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.75 -77.06 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.177 0.513 . . . . 0.0 111.033 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -172.6 157.59 3.62 Favored Pre-proline 0 C--N 1.321 -0.632 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.828 179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.471 ' HB3' HG23 ' A' ' 56' ' ' THR . 29.9 Cg_endo -63.5 -167.03 0.07 OUTLIER 'Trans proline' 0 C--N 1.344 0.306 0 C-N-CA 122.571 2.181 . . . . 0.0 112.202 -179.996 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.71 144.63 0.84 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.174 -0.466 . . . . 0.0 110.824 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -59.54 -26.74 62.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.691 -0.766 . . . . 0.0 112.585 179.978 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.754 ' OE1' HG21 ' A' ' 9' ' ' VAL . 0.5 OUTLIER -59.94 -56.29 23.5 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-O 120.93 0.395 . . . . 0.0 110.817 -179.846 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 54.1 t -55.39 -26.05 39.11 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.942 -0.572 . . . . 0.0 111.168 -179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.53 -48.49 72.32 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.855 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -78.99 -25.08 60.53 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.767 -0.73 . . . . 0.0 112.725 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 30.5 m120 -64.77 -62.74 1.39 Allowed 'General case' 0 CA--C 1.515 -0.374 0 CA-C-O 121.129 0.49 . . . . 0.0 110.972 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.581 HD12 ' HD2' ' A' ' 29' ' ' ARG . 2.8 pp -54.76 -24.87 24.47 Favored 'General case' 0 C--N 1.32 -0.683 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.588 179.819 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.96 ' NE ' HD13 ' A' ' 62' ' ' LEU . 0.0 OUTLIER -64.34 -52.44 58.38 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.19 179.871 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.75 -25.39 2.96 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.477 179.485 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.663 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.1 OUTLIER -81.41 -71.6 0.47 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.914 179.416 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.442 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 48.76 19.25 0.24 Allowed 'General case' 0 C--O 1.232 0.133 0 CA-C-N 116.066 -0.516 . . . . 0.0 111.694 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -139.0 -81.87 0.08 OUTLIER Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 121.129 -0.558 . . . . 0.0 111.72 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.599 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.7 t -60.7 -33.78 73.37 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.43 0.633 . . . . 0.0 110.253 179.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.441 ' CD1' ' N ' ' A' ' 36' ' ' CYS . 0.0 OUTLIER -55.54 -45.75 77.19 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.033 -0.985 . . . . 0.0 110.671 179.611 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.441 ' N ' ' CD1' ' A' ' 35' ' ' PHE . 4.7 t -64.43 -56.3 15.17 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.284 -0.871 . . . . 0.0 110.937 179.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.599 HE21 ' HA ' ' A' ' 34' ' ' CYS . 15.3 pt20 -66.05 -23.15 66.48 Favored 'General case' 0 N--CA 1.454 -0.268 0 CA-C-N 116.255 -0.43 . . . . 0.0 111.28 -179.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -58.61 -18.53 31.01 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.175 -0.466 . . . . 0.0 110.876 179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HB2' ' HB2' ' A' ' 65' ' ' PRO . . . -51.51 -22.95 3.52 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 116.284 -0.416 . . . . 0.0 112.031 -179.723 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 1.7 tppt? -97.53 -24.26 15.65 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.506 -0.316 . . . . 0.0 111.499 -179.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.46 ' CG ' ' HG1' ' A' ' 43' ' ' THR . 10.4 t70 -57.44 109.1 1.51 Allowed Pre-proline 0 C--N 1.327 -0.387 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.057 -179.836 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 79.4 Cg_endo -88.62 -10.07 4.59 Favored 'Trans proline' 0 N--CA 1.46 -0.468 0 C-N-CA 122.822 2.348 . . . . 0.0 112.829 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.46 ' HG1' ' CG ' ' A' ' 41' ' ' ASP . 0.0 OUTLIER -51.7 -27.77 12.77 Favored 'General case' 0 C--N 1.332 -0.159 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.697 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.72 ' CZ ' HCM2 ' A' ' 68' ' ' PGM . 24.2 m-85 -67.3 -58.92 3.92 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.442 -0.344 . . . . 0.0 110.897 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 118.27 80.83 0.74 Allowed Glycine 0 N--CA 1.452 -0.283 0 C-N-CA 120.723 -0.751 . . . . 0.0 112.68 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 58.08 22.46 9.01 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.15 0.5 . . . . 0.0 110.865 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.721 ' CE2' HCN2 ' A' ' 68' ' ' PGM . 8.4 t80 -65.74 -54.66 24.24 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.94 -179.532 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.723 HD13 HCG1 ' A' ' 68' ' ' PGM . 20.8 mm -71.08 -37.27 66.52 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 115.836 -0.62 . . . . 0.0 111.576 -179.506 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 2.7 mtt180 -80.81 25.08 0.46 Allowed 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 112.072 0.397 . . . . 0.0 112.072 -179.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.48 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.03 155.79 72.42 Favored Pre-proline 0 C--N 1.321 -0.669 0 CA-C-N 116.176 -0.465 . . . . 0.0 110.66 179.209 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.432 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 13.1 Cg_endo -81.01 -40.55 0.17 Allowed 'Trans proline' 0 N--CA 1.454 -0.813 0 C-N-CA 122.365 2.043 . . . . 0.0 111.968 179.144 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.489 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.69 -30.83 36.37 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.593 -179.31 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.484 ' HB1' HCE2 ' A' ' 68' ' ' PGM . . . -53.6 -42.02 67.25 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.586 -179.491 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 2.3 ttp180 -65.88 -30.39 70.99 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.698 -0.683 . . . . 0.0 110.785 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.9 t70 -70.31 -40.1 74.42 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.958 -0.564 . . . . 0.0 110.707 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.471 HG23 ' HB3' ' A' ' 20' ' ' PRO . 1.3 m -58.06 -49.04 78.27 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.918 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.622 HD13 HCD2 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -59.14 -50.79 72.72 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.067 0.461 . . . . 0.0 110.886 179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.7 m -60.8 -44.55 96.72 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-N 115.707 -0.679 . . . . 0.0 110.336 179.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -50.67 -31.28 15.85 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.55 0.69 . . . . 0.0 109.705 178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.934 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -76.25 -38.99 55.54 Favored 'General case' 0 N--CA 1.446 -0.65 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.226 179.315 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 74.61 54.62 5.9 Favored Glycine 0 C--N 1.333 0.398 0 C-N-CA 120.688 -0.768 . . . . 0.0 113.113 179.513 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.96 HD13 ' NE ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER -123.48 -81.0 0.63 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-O 120.798 0.332 . . . . 0.0 110.662 179.469 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.414 ' O ' HD23 ' A' ' 57' ' ' LEU . . . -150.63 168.45 24.28 Favored 'General case' 0 N--CA 1.452 -0.351 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.503 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.416 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.8 p -109.93 137.94 20.61 Favored Pre-proline 0 N--CA 1.448 -0.526 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.804 179.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.559 ' HB2' ' HB2' ' A' ' 39' ' ' ALA . 18.7 Cg_endo -57.73 -160.57 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.402 0 C-N-CA 122.34 2.026 . . . . 0.0 112.095 179.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 69.3 m80 61.55 31.24 18.9 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.271 -0.422 . . . . 0.0 110.704 -179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 18.1 p . . . . . 0 C--O 1.249 1.026 0 CA-C-O 118.212 -0.899 . . . . 0.0 110.91 179.996 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' PGM . . . . . 0.723 HCG1 HD13 ' A' ' 48' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.342 0 CA-C-O 120.811 0.339 . . . . 0.0 111.07 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 13.4 p -85.12 62.53 7.56 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.204 -0.453 . . . . 0.0 110.868 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -64.62 153.2 40.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.059 -0.519 . . . . 0.0 110.959 179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -65.36 -27.33 68.5 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.303 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -54.72 -27.91 44.21 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.107 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -70.38 -12.82 61.84 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 116.225 -0.443 . . . . 0.0 111.17 -179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.479 HD13 HCJ2 ' A' ' 68' ' ' PGM . 0.9 OUTLIER -109.58 -19.09 13.34 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.315 -0.402 . . . . 0.0 111.245 -179.561 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -47.0 -60.98 2.09 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-O 121.175 0.512 . . . . 0.0 111.501 -179.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.827 HG11 ' OE2' ' A' ' 23' ' ' GLU . 8.5 p -51.53 -26.32 6.12 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.672 0 CA-C-N 115.442 -0.799 . . . . 0.0 111.322 179.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -72.09 -31.81 66.42 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.87 -0.604 . . . . 0.0 110.533 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.598 ' HB1' HD12 ' A' ' 15' ' ' LEU . . . -44.61 -28.78 0.64 Allowed 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.443 -0.799 . . . . 0.0 111.516 -179.742 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -49.12 -32.03 9.19 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 115.813 -0.631 . . . . 0.0 110.997 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -96.04 -34.52 11.72 Favored 'General case' 0 N--CA 1.452 -0.353 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.313 -179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.884 HD13 ' OH ' ' A' ' 47' ' ' TYR . 5.2 mp -74.74 -59.11 3.61 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.067 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.598 HD12 ' HB1' ' A' ' 11' ' ' ALA . 93.2 mt -74.61 -74.31 0.2 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.237 -0.438 . . . . 0.0 111.211 -179.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -50.9 -54.79 21.06 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.246 -0.434 . . . . 0.0 111.315 -179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.4 ' HA2' ' CD2' ' A' ' 52' ' ' HIS . . . 94.06 22.2 25.88 Favored Glycine 0 N--CA 1.45 -0.368 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.526 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -67.89 -77.62 0.07 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 121.143 0.497 . . . . 0.0 111.115 -179.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -167.99 163.95 8.82 Favored Pre-proline 0 C--N 1.321 -0.654 0 CA-C-N 115.617 -0.719 . . . . 0.0 110.841 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -55.44 -164.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.345 0.349 0 C-N-CA 122.648 2.232 . . . . 0.0 112.42 -179.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -172.41 136.92 0.82 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.163 -0.472 . . . . 0.0 110.921 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -61.13 -35.18 90.42 Favored Glycine 0 N--CA 1.451 -0.366 0 C-N-CA 120.707 -0.759 . . . . 0.0 112.538 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.827 ' OE2' HG11 ' A' ' 9' ' ' VAL . 0.4 OUTLIER -56.78 -50.55 71.98 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-O 120.883 0.373 . . . . 0.0 110.939 -179.818 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 45.7 t -56.95 -26.59 59.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.01 -0.541 . . . . 0.0 111.126 -179.932 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -68.9 -51.81 36.08 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 116.115 -0.493 . . . . 0.0 110.711 -179.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -59.87 -39.51 95.57 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.706 -0.759 . . . . 0.0 112.473 179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 31.2 m-20 -59.16 -56.76 18.01 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.288 0.566 . . . . 0.0 110.91 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.56 HD21 ' CG ' ' A' ' 35' ' ' PHE . 0.4 OUTLIER -48.66 -30.87 5.95 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.327 -0.851 . . . . 0.0 111.386 -179.975 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . 0.509 ' HA ' ' NE2' ' A' ' 32' ' ' GLN . 0.0 OUTLIER -66.31 -53.78 32.47 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-N 116.061 -0.518 . . . . 0.0 111.494 -179.554 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.93 -25.15 2.99 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.975 -0.557 . . . . 0.0 110.061 178.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.455 HE22 HD21 ' A' ' 7' ' ' LEU . 1.9 mt-30 -81.09 -71.6 0.46 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 115.432 -0.803 . . . . 0.0 110.54 179.151 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.509 ' NE2' ' HA ' ' A' ' 29' ' ' ARG . 0.0 OUTLIER 46.39 21.72 0.13 Allowed 'General case' 0 N--CA 1.452 -0.366 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.754 -179.863 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 175.52 28.73 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 115.826 -0.625 . . . . 0.0 112.5 179.642 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.536 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.3 t -135.1 -37.08 0.8 Allowed 'General case' 0 N--CA 1.446 -0.64 0 CA-C-O 120.998 0.427 . . . . 0.0 111.7 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.56 ' CG ' HD21 ' A' ' 28' ' ' LEU . 17.0 p90 -57.57 -58.29 8.97 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.403 0.621 . . . . 0.0 111.15 -179.406 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 31.3 t -48.12 -33.65 8.59 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.965 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.536 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 29.5 mt-30 -54.54 -34.18 61.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 121.053 0.454 . . . . 0.0 111.127 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.404 ' CB ' HD11 ' A' ' 48' ' ' ILE . 83.2 m-85 -66.19 -21.17 66.31 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.796 -0.638 . . . . 0.0 110.968 179.931 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.417 ' HA ' ' CD1' ' A' ' 48' ' ' ILE . . . -56.23 -21.7 25.03 Favored 'General case' 0 C--N 1.331 -0.225 0 CA-C-N 116.332 -0.395 . . . . 0.0 111.728 -179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -102.2 -21.07 14.45 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.23 -179.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -70.83 127.21 92.02 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-N 116.254 -0.43 . . . . 0.0 110.802 -179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -76.47 -42.62 0.34 Allowed 'Trans proline' 0 C--N 1.347 0.462 0 C-N-CA 122.48 2.12 . . . . 0.0 112.525 -179.86 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -57.24 -40.11 76.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.251 -0.432 . . . . 0.0 110.964 -179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.67 ' CD1' HCM2 ' A' ' 68' ' ' PGM . 45.8 m-85 -95.18 15.65 18.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.239 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -70.57 -25.08 76.27 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.779 -0.724 . . . . 0.0 112.642 -179.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 60.9 mt-30 -71.36 -27.76 63.58 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.913 0.387 . . . . 0.0 110.752 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.884 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.2 t80 -73.38 -46.11 50.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.018 -0.537 . . . . 0.0 110.99 -179.943 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 1.054 HG23 HCE2 ' A' ' 68' ' ' PGM . 26.9 mt -71.37 -30.46 39.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.004 -0.543 . . . . 0.0 111.651 -179.548 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 3.8 mmm-85 -80.73 22.88 0.56 Allowed 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.714 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -81.15 149.93 67.15 Favored Pre-proline 0 C--N 1.321 -0.659 0 CA-C-N 116.001 -0.545 . . . . 0.0 110.611 179.103 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -73.55 -44.62 0.49 Allowed 'Trans proline' 0 C--N 1.343 0.271 0 C-N-CA 122.322 2.015 . . . . 0.0 112.193 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.4 ' CD2' ' HA2' ' A' ' 17' ' ' GLY . 13.0 m-70 -80.36 -16.77 53.76 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.052 -0.522 . . . . 0.0 111.621 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.714 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -54.47 -48.89 71.25 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-O 121.204 0.526 . . . . 0.0 111.449 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.686 ' CG ' HCB2 ' A' ' 68' ' ' PGM . 43.6 mtm180 -58.6 -38.39 77.86 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.422 -0.808 . . . . 0.0 111.281 -179.654 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 11.4 t0 -67.07 -42.21 85.08 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 115.815 -0.629 . . . . 0.0 110.791 -179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.02 -47.47 85.09 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-N 115.567 -0.742 . . . . 0.0 110.969 179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.561 HD11 HCF2 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -61.28 -49.85 75.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-N 116.08 -0.509 . . . . 0.0 110.978 179.966 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 1.5 m -62.02 -42.71 99.46 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.587 -0.733 . . . . 0.0 110.524 179.781 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -52.4 -33.98 46.11 Favored 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.487 0.661 . . . . 0.0 109.952 179.034 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.17 -33.46 38.32 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 114.927 -1.033 . . . . 0.0 110.385 179.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 66.54 55.73 16.5 Favored Glycine 0 N--CA 1.449 -0.466 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.549 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.72 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -113.87 -83.57 0.6 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.771 0.32 . . . . 0.0 110.647 179.49 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.72 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.74 159.63 44.4 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.239 179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.444 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 8.6 p -109.8 138.71 20.76 Favored Pre-proline 0 N--CA 1.449 -0.481 0 CA-C-N 116.074 -0.512 . . . . 0.0 110.667 179.73 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.69 ' HG3' HCC2 ' A' ' 68' ' ' PGM . 17.5 Cg_endo -56.42 -160.21 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.483 0 C-N-CA 122.444 2.096 . . . . 0.0 112.151 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 30.8 m80 59.02 32.09 21.93 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.544 -179.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.194 -0.908 . . . . 0.0 110.922 -179.811 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' PGM . . . . . 1.054 HCE2 HG23 ' A' ' 48' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.356 0 CA-C-O 120.821 0.343 . . . . 0.0 111.016 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 9.4 m -106.26 -67.4 0.94 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.148 -0.478 . . . . 0.0 110.871 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -161.71 108.04 1.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 0.0 110.792 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -83.03 -26.37 31.24 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.067 -0.515 . . . . 0.0 111.162 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 3.7 m -67.77 -13.06 61.8 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.178 -0.464 . . . . 0.0 111.468 -179.797 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.405 ' O ' ' HB3' ' A' ' 27' ' ' ASN . 0.4 OUTLIER -83.6 -31.58 26.21 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-O 121.111 0.481 . . . . 0.0 110.654 179.994 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.625 HD11 ' OE1' ' A' ' 31' ' ' GLN . 0.8 OUTLIER -101.79 -13.78 17.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.676 -0.693 . . . . 0.0 111.369 -179.574 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.36 -36.96 23.16 Favored 'General case' 0 C--N 1.332 -0.179 0 CA-C-O 121.067 0.461 . . . . 0.0 111.295 -179.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 11.5 p -59.05 -25.18 29.1 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.571 0 CA-C-N 115.747 -0.66 . . . . 0.0 111.146 179.901 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.6 t -84.04 -37.52 22.03 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.4 179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.625 ' HB2' ' HE2' ' A' ' 47' ' ' TYR . . . -47.84 -27.88 2.31 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.536 -179.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 66.4 m -51.43 -29.87 17.49 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.889 -0.596 . . . . 0.0 111.416 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . 0.585 ' HB2' ' H ' ' A' ' 19' ' ' LYS . . . -140.58 21.27 2.36 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.593 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.449 ' CG2' ' HA ' ' A' ' 11' ' ' ALA . 0.5 OUTLIER -80.22 -45.03 22.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.244 0 CA-C-O 120.81 0.338 . . . . 0.0 111.253 179.959 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.471 HD23 ' HB3' ' A' ' 46' ' ' GLN . 2.2 mp -80.2 -68.07 0.71 Allowed 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.04 -179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 16.1 m -79.43 -64.08 1.27 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.206 -0.452 . . . . 0.0 110.99 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.503 ' HA2' ' HB1' ' A' ' 13' ' ' ALA . . . 114.09 49.07 0.55 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.695 -0.764 . . . . 0.0 112.497 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.02 -42.33 99.77 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 121.096 0.474 . . . . 0.0 111.216 -179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.585 ' H ' ' HB2' ' A' ' 13' ' ' ALA . 0.0 OUTLIER -178.97 94.92 0.21 Allowed Pre-proline 0 C--N 1.321 -0.64 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.942 -179.957 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_endo -67.0 -167.26 0.13 Allowed 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 122.438 2.092 . . . . 0.0 112.238 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.4 t -172.45 144.38 1.5 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.812 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -58.04 -29.1 61.89 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.772 -0.728 . . . . 0.0 112.604 -179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -48.39 -31.86 6.77 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-O 120.842 0.353 . . . . 0.0 111.144 -179.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 41.3 t -53.86 -25.11 18.24 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.342 -179.848 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.2 m -75.79 -50.57 14.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.166 -0.47 . . . . 0.0 110.677 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -62.63 -32.83 84.75 Favored Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 120.798 -0.715 . . . . 0.0 112.511 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . 0.405 ' HB3' ' O ' ' A' ' 6' ' ' GLN . 34.5 m120 -66.39 -64.72 0.8 Allowed 'General case' 0 N--CA 1.451 -0.424 0 CA-C-O 121.155 0.502 . . . . 0.0 110.918 -179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.617 HD11 HD22 ' A' ' 62' ' ' LEU . 1.2 pp -50.76 -28.7 9.75 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.499 179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.43 -42.62 74.43 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 115.717 -0.674 . . . . 0.0 110.743 179.784 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.83 -23.99 20.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.384 179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.625 ' OE1' HD11 ' A' ' 7' ' ' LEU . 0.0 OUTLIER -80.89 -71.56 0.46 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.621 -0.718 . . . . 0.0 110.536 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.519 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 48.66 19.8 0.28 Allowed 'General case' 0 C--N 1.332 -0.16 0 CA-C-N 116.106 -0.497 . . . . 0.0 111.827 179.92 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -176.62 26.6 0.06 OUTLIER Glycine 0 N--CA 1.45 -0.422 0 C-N-CA 120.98 -0.629 . . . . 0.0 112.163 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.594 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.5 t -135.27 -38.08 0.77 Allowed 'General case' 0 N--CA 1.443 -0.776 0 CA-C-O 120.869 0.366 . . . . 0.0 111.802 -179.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.519 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 4.6 p90 -56.09 -53.17 60.26 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.495 0.664 . . . . 0.0 111.445 -179.399 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.7 t -55.73 -49.61 72.61 Favored 'General case' 0 C--N 1.313 -0.987 0 CA-C-N 114.898 -1.046 . . . . 0.0 111.334 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.594 HE21 ' HA ' ' A' ' 34' ' ' CYS . 23.1 pt20 -67.65 -26.23 66.11 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.192 -0.458 . . . . 0.0 111.224 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -60.2 -27.91 67.55 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.716 179.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.567 ' HB2' ' CB ' ' A' ' 65' ' ' PRO . . . -56.0 -20.13 15.36 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 116.012 -0.54 . . . . 0.0 111.805 -179.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -91.05 -23.6 20.3 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.864 0.364 . . . . 0.0 111.23 -179.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -67.66 112.1 9.42 Favored Pre-proline 0 C--N 1.326 -0.418 0 CA-C-N 116.081 -0.509 . . . . 0.0 111.042 -179.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_endo -89.23 105.9 0.41 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.918 2.412 . . . . 0.0 112.474 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -170.75 -45.27 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.298 -0.41 . . . . 0.0 111.059 179.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.654 ' OH ' HCP3 ' A' ' 68' ' ' PGM . 47.9 m-85 -75.54 -62.21 1.65 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.254 -0.43 . . . . 0.0 111.065 -179.864 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 57.52 30.61 62.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.711 -0.757 . . . . 0.0 112.388 -179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . 0.471 ' HB3' HD23 ' A' ' 15' ' ' LEU . 0.7 OUTLIER -164.16 -40.72 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.762 0.315 . . . . 0.0 110.995 -179.884 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.68 ' CE2' HCO1 ' A' ' 68' ' ' PGM . 1.7 t80 -59.5 -54.03 51.33 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.935 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.694 ' O ' HCF1 ' A' ' 68' ' ' PGM . 15.3 mt -74.61 -47.83 37.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 115.993 -0.549 . . . . 0.0 111.449 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.406 ' HA ' HCB2 ' A' ' 68' ' ' PGM . 40.5 mtm180 -80.76 28.46 0.34 Allowed 'General case' 0 C--N 1.331 -0.225 0 CA-C-O 120.884 0.373 . . . . 0.0 111.923 -179.833 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.485 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.4 OUTLIER -80.94 151.49 70.59 Favored Pre-proline 0 C--N 1.323 -0.551 0 CA-C-N 116.127 -0.488 . . . . 0.0 110.539 179.326 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 61.3 Cg_endo -73.45 -42.48 0.89 Allowed 'Trans proline' 0 C--N 1.344 0.293 0 C-N-CA 122.223 1.948 . . . . 0.0 112.185 179.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 16.8 m-70 -80.29 -26.36 38.92 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.492 -179.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.485 ' CB ' ' HB3' ' A' ' 50' ' ' SER . . . -57.91 -52.47 65.35 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.193 0.521 . . . . 0.0 111.411 -179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.735 ' HG3' HCE1 ' A' ' 68' ' ' PGM . 1.5 ttp180 -54.12 -32.45 55.08 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.471 -0.786 . . . . 0.0 111.229 -179.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 5.7 t70 -70.9 -41.09 71.74 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.629 179.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.2 m -59.91 -49.12 78.94 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.678 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.7 HD13 HCG1 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -59.67 -50.23 74.67 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 121.181 0.515 . . . . 0.0 110.872 179.857 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 19.4 m -60.43 -44.27 95.96 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.493 -0.776 . . . . 0.0 110.576 179.806 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.87 -32.51 32.47 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-O 121.484 0.659 . . . . 0.0 109.875 178.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -80.12 -35.63 36.48 Favored 'General case' 0 N--CA 1.445 -0.718 0 CA-C-N 114.847 -1.07 . . . . 0.0 110.314 179.378 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 68.29 58.27 7.45 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.616 -0.802 . . . . 0.0 112.401 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.663 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -116.99 -76.49 0.57 Allowed 'General case' 0 C--N 1.331 -0.217 0 CA-C-O 120.644 0.259 . . . . 0.0 110.988 179.714 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.663 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.51 -170.68 3.72 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.052 0.453 . . . . 0.0 111.684 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.541 HG13 ' HD2' ' A' ' 65' ' ' PRO . 61.7 t -148.21 139.79 13.99 Favored Pre-proline 0 N--CA 1.451 -0.399 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.849 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.567 ' CB ' ' HB2' ' A' ' 39' ' ' ALA . 17.9 Cg_endo -58.02 -160.66 0.02 OUTLIER 'Trans proline' 0 C--N 1.346 0.404 0 C-N-CA 122.466 2.111 . . . . 0.0 112.145 179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.549 ' HE1' HCB1 ' A' ' 68' ' ' PGM . 61.2 m80 60.7 35.95 19.6 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.836 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 10.6 p . . . . . 0 C--O 1.249 1.059 0 CA-C-O 118.225 -0.893 . . . . 0.0 110.946 -179.924 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' PGM . . . . . 0.735 HCE1 ' HG3' ' A' ' 54' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.319 0 CA-C-O 120.831 0.348 . . . . 0.0 111.056 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 5.0 m 61.37 104.44 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.163 -0.471 . . . . 0.0 110.903 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.481 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 5.9 mt-30 -62.35 -21.54 65.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.137 -0.483 . . . . 0.0 111.177 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.481 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . 71.56 8.68 6.27 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 116.452 -0.34 . . . . 0.0 111.611 -179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -138.46 12.69 2.77 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.705 0.288 . . . . 0.0 111.185 179.801 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -81.08 -20.24 41.95 Favored 'General case' 0 N--CA 1.449 -0.512 0 CA-C-O 120.834 0.35 . . . . 0.0 111.227 -179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.642 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.4 mt -96.9 -17.45 20.13 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.219 -0.446 . . . . 0.0 111.356 -179.668 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -48.05 -54.04 14.4 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-O 121.178 0.513 . . . . 0.0 111.54 -179.892 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.77 HG11 ' OE1' ' A' ' 23' ' ' GLU . 10.1 p -53.66 -25.46 11.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.363 -179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.3 t -77.15 -29.84 54.76 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.945 -0.57 . . . . 0.0 110.44 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -42.61 -30.84 0.39 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.351 -0.841 . . . . 0.0 111.438 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.3 t -50.26 -31.24 13.65 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.994 179.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -95.36 -29.78 14.27 Favored 'General case' 0 N--CA 1.452 -0.339 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.333 -179.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.84 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.3 mp -76.32 -67.54 0.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.405 -0.361 . . . . 0.0 110.975 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.5 mt -68.11 -77.26 0.08 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.114 -0.494 . . . . 0.0 111.308 -179.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 38.1 t -51.78 -59.27 4.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.269 -0.423 . . . . 0.0 111.183 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 98.88 28.77 7.63 Favored Glycine 0 N--CA 1.451 -0.364 0 C-N-CA 120.677 -0.773 . . . . 0.0 112.381 -179.885 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.36 -78.7 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 121.09 0.471 . . . . 0.0 111.127 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.14 153.98 1.63 Allowed Pre-proline 0 C--N 1.322 -0.627 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.867 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -53.62 -177.92 0.04 OUTLIER 'Trans proline' 0 C--N 1.344 0.323 0 C-N-CA 122.514 2.143 . . . . 0.0 112.233 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -174.76 135.64 0.39 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.877 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.23 -26.73 56.7 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.737 -0.744 . . . . 0.0 112.502 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.77 ' OE1' HG11 ' A' ' 9' ' ' VAL . 0.9 OUTLIER -57.05 -48.02 79.56 Favored 'General case' 0 N--CA 1.448 -0.562 0 CA-C-O 120.863 0.363 . . . . 0.0 111.12 -179.761 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.511 ' O ' HD23 ' A' ' 28' ' ' LEU . 53.5 t -54.22 -29.35 46.08 Favored 'General case' 0 C--N 1.331 -0.229 0 CA-C-N 116.188 -0.46 . . . . 0.0 111.411 -179.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.3 m -70.57 -55.88 7.8 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.65 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -56.39 -31.07 59.41 Favored Glycine 0 N--CA 1.45 -0.411 0 C-N-CA 120.635 -0.793 . . . . 0.0 112.413 179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.7 m120 -70.36 -66.21 0.63 Allowed 'General case' 0 N--CA 1.45 -0.471 0 CA-C-O 121.074 0.464 . . . . 0.0 111.02 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.631 HD11 ' CD2' ' A' ' 62' ' ' LEU . 3.8 pp -52.98 -25.76 13.06 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.722 -0.672 . . . . 0.0 110.573 179.826 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.19 -44.59 88.12 Favored 'General case' 0 N--CA 1.449 -0.498 0 CA-C-N 115.941 -0.572 . . . . 0.0 110.91 179.546 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.63 -26.1 12.65 Favored 'General case' 0 C--N 1.322 -0.616 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.318 179.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.642 ' OE1' HD21 ' A' ' 7' ' ' LEU . 0.6 OUTLIER -81.41 -71.31 0.48 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.554 -0.748 . . . . 0.0 110.89 179.466 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.478 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 51.66 17.97 0.66 Allowed 'General case' 0 N--CA 1.455 -0.221 0 CA-C-N 115.969 -0.559 . . . . 0.0 111.685 -179.976 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 177.74 28.57 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.403 0 CA-C-N 115.978 -0.555 . . . . 0.0 111.96 179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.463 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.2 t -137.53 -34.81 0.68 Allowed 'General case' 0 N--CA 1.443 -0.781 0 CA-C-O 120.993 0.425 . . . . 0.0 111.499 -179.245 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.478 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 0.9 OUTLIER -51.65 -50.45 60.31 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.424 0.631 . . . . 0.0 111.346 -179.205 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -52.51 -41.77 63.72 Favored 'General case' 0 C--N 1.314 -0.96 0 CA-C-N 114.968 -1.015 . . . . 0.0 111.203 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.463 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 28.6 mt-30 -54.72 -29.68 54.1 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.172 -0.467 . . . . 0.0 111.282 -179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 63.6 m-85 -79.44 -22.67 43.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.984 -0.553 . . . . 0.0 111.107 -179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -56.65 -19.24 15.3 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.201 -0.454 . . . . 0.0 111.911 -179.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -108.95 8.95 26.61 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.611 -0.268 . . . . 0.0 111.399 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 4.8 t70 -80.04 131.02 64.32 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-N 116.492 -0.322 . . . . 0.0 110.657 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_endo -65.66 -59.12 0.15 Allowed 'Trans proline' 0 C--N 1.346 0.42 0 C-N-CA 122.506 2.137 . . . . 0.0 112.812 -179.575 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.72 -27.32 27.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.398 -0.364 . . . . 0.0 111.344 -179.609 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.672 ' CZ ' HCP2 ' A' ' 68' ' ' PGM . 3.8 m-30 -97.66 15.54 23.19 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.378 -0.374 . . . . 0.0 111.257 -179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -60.71 -34.56 87.09 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 120.714 -0.755 . . . . 0.0 112.615 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -72.57 -26.63 61.79 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.819 0.342 . . . . 0.0 110.951 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.84 ' OH ' HD13 ' A' ' 14' ' ' ILE . 9.0 t80 -75.17 -46.44 34.13 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.785 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.743 ' CD1' HCJ2 ' A' ' 68' ' ' PGM . 24.8 mm -70.27 -36.94 69.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 115.897 -0.592 . . . . 0.0 111.586 -179.632 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 15.9 mmt85 -80.84 24.39 0.49 Allowed 'General case' 0 C--N 1.331 -0.209 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.617 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.9 OUTLIER -81.18 153.67 71.93 Favored Pre-proline 0 C--N 1.321 -0.635 0 CA-C-N 116.136 -0.483 . . . . 0.0 110.481 179.081 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.431 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 12.7 Cg_endo -81.17 -42.55 0.12 Allowed 'Trans proline' 0 N--CA 1.455 -0.745 0 C-N-CA 122.363 2.042 . . . . 0.0 112.053 179.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.73 -18.11 48.83 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.408 -0.814 . . . . 0.0 111.761 -179.198 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.617 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -57.42 -53.52 57.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.288 0.565 . . . . 0.0 111.374 -179.548 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.7 ttp180 -58.67 -33.57 70.27 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.167 -179.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 4.1 t70 -69.71 -41.71 74.98 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.877 -0.601 . . . . 0.0 110.701 179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 1.1 m -60.4 -48.88 79.84 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.868 179.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.558 HD23 ' CD1' ' A' ' 62' ' ' LEU . 0.1 OUTLIER -61.42 -48.12 82.62 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.883 179.951 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 90.3 m -61.28 -43.53 98.73 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.456 179.661 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.1 t -51.93 -31.72 29.93 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 121.526 0.679 . . . . 0.0 109.83 178.889 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.411 ' SG ' HD21 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -78.66 -33.7 46.91 Favored 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 114.791 -1.095 . . . . 0.0 110.379 179.387 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 70.11 57.58 6.81 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.629 -0.796 . . . . 0.0 112.603 179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.643 HD12 ' H ' ' A' ' 63' ' ' ALA . 0.0 OUTLIER -119.04 -80.85 0.62 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.763 0.316 . . . . 0.0 110.651 179.536 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.643 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.54 167.96 25.65 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.279 -0.419 . . . . 0.0 111.402 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.405 ' CG2' ' HD2' ' A' ' 65' ' ' PRO . 7.3 p -109.85 137.37 20.43 Favored Pre-proline 0 N--CA 1.449 -0.483 0 CA-C-N 116.077 -0.51 . . . . 0.0 110.987 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.405 ' HD2' ' CG2' ' A' ' 64' ' ' VAL . 32.9 Cg_endo -62.92 -163.26 0.04 OUTLIER 'Trans proline' 0 C--N 1.346 0.413 0 C-N-CA 122.363 2.042 . . . . 0.0 112.118 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 78.4 m80 56.42 35.32 25.73 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 0.0 110.929 -179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 25.5 p . . . . . 0 C--O 1.248 1.016 0 CA-C-O 118.256 -0.878 . . . . 0.0 110.869 -179.938 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' PGM . . . . . 0.743 HCJ2 ' CD1' ' A' ' 48' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.363 0 CA-C-O 120.82 0.343 . . . . 0.0 111.041 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -157.42 -60.59 0.09 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.139 -0.482 . . . . 0.0 110.911 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.453 ' O ' ' HB3' ' A' ' 4' ' ' ALA . 0.4 OUTLIER -161.25 -42.88 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.275 -0.42 . . . . 0.0 111.0 -179.874 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.453 ' HB3' ' O ' ' A' ' 3' ' ' GLN . . . 70.48 22.26 5.25 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 116.3 -0.409 . . . . 0.0 111.215 -179.825 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -121.85 -19.83 6.6 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.361 -0.381 . . . . 0.0 111.43 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . 0.451 ' OE1' ' HB3' ' A' ' 30' ' ' ALA . 12.2 mm-40 -75.29 -6.93 52.38 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.584 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.859 HD13 HCK1 ' A' ' 68' ' ' PGM . 4.0 mt -116.14 -20.32 9.9 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.646 -0.252 . . . . 0.0 111.569 -179.332 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.19 -50.48 37.91 Favored 'General case' 0 C--N 1.332 -0.194 0 CA-C-O 121.172 0.511 . . . . 0.0 111.392 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.586 HG21 ' OE1' ' A' ' 23' ' ' GLU . 11.4 p -57.21 -22.83 17.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.661 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.39 -179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.464 ' SG ' HG21 ' A' ' 56' ' ' THR . 3.6 t -81.79 -33.32 30.9 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.63 -179.842 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -45.05 -29.02 0.78 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.426 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -54.95 -45.56 74.92 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.893 179.841 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -79.24 -28.09 42.42 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.1 -0.5 . . . . 0.0 111.336 -179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.529 HD13 ' CZ ' ' A' ' 47' ' ' TYR . 2.0 mp -70.21 -63.21 1.02 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.398 -0.365 . . . . 0.0 110.75 179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 5.1 mt -69.85 -75.02 0.12 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.103 -0.499 . . . . 0.0 111.326 -179.529 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -53.03 -64.12 0.92 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.327 -0.397 . . . . 0.0 111.227 -179.689 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 94.94 32.83 6.93 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.612 -0.804 . . . . 0.0 112.303 -179.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -65.49 -53.68 39.07 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.208 0.528 . . . . 0.0 111.167 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 178.52 157.85 0.61 Allowed Pre-proline 0 C--N 1.321 -0.662 0 CA-C-N 115.43 -0.804 . . . . 0.0 110.767 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.28 -179.2 2.54 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.498 2.132 . . . . 0.0 112.155 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.94 129.76 3.49 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.921 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.12 -28.94 59.08 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 0.0 112.457 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.586 ' OE1' HG21 ' A' ' 9' ' ' VAL . 1.6 tt0 -54.92 -47.18 74.73 Favored 'General case' 0 N--CA 1.449 -0.514 0 CA-C-O 120.925 0.393 . . . . 0.0 110.948 -179.932 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.52 ' O ' HD23 ' A' ' 28' ' ' LEU . 48.3 t -54.6 -30.21 54.02 Favored 'General case' 0 C--N 1.331 -0.239 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.015 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 27.7 t -76.72 -36.31 57.27 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.842 -0.617 . . . . 0.0 110.524 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -80.08 -32.01 37.11 Favored Glycine 0 N--CA 1.451 -0.363 0 C-N-CA 120.788 -0.72 . . . . 0.0 112.611 179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -65.87 -61.01 2.3 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 120.993 0.425 . . . . 0.0 111.026 -179.729 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.803 HD11 ' CD2' ' A' ' 62' ' ' LEU . 3.9 pp -50.59 -27.41 6.77 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.786 -0.643 . . . . 0.0 110.508 179.735 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -53.18 -44.16 67.7 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.811 -0.631 . . . . 0.0 110.704 179.624 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.451 ' HB3' ' OE1' ' A' ' 6' ' ' GLN . . . -55.51 -23.83 28.33 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.087 178.812 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -81.08 -71.73 0.46 Allowed 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.511 -0.768 . . . . 0.0 110.65 179.51 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . 0.483 ' HA ' ' CE2' ' A' ' 35' ' ' PHE . 0.0 OUTLIER 49.86 19.06 0.4 Allowed 'General case' 0 C--N 1.331 -0.207 0 CA-C-N 116.084 -0.507 . . . . 0.0 111.904 179.935 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 179.14 27.8 0.05 OUTLIER Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.954 -0.641 . . . . 0.0 112.177 179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.472 ' HA ' ' NE2' ' A' ' 37' ' ' GLN . 3.3 t -137.4 -34.58 0.7 Allowed 'General case' 0 N--CA 1.443 -0.818 0 CA-C-O 120.916 0.388 . . . . 0.0 111.702 -179.28 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.483 ' CE2' ' HA ' ' A' ' 32' ' ' GLN . 1.5 p90 -53.18 -52.28 59.32 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-O 121.389 0.614 . . . . 0.0 111.369 -179.16 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 1.8 t -51.61 -38.94 56.92 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.025 -0.989 . . . . 0.0 111.233 -179.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.472 ' NE2' ' HA ' ' A' ' 34' ' ' CYS . 29.3 mt-30 -56.43 -28.27 58.99 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.231 -0.44 . . . . 0.0 111.264 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . 0.407 ' CG ' HCK2 ' A' ' 68' ' ' PGM . 43.4 m-85 -77.14 -28.2 54.13 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-N 116.04 -0.527 . . . . 0.0 111.006 -179.871 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.456 ' HB2' ' CB ' ' A' ' 65' ' ' PRO . . . -52.62 -24.51 8.54 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.247 -0.433 . . . . 0.0 111.542 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -103.77 -23.73 13.39 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.161 -0.472 . . . . 0.0 111.175 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.3 t70 -57.94 109.27 1.67 Allowed Pre-proline 0 C--N 1.329 -0.32 0 CA-C-N 116.19 -0.459 . . . . 0.0 111.036 -179.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.0 Cg_endo -83.79 97.95 0.78 Allowed 'Trans proline' 0 C--N 1.346 0.424 0 C-N-CA 122.699 2.266 . . . . 0.0 112.361 -179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -159.96 -45.39 0.05 OUTLIER 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.179 -0.464 . . . . 0.0 110.816 179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.443 ' CZ ' HCN1 ' A' ' 68' ' ' PGM . 91.0 m-85 -90.1 -62.62 1.42 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.836 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 77.65 -58.29 3.8 Favored Glycine 0 N--CA 1.452 -0.272 0 C-N-CA 120.758 -0.734 . . . . 0.0 112.777 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 3.3 tt0 -69.57 -13.57 62.39 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.614 0.245 . . . . 0.0 111.233 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.533 ' CE2' HCN2 ' A' ' 68' ' ' PGM . 2.7 t80 -80.07 -55.65 4.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.824 0.345 . . . . 0.0 111.119 -179.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.604 ' O ' HCC2 ' A' ' 68' ' ' PGM . 37.8 mm -66.76 -55.8 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.165 -0.471 . . . . 0.0 111.348 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -80.64 30.55 0.3 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-O 120.803 0.335 . . . . 0.0 111.676 -179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.472 ' HB3' ' CB ' ' A' ' 53' ' ' ALA . 0.7 OUTLIER -80.71 160.53 66.58 Favored Pre-proline 0 C--N 1.324 -0.502 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.701 179.41 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.408 ' HG2' ' NE2' ' A' ' 52' ' ' HIS . 11.1 Cg_endo -81.05 -44.2 0.1 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.816 0 C-N-CA 122.466 2.111 . . . . 0.0 111.917 179.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . 0.516 ' CD2' ' N ' ' A' ' 52' ' ' HIS . 0.1 OUTLIER -80.81 -24.53 38.45 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 115.372 -0.831 . . . . 0.0 111.705 -179.283 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.66 ' HB1' HCD1 ' A' ' 68' ' ' PGM . . . -55.7 -50.21 70.94 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.204 0.526 . . . . 0.0 111.347 -179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 26.1 mtm180 -56.79 -32.49 65.71 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.398 -0.819 . . . . 0.0 111.219 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 12.5 t0 -68.02 -40.06 83.03 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.778 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.466 HG21 ' SG ' ' A' ' 24' ' ' CYS . 1.2 m -58.76 -50.92 72.14 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 115.498 -0.774 . . . . 0.0 110.876 179.833 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.706 ' CD1' HCD2 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -56.47 -48.81 76.32 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.134 -0.485 . . . . 0.0 110.891 179.896 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 18.6 m -63.14 -41.05 99.23 Favored 'General case' 0 C--N 1.321 -0.664 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.442 179.697 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.2 t -52.93 -36.15 59.42 Favored 'General case' 0 N--CA 1.45 -0.452 0 CA-C-O 121.396 0.617 . . . . 0.0 109.918 179.083 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -80.37 -32.18 37.69 Favored 'General case' 0 N--CA 1.448 -0.548 0 CA-C-N 114.98 -1.009 . . . . 0.0 110.104 179.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 65.66 53.48 31.23 Favored Glycine 0 N--CA 1.449 -0.445 0 C-N-CA 120.727 -0.749 . . . . 0.0 112.846 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.803 ' CD2' HD11 ' A' ' 28' ' ' LEU . 0.0 OUTLIER -112.25 -78.84 0.58 Allowed 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 120.806 0.336 . . . . 0.0 110.786 179.239 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.763 ' H ' HD12 ' A' ' 62' ' ' LEU . . . -150.65 -164.28 1.98 Allowed 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 116.194 -0.457 . . . . 0.0 111.436 179.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.499 HG13 ' HD2' ' A' ' 65' ' ' PRO . 33.7 t -137.1 139.19 27.62 Favored Pre-proline 0 N--CA 1.452 -0.373 0 CA-C-N 116.035 -0.53 . . . . 0.0 110.813 179.757 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.499 ' HD2' HG13 ' A' ' 64' ' ' VAL . 17.9 Cg_endo -56.69 -160.1 0.01 OUTLIER 'Trans proline' 0 C--N 1.347 0.454 0 C-N-CA 122.54 2.16 . . . . 0.0 112.305 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.602 ' CE1' HC91 ' A' ' 68' ' ' PGM . 15.8 m80 67.49 43.4 1.93 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.709 -179.7 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 19.5 m . . . . . 0 C--O 1.25 1.101 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.012 -179.936 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' PGM . . . . . 0.859 HCK1 HD13 ' A' ' 7' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.377 0 CA-C-O 120.808 0.337 . . . . 0.0 111.03 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' CYS . . . . . . . . . . . . . 96.2 m -88.29 63.5 7.18 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.211 -0.449 . . . . 0.0 110.857 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.7 mt-30 -60.85 107.58 0.73 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.868 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -88.2 11.83 15.4 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.162 -0.472 . . . . 0.0 111.751 -179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' SER . . . . . . . . . . . . . 9.7 m -109.78 -23.25 11.5 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 120.772 0.32 . . . . 0.0 111.073 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLN . . . . . . . . . . . . . 10.9 mm-40 -72.1 -11.18 60.63 Favored 'General case' 0 N--CA 1.45 -0.446 0 CA-C-N 116.341 -0.39 . . . . 0.0 111.228 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.861 HD21 ' OE1' ' A' ' 31' ' ' GLN . 2.2 mt -108.59 -17.92 13.85 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.311 -0.404 . . . . 0.0 111.455 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -49.38 -35.53 19.08 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 121.086 0.469 . . . . 0.0 111.236 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.514 HG21 ' OE1' ' A' ' 23' ' ' GLU . 9.1 p -65.05 -24.42 35.4 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.538 0 CA-C-N 115.606 -0.725 . . . . 0.0 111.281 179.925 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 3.5 t -83.08 -32.07 26.97 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 115.982 -0.554 . . . . 0.0 110.435 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.471 ' HB2' HCP3 ' A' ' 68' ' ' PGM . . . -43.89 -30.08 0.64 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 115.399 -0.818 . . . . 0.0 111.389 -179.87 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 1.4 t -53.13 -38.44 62.68 Favored 'General case' 0 C--N 1.325 -0.498 0 CA-C-N 115.679 -0.692 . . . . 0.0 110.691 179.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -82.38 -40.01 21.93 Favored 'General case' 0 N--CA 1.453 -0.322 0 CA-C-N 115.909 -0.587 . . . . 0.0 111.19 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ILE . . . . . 0.672 HD13 ' OH ' ' A' ' 47' ' ' TYR . 4.4 mp -66.18 -58.69 5.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 CA-C-N 116.261 -0.427 . . . . 0.0 110.878 179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 83.6 mt -53.68 -81.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.123 -0.49 . . . . 0.0 111.463 -179.493 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 26.4 t -70.69 -79.64 0.06 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.818 0.342 . . . . 0.0 111.088 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 134.19 43.14 0.13 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.697 -0.763 . . . . 0.0 112.445 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.95 -78.45 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.12 0.486 . . . . 0.0 111.075 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -174.75 141.79 0.73 Allowed Pre-proline 0 C--N 1.322 -0.616 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.889 179.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PRO . . . . . 0.562 ' HB3' HG23 ' A' ' 56' ' ' THR . 54.4 Cg_exo -52.01 -179.86 0.03 OUTLIER 'Trans proline' 0 C--N 1.346 0.41 0 C-N-CA 122.459 2.106 . . . . 0.0 112.297 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -174.22 139.64 0.63 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 0.0 110.96 179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -57.76 -25.22 55.52 Favored Glycine 0 N--CA 1.451 -0.361 0 C-N-CA 120.8 -0.714 . . . . 0.0 112.596 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.514 ' OE1' HG21 ' A' ' 9' ' ' VAL . 4.3 tm-20 -55.25 -48.52 73.85 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-O 120.938 0.399 . . . . 0.0 110.965 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 46.9 t -57.15 -35.97 70.17 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.003 -0.544 . . . . 0.0 111.068 -179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.551 ' HA ' HD21 ' A' ' 28' ' ' LEU . 69.7 m -65.11 -40.49 94.59 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.754 -0.657 . . . . 0.0 110.912 179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -63.53 -42.52 98.88 Favored Glycine 0 N--CA 1.45 -0.401 0 C-N-CA 120.809 -0.71 . . . . 0.0 112.748 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 18.4 m120 -65.09 -61.26 2.25 Favored 'General case' 0 N--CA 1.452 -0.34 0 CA-C-O 121.012 0.434 . . . . 0.0 111.03 -179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.551 HD21 ' HA ' ' A' ' 25' ' ' CYS . 4.6 pp -51.3 -25.8 6.42 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.829 -0.623 . . . . 0.0 110.45 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.52 -56.16 25.46 Favored 'General case' 0 N--CA 1.446 -0.641 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.305 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.55 -25.88 3.07 Favored 'General case' 0 C--N 1.32 -0.707 0 CA-C-N 115.64 -0.709 . . . . 0.0 110.149 179.315 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.861 ' OE1' HD21 ' A' ' 7' ' ' LEU . 1.4 mt-30 -81.75 -71.9 0.46 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.447 -0.797 . . . . 0.0 110.789 179.225 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 47.01 20.66 0.12 Allowed 'General case' 0 CA--C 1.528 0.109 0 CA-C-N 116.045 -0.525 . . . . 0.0 111.518 -179.627 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -145.21 -81.02 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.432 0 C-N-CA 121.063 -0.589 . . . . 0.0 111.9 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' CYS . . . . . 0.561 ' HA ' HE21 ' A' ' 37' ' ' GLN . 3.7 t -58.94 -37.92 77.81 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.189 0.519 . . . . 0.0 110.54 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.565 ' HZ ' HD21 ' A' ' 57' ' ' LEU . 0.0 OUTLIER -50.08 -41.68 48.62 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 115.468 -0.787 . . . . 0.0 109.152 178.734 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 3.8 t -75.78 -33.01 60.16 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 114.888 -1.051 . . . . 0.0 109.605 178.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLN . . . . . 0.561 HE21 ' HA ' ' A' ' 34' ' ' CYS . 28.1 mt-30 -62.46 -32.64 73.54 Favored 'General case' 0 N--CA 1.453 -0.285 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.905 179.697 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 15.6 m-85 -59.18 -19.96 49.68 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.791 -0.641 . . . . 0.0 111.38 -179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.465 ' HB1' ' O ' ' A' ' 65' ' ' PRO . . . -51.32 -25.11 5.37 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 120.8 0.333 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.61 -22.33 12.01 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.239 -0.437 . . . . 0.0 111.09 -179.901 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.829 ' OD1' HG23 ' A' ' 43' ' ' THR . 51.8 t0 -59.63 114.43 9.5 Favored Pre-proline 0 C--N 1.328 -0.367 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.792 179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 98.9 Cg_endo -79.43 3.32 7.59 Favored 'Trans proline' 0 C--N 1.348 0.506 0 C-N-CA 122.547 2.165 . . . . 0.0 113.071 -179.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . 0.829 HG23 ' OD1' ' A' ' 41' ' ' ASP . 41.0 p -51.2 -41.13 60.03 Favored 'General case' 0 C--N 1.332 -0.16 0 CA-C-O 120.819 0.342 . . . . 0.0 111.075 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' TYR . . . . . 0.671 ' CE2' HCN1 ' A' ' 68' ' ' PGM . 56.7 m-85 -105.75 -62.2 1.4 Allowed 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.212 -0.449 . . . . 0.0 110.762 179.908 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.47 -59.45 4.38 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.748 -0.739 . . . . 0.0 112.636 179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLN . . . . . . . . . . . . . 5.9 tt0 -70.54 -20.57 62.8 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.717 0.294 . . . . 0.0 111.138 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.768 ' CE1' HCJ1 ' A' ' 68' ' ' PGM . 7.2 t80 -74.82 -49.91 19.01 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 120.937 0.399 . . . . 0.0 110.865 -179.665 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.451 ' CD1' HCE2 ' A' ' 68' ' ' PGM . 32.8 mm -68.25 -53.22 30.44 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.957 -0.565 . . . . 0.0 111.264 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 70.2 mtt180 -80.64 30.56 0.3 Allowed 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.802 0.334 . . . . 0.0 111.797 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . 0.594 ' HB3' ' HB2' ' A' ' 53' ' ' ALA . 0.8 OUTLIER -80.72 147.59 63.14 Favored Pre-proline 0 C--N 1.325 -0.498 0 CA-C-N 116.229 -0.441 . . . . 0.0 110.757 179.393 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -71.3 -42.06 2.16 Favored 'Trans proline' 0 C--N 1.343 0.286 0 C-N-CA 122.377 2.051 . . . . 0.0 112.281 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' HIS . . . . . . . . . . . . . 8.5 m-70 -80.15 -18.93 48.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.095 -0.502 . . . . 0.0 111.376 -179.816 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.594 ' HB2' ' HB3' ' A' ' 50' ' ' SER . . . -59.08 -55.72 31.44 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 121.218 0.533 . . . . 0.0 111.293 -179.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 1.4 ttp85 -57.25 -33.9 68.05 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.432 -0.804 . . . . 0.0 111.124 -179.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 10.4 t0 -66.7 -49.38 66.29 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-N 115.855 -0.611 . . . . 0.0 110.754 179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . 0.562 HG23 ' HB3' ' A' ' 20' ' ' PRO . 1.2 m -59.42 -48.23 82.44 Favored 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.515 179.539 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.972 HD13 HCD1 ' A' ' 68' ' ' PGM . 0.1 OUTLIER -62.94 -48.14 80.2 Favored 'General case' 0 N--CA 1.45 -0.444 0 CA-C-N 116.01 -0.541 . . . . 0.0 110.674 179.68 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 94.9 m -61.66 -42.77 99.37 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.543 179.941 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.7 t -51.35 -37.55 48.53 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.48 0.657 . . . . 0.0 109.694 179.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' CYS . . . . . 0.528 ' SG ' HD23 ' A' ' 62' ' ' LEU . 0.5 OUTLIER -80.57 -39.22 28.04 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.192 178.933 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 59.5 49.97 72.82 Favored Glycine 0 C--N 1.335 0.473 0 C-N-CA 120.81 -0.71 . . . . 0.0 112.482 179.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.908 HD12 ' N ' ' A' ' 63' ' ' ALA . 1.7 pp -115.36 -40.88 3.35 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 111.632 0.234 . . . . 0.0 111.632 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.908 ' N ' HD12 ' A' ' 62' ' ' LEU . . . -150.78 175.01 12.39 Favored 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.02 0.438 . . . . 0.0 111.628 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.818 HG22 ' HD2' ' A' ' 65' ' ' PRO . 0.4 OUTLIER -146.44 148.14 33.2 Favored Pre-proline 0 N--CA 1.449 -0.492 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.755 179.917 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' PRO . . . . . 0.818 ' HD2' HG22 ' A' ' 64' ' ' VAL . 69.2 Cg_endo -75.9 33.05 0.39 Allowed 'Trans proline' 0 N--CA 1.475 0.432 0 C-N-CA 123.196 2.598 . . . . 0.0 113.287 -179.664 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.451 ' CE1' ' HC8' ' A' ' 68' ' ' PGM . 87.0 m-70 -128.63 29.72 5.23 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 115.688 -0.687 . . . . 0.0 110.682 179.639 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' CYS . . . . . . . . . . . . . 26.3 p . . . . . 0 C--O 1.249 1.051 0 CA-C-O 118.227 -0.892 . . . . 0.0 110.916 -179.904 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' PGM . . . . . 0.972 HCD1 HD13 ' A' ' 57' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_