data_2kfb_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 2kfb _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.627 0 N-CA-C 110.507 -1.037 . . . . 1.0 110.507 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -167.66 107.63 0.57 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.008 -0.277 . . . . 1.0 110.604 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.456 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.23 168.83 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.229 0.538 . . . . 1.0 111.206 -179.128 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 33.0 m -126.24 121.18 31.97 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 107.806 -1.183 . . . . 1.0 107.806 177.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.1 mt -106.59 134.72 49.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.008 -0.996 . . . . 1.0 110.117 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -117.18 128.25 54.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.631 -0.713 . . . . 1.0 111.461 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -53.05 -31.87 43.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.701 -0.681 . . . . 1.0 110.301 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -115.97 160.41 20.3 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.246 0.546 . . . . 1.0 110.774 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -63.76 -173.78 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 1.0 111.047 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.89 26.69 0.48 Allowed Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.765 -0.934 . . . . 1.0 110.765 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 50.29 70.41 0.51 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.147 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -133.69 -159.63 0.98 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.915 0.388 . . . . 1.0 110.378 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.16 -150.77 0.97 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.754 -0.938 . . . . 1.0 110.754 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -68.44 145.56 53.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.738 0.304 . . . . 1.0 110.822 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -135.59 151.84 50.67 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 121.288 0.566 . . . . 1.0 110.457 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -146.24 141.38 27.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.252 -0.886 . . . . 1.0 109.995 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 73.4 tt0 -110.22 121.24 44.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.317 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.57 127.05 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.973 0.416 . . . . 1.0 111.043 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 p -117.15 10.08 13.75 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.731 -0.668 . . . . 1.0 110.589 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.0 t -155.38 166.21 34.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.969 -0.56 . . . . 1.0 110.488 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -57.74 140.18 52.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.659 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.51 146.86 48.54 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.743 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.1 p -114.87 -14.98 11.89 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.787 -0.642 . . . . 1.0 112.17 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -150.87 111.08 4.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.216 0.532 . . . . 1.0 110.352 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 24.7 mt -111.43 0.96 16.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.304 -0.862 . . . . 1.0 110.278 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.566 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 20.4 mt-30 -51.65 -48.22 87.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.009 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.566 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 24.5 Cg_endo -57.22 -33.08 95.34 Favored 'Trans proline' 0 N--CA 1.491 1.37 0 C-N-CA 121.322 1.348 . . . . 1.0 112.239 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.17 -50.61 5.2 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.427 -0.509 . . . . 1.0 110.952 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.25 128.81 54.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.872 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.7 t -95.55 -8.2 35.77 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.842 -0.617 . . . . 1.0 111.631 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -145.0 -70.82 0.27 Allowed 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 112.427 0.528 . . . . 1.0 112.427 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.5 t 76.69 71.68 0.07 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 122.757 0.423 . . . . 1.0 110.325 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -92.76 3.0 56.44 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.609 -0.269 . . . . 1.0 111.378 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.2 p -156.64 158.78 37.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.937 0.399 . . . . 1.0 110.181 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -156.25 153.84 29.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 1.0 111.495 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.5 mtp180 -131.94 122.45 25.63 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 108.771 -0.825 . . . . 1.0 108.771 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.69 110.83 33.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.254 0.55 . . . . 1.0 109.96 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -73.77 -43.5 58.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.296 -0.865 . . . . 1.0 110.851 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 95.7 p -160.83 160.34 30.99 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.761 -0.829 . . . . 1.0 108.761 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.05 168.29 42.8 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 111.158 -0.777 . . . . 1.0 111.158 179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 171' ' ' ILE . 64.7 m -110.28 124.55 51.85 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.919 -0.771 . . . . 1.0 108.919 178.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 57.0 m95 -115.28 152.42 32.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.613 0.721 . . . . 1.0 111.616 -178.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.422 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 2.1 ttt -127.72 133.92 49.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.713 -1.131 . . . . 1.0 109.021 177.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.9 mp -109.96 134.83 51.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.882 -1.054 . . . . 1.0 110.092 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -111.49 133.45 53.77 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.343 0.592 . . . . 1.0 111.378 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.3 pt-20 -60.4 -37.11 79.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.306 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -105.37 153.8 39.44 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.123 -0.944 . . . . 1.0 111.256 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.93 152.51 80.25 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.776 2.318 . . . . 1.0 112.818 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.448 ' C ' ' CD1' ' A' ' 51' ' ' TYR . 3.3 m-80 60.71 32.54 20.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.237 -0.892 . . . . 1.0 110.955 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.448 ' CD1' ' C ' ' A' ' 50' ' ' ASN . 0.1 OUTLIER 46.6 65.07 1.29 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.171 -0.922 . . . . 1.0 109.65 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.7 m -123.2 17.44 9.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.435 -0.802 . . . . 1.0 111.798 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -142.05 -154.28 6.13 Favored Glycine 0 N--CA 1.46 0.289 0 C-N-CA 120.687 -0.768 . . . . 1.0 111.572 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.517 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.0 tp -63.48 152.44 38.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.338 -0.431 . . . . 1.0 109.88 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.422 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 9.7 pt20 -123.72 149.28 45.73 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.646 0.26 . . . . 1.0 111.298 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -125.99 122.9 37.22 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.16 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -82.9 122.38 28.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.084 0.469 . . . . 1.0 110.139 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.6 mp -118.21 147.46 43.36 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.712 -0.676 . . . . 1.0 109.521 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' ' C ' ' A' ' 60' ' ' ARG . 5.3 ptm180 -136.39 161.82 34.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.723 -0.671 . . . . 1.0 109.897 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.404 ' C ' ' O ' ' A' ' 59' ' ' ARG . 62.3 ttp180 -38.49 124.73 1.32 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.766 0.317 . . . . 1.0 110.75 -178.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.6 -178.65 32.08 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.702 -0.959 . . . . 1.0 110.702 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -115.84 131.52 56.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.888 0.375 . . . . 1.0 110.491 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -125.09 113.4 17.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.419 -0.585 . . . . 1.0 109.419 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.48 -1.87 55.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.275 -0.421 . . . . 1.0 111.914 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -148.11 146.76 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.189 -1.041 . . . . 1.0 108.189 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.676 ' H ' ' HD1' ' A' ' 66' ' ' HIS . 8.7 p-80 -66.13 -45.61 80.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.047 0.451 . . . . 1.0 111.296 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 98.9 mm-40 -49.5 -9.86 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.741 -0.663 . . . . 1.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.506 ' H ' ' C ' ' A' ' 66' ' ' HIS . 14.7 mm-40 -81.46 -37.38 28.09 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 120.481 -0.487 . . . . 1.0 111.007 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.431 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -87.89 18.82 3.88 Favored 'General case' 0 CA--C 1.509 -0.62 0 C-N-CA 120.323 -0.551 . . . . 1.0 111.244 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.55 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 63.8 mtp 80.52 19.16 0.54 Allowed 'General case' 0 CA--C 1.521 -0.138 0 O-C-N 123.929 0.768 . . . . 1.0 109.833 -178.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.519 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . . . . . . 0 C--N 1.339 0.697 0 N-CA-C 110.431 -1.067 . . . . 1.0 110.431 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 108.491 -0.929 . . . . 1.0 108.491 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -117.76 7.89 12.59 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 121.015 -0.274 . . . . 1.0 110.978 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.6 p -162.49 162.82 27.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 1.0 110.543 178.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 14.2 p -156.27 147.57 22.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.486 -0.779 . . . . 1.0 110.426 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -126.93 151.44 48.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.912 0.386 . . . . 1.0 110.241 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 17.8 tp -97.45 126.86 42.97 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 177.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.418 HG23 HD13 ' A' ' 82' ' ' ILE . 28.7 mt -83.34 113.8 48.87 Favored Pre-proline 0 CA--C 1.538 0.5 0 C-N-CA 120.807 -0.357 . . . . 1.0 111.337 -177.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo . . . . . 0 N--CA 1.491 1.371 0 C-N-CA 121.811 1.674 . . . . 1.0 111.581 179.141 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 CA--C 1.524 -0.044 0 N-CA-C 109.923 -0.399 . . . . 1.0 109.923 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 12.6 m80 -128.19 97.15 4.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 121.104 -0.238 . . . . 1.0 111.258 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -131.59 136.41 47.76 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 120.631 -0.428 . . . . 1.0 110.647 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.4 tt -148.21 141.53 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-O 120.895 0.379 . . . . 1.0 111.486 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -119.28 98.06 5.97 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.838 -0.619 . . . . 1.0 111.511 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.9 139.82 40.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.203 0.525 . . . . 1.0 110.171 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.587 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 55.1 m-85 -119.84 137.44 53.99 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.984 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.527 ' OE2' ' CD1' ' A' ' 118' ' ' PHE . 1.8 tm-20 -56.32 -66.52 0.42 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.722 -0.672 . . . . 1.0 111.446 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.441 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.2 mtp85 -97.25 167.83 10.79 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.272 0.558 . . . . 1.0 111.715 -177.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 . . . . . 0 N--CA 1.461 0.113 0 CA-C-N 115.229 -0.896 . . . . 1.0 111.558 179.587 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.777 0 N-CA-C 110.891 -0.883 . . . . 1.0 110.891 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -62.97 144.12 57.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 1.0 110.81 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.587 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 6.3 ttp -131.67 148.08 52.56 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 116.345 -0.389 . . . . 1.0 111.013 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.497 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 11.4 tt -141.14 140.93 31.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.484 0 N-CA-C 109.464 -0.569 . . . . 1.0 109.464 177.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.68 137.73 50.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.639 0.733 . . . . 1.0 110.895 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.55 155.68 37.15 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.422 -1.263 . . . . 1.0 110.222 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 16.7 p -143.07 25.98 1.71 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.018 -0.537 . . . . 1.0 110.344 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -166.5 -166.86 0.91 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.842 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -76.09 141.99 41.85 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.111 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.9 m -130.6 92.56 3.27 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.079 -0.51 . . . . 1.0 109.998 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.51 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.3 m -68.48 -32.12 71.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.7 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -133.55 93.32 3.12 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.325 0.583 . . . . 1.0 110.479 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.7 tp -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.232 -0.895 . . . . 1.0 110.363 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -47.73 -9.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.697 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.512 ' H ' ' C ' ' A' ' 112' ' ' LEU . 92.5 m-20 -96.4 -25.31 15.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.035 0.445 . . . . 1.0 110.407 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.9 mmt180 -108.28 -39.96 5.31 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.662 -0.699 . . . . 1.0 111.704 -178.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.497 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 3.6 t80 -124.81 122.07 36.39 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.629 -0.508 . . . . 1.0 109.629 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 78.2 mtt-85 -60.69 -56.07 25.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.641 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.527 ' CD1' ' OE2' ' A' ' 94' ' ' GLU . 95.2 m-85 -46.73 140.04 4.85 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.945 -0.571 . . . . 1.0 109.668 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -101.5 15.02 30.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.028 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 120' ' ' GLU . 3.4 pm0 -151.51 148.66 28.31 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.833 -179.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 36.1 mm -123.71 125.58 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 109.547 -0.538 . . . . 1.0 109.547 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.557 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 16.3 m-70 -108.89 20.81 18.03 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.078 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.4 p 167.44 150.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.515 -0.55 . . . . 1.0 109.515 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 pp -161.27 156.79 24.57 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.709 -0.678 . . . . 1.0 110.285 -178.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.1 112.03 17.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.499 -0.556 . . . . 1.0 109.499 178.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 23.9 t -98.58 105.81 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.207 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.47 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.73 -45.0 22.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.957 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -156.67 157.52 35.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.61 -0.436 . . . . 1.0 111.477 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.432 ' O ' ' O ' ' A' ' 130' ' ' SER . . . 64.2 78.72 0.19 Allowed Glycine 0 C--N 1.333 0.378 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.365 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.432 ' O ' ' O ' ' A' ' 129' ' ' GLY . 4.2 m -32.28 151.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.915 0.388 . . . . 1.0 111.599 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.445 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 46.9 m95 -122.03 168.21 12.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.387 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.36 99.5 2.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.526 -0.306 . . . . 1.0 110.428 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.9 mt -74.77 141.35 44.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.612 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -120.45 134.66 55.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.366 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -48.81 -45.03 39.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.289 -0.414 . . . . 1.0 110.79 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.96 169.04 13.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.261 0.553 . . . . 1.0 110.478 -178.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 18.4 m -75.48 176.32 7.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.303 -0.862 . . . . 1.0 111.303 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 58.21 21.37 8.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.507 -1.224 . . . . 1.0 109.801 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 35.48 78.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.606 -0.724 . . . . 1.0 111.735 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 63.2 ttt180 -149.01 45.6 1.0 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.0 0.429 . . . . 1.0 110.298 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -157.42 -137.51 2.31 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.764 -0.935 . . . . 1.0 110.764 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.436 HH12 ' CG2' ' A' ' 160' ' ' THR . 82.1 mtp180 -78.85 163.26 25.46 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.958 -0.297 . . . . 1.0 110.224 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.55 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.36 136.17 29.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.987 -0.551 . . . . 1.0 110.877 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -128.23 140.4 51.92 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.134 -0.691 . . . . 1.0 109.134 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 39.0 tp -96.01 126.38 41.21 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.725 0.774 . . . . 1.0 111.425 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.578 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.1 mm? -112.68 99.5 7.98 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 114.39 -1.277 . . . . 1.0 109.733 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.481 ' N ' ' HH ' ' A' ' 151' ' ' TYR . 2.0 mpp? -73.94 167.68 33.17 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -62.91 116.43 3.55 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 121.56 1.506 . . . . 1.0 111.163 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 178.08 -158.01 22.58 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 111.021 -0.832 . . . . 1.0 111.021 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -124.78 115.69 21.11 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.081 0.467 . . . . 1.0 110.537 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.481 ' HH ' ' N ' ' A' ' 147' ' ' MET . 37.1 m-85 -107.1 129.47 54.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 1.0 109.878 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -113.15 -4.53 13.78 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.709 0.29 . . . . 1.0 110.604 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -156.38 166.35 33.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.365 0.603 . . . . 1.0 110.337 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -78.09 -20.1 52.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.016 -0.993 . . . . 1.0 112.249 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -69.6 -20.02 63.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.786 0.327 . . . . 1.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -50.42 -47.73 56.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.993 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . . . . . . . . . 24.5 p90 -97.65 22.22 9.32 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.091 0.472 . . . . 1.0 110.35 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.19 74.32 0.31 Allowed Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -121.28 149.1 43.41 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.292 0.568 . . . . 1.0 110.593 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 160' ' ' THR . . . . . 0.436 ' CG2' HH12 ' A' ' 142' ' ' ARG . 11.6 t -77.37 -10.73 59.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.75 -1.114 . . . . 1.0 110.198 178.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -172.0 -165.49 0.36 Allowed 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.131 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.557 ' CB ' ' CD2' ' A' ' 122' ' ' HIS . . . -111.7 -19.71 12.37 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.894 -0.593 . . . . 1.0 110.924 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.6 mtt180 -31.9 116.77 0.19 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.299 0.374 . . . . 1.0 111.881 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 62.4 t -126.28 137.15 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-N 116.13 -0.486 . . . . 1.0 110.575 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -116.47 -34.57 1.29 Allowed Glycine 0 N--CA 1.465 0.581 0 N-CA-C 111.597 -0.601 . . . . 1.0 111.597 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.51 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -159.47 172.22 18.28 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 120.534 -0.466 . . . . 1.0 110.88 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -157.32 142.48 17.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.539 -179.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -130.66 166.36 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.351 -0.981 . . . . 1.0 108.351 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -104.01 139.45 39.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.448 -0.796 . . . . 1.0 109.607 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 19.0 t -81.48 121.22 34.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.849 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . 0.498 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 1.6 mp . . . . . 0 N--CA 1.477 0.922 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.189 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.615 0 N-CA-C 110.459 -1.057 . . . . 1.0 110.459 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -172.81 103.31 0.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.124 -0.324 . . . . 1.0 110.124 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.414 HG21 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.38 166.78 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.089 0.471 . . . . 1.0 111.175 -178.418 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.5 m -124.62 121.19 34.03 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.86 -1.163 . . . . 1.0 107.86 177.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -106.19 133.72 50.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.874 -1.057 . . . . 1.0 110.244 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -115.97 125.94 53.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.351 -0.84 . . . . 1.0 111.219 -178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -53.75 -29.7 41.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.507 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -117.84 153.85 32.81 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.292 0.567 . . . . 1.0 110.675 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.422 ' C ' ' N ' ' A' ' 12' ' ' PHE . 16.3 ptt-85 -59.58 -176.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.827 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 46.1 22.53 0.9 Allowed Glycine 0 C--N 1.33 0.211 0 N-CA-C 110.552 -1.019 . . . . 1.0 110.552 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.537 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 10.6 m-85 54.14 67.85 0.94 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -129.92 -155.66 0.71 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.029 0.443 . . . . 1.0 110.468 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.14 -152.46 0.11 Allowed Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.984 -0.846 . . . . 1.0 110.984 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -68.98 146.53 52.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.787 0.327 . . . . 1.0 110.69 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -135.55 145.19 46.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.265 0.555 . . . . 1.0 110.444 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.4 t80 -140.26 142.26 35.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.31 -0.859 . . . . 1.0 110.213 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.545 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 41.1 tt0 -110.63 122.08 46.89 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.101 -0.499 . . . . 1.0 110.154 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.435 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -109.75 126.24 53.53 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.998 0.428 . . . . 1.0 110.67 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -117.32 13.96 14.65 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.624 -0.716 . . . . 1.0 110.357 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.9 m -157.91 167.87 28.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.582 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -58.67 140.13 55.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.577 -0.738 . . . . 1.0 111.549 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.435 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.16 145.31 45.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.868 -0.605 . . . . 1.0 110.821 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.2 p -112.64 -11.92 13.48 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.976 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -149.73 117.92 6.4 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.514 0.673 . . . . 1.0 110.172 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.8 mp -113.13 -2.44 14.15 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.096 -0.956 . . . . 1.0 110.246 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.629 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.4 OUTLIER -58.15 -41.77 91.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.301 -178.867 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.9 Cg_exo -58.79 -37.7 92.53 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.175 1.917 . . . . 1.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -97.22 -51.21 4.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.919 0.39 . . . . 1.0 111.327 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.503 ' N ' ' O ' ' A' ' 26' ' ' LEU . 6.9 mt -118.55 127.95 54.1 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.735 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -94.75 -8.39 37.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.937 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -147.5 -58.04 0.25 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.955 0.354 . . . . 1.0 111.955 -178.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t 63.08 74.83 0.42 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.755 0.312 . . . . 1.0 110.174 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.578 ' ND2' ' HD1' ' A' ' 66' ' ' HIS . 1.3 t30 -90.56 3.89 52.77 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.197 -0.456 . . . . 1.0 111.284 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.537 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -157.25 155.9 31.58 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 1.0 110.051 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 155.11 35.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 1.0 111.431 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -132.74 121.41 23.01 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 108.602 -0.888 . . . . 1.0 108.602 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.3 t -108.53 117.77 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 O-C-N 123.629 0.581 . . . . 1.0 109.905 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -78.84 -43.81 24.35 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.995 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.1 m -161.2 159.38 28.76 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.316 -0.624 . . . . 1.0 109.316 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.21 174.45 50.39 Favored Glycine 0 C--N 1.316 -0.55 0 N-CA-C 110.96 -0.856 . . . . 1.0 110.96 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 98.3 m -112.85 131.0 55.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.949 -0.76 . . . . 1.0 108.949 178.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.414 ' CE2' HG21 ' A' ' 4' ' ' ILE . 54.6 m95 -119.26 143.21 47.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.29 0.567 . . . . 1.0 111.438 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.2 tpt -113.93 129.0 56.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.393 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.411 ' CD1' ' N ' ' A' ' 45' ' ' LEU . 9.6 mp -108.15 127.57 53.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.995 -0.743 . . . . 1.0 108.995 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -106.85 133.41 51.55 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.687 0.756 . . . . 1.0 111.215 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.524 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.4 pt-20 -62.66 -36.7 83.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.828 -1.078 . . . . 1.0 110.296 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -106.59 151.68 40.49 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.244 -0.889 . . . . 1.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.1 154.14 74.91 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.575 2.183 . . . . 1.0 112.737 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.462 ' N ' HD21 ' A' ' 50' ' ' ASN . 1.4 m-80 59.47 34.8 22.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.967 -1.015 . . . . 1.0 110.721 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 23' ' ' HIS . 1.5 m-85 42.93 66.22 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.34 -0.846 . . . . 1.0 110.26 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.4 m -123.58 17.31 9.61 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.283 -0.871 . . . . 1.0 111.298 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.29 -155.12 6.37 Favored Glycine 0 N--CA 1.462 0.375 0 C-N-CA 120.693 -0.765 . . . . 1.0 111.553 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.524 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.4 tp -65.82 151.99 45.41 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.459 -0.371 . . . . 1.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -123.15 152.03 41.54 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.742 0.306 . . . . 1.0 111.624 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -127.76 125.82 40.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.011 -0.541 . . . . 1.0 111.302 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -82.6 121.92 27.44 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.336 -0.393 . . . . 1.0 109.962 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.34 146.08 47.65 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.11 0.481 . . . . 1.0 110.311 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.467 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 42.5 mtp180 -134.69 160.42 38.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.494 -0.775 . . . . 1.0 110.283 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' A' ' 59' ' ' ARG . 9.7 ptm180 -34.02 127.32 0.42 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.829 -0.623 . . . . 1.0 111.272 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.63 -179.53 30.66 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.084 -0.807 . . . . 1.0 111.084 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.9 p-10 -116.36 125.19 51.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.161 0.505 . . . . 1.0 110.432 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -118.93 113.49 21.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.769 -0.651 . . . . 1.0 109.426 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.422 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.44 -3.31 53.35 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.669 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.422 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -148.36 141.63 25.13 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.628 -0.879 . . . . 1.0 108.628 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.578 ' HD1' ' ND2' ' A' ' 34' ' ' ASN . 22.8 p-80 -62.52 -41.41 98.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.174 0.512 . . . . 1.0 110.689 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -51.98 -8.94 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.46 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.503 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -81.31 -34.93 31.6 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.116 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -92.78 15.65 14.15 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 120.813 -0.355 . . . . 1.0 110.515 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 58.7 mtt 72.55 30.55 1.88 Allowed 'General case' 0 CA--C 1.514 -0.433 0 O-C-N 124.31 1.006 . . . . 1.0 109.633 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.668 0 CA-C-O 118.786 -1.008 . . . . 1.0 112.834 -178.968 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 C--O 1.232 0.152 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -122.91 4.78 9.38 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.703 0.287 . . . . 1.0 110.723 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.7 t -166.12 163.42 18.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.199 0.523 . . . . 1.0 110.822 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -155.89 146.63 22.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.433 -0.803 . . . . 1.0 109.945 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.519 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 3.1 ptm180 -126.99 151.51 48.48 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 27.5 tp -100.05 135.22 41.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.457 -0.942 . . . . 1.0 108.457 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mt -96.7 111.32 56.94 Favored Pre-proline 0 CA--C 1.543 0.711 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 N--CA 1.5 1.9 0 C-N-CA 121.901 1.734 . . . . 1.0 113.295 -179.598 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' SER . . . . . 0.405 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 3.8 m . . . . . 0 CA--C 1.521 -0.153 0 N-CA-C 109.744 -0.465 . . . . 1.0 109.744 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -128.06 104.17 7.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.835 -0.166 . . . . 1.0 111.379 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -136.29 139.64 42.8 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.191 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 tt -149.6 141.81 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.735 0.302 . . . . 1.0 111.389 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -119.05 98.39 6.15 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.922 -0.581 . . . . 1.0 112.237 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.1 mt -79.88 142.91 34.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.538 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -125.41 137.68 54.01 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.822 -0.626 . . . . 1.0 111.923 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.505 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 2.3 tm-20 -56.08 -58.14 9.18 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.791 -0.64 . . . . 1.0 111.584 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -107.36 172.34 6.88 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.173 0.511 . . . . 1.0 111.128 -178.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.432 -0.804 . . . . 1.0 110.735 179.377 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.709 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -69.04 141.55 54.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.006 0.431 . . . . 1.0 110.872 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.515 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 154.36 48.22 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.661 -0.7 . . . . 1.0 111.058 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.6 tt -145.77 139.42 21.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 N-CA-C 109.33 -0.619 . . . . 1.0 109.33 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -113.39 144.73 42.29 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.681 0.753 . . . . 1.0 111.141 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -130.61 156.3 45.1 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 114.692 -1.14 . . . . 1.0 110.934 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.0 p -143.66 31.57 1.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.477 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -170.85 -169.08 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.628 -0.429 . . . . 1.0 110.796 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 55.2 p-10 -82.68 149.29 27.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.353 179.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.63 101.1 4.38 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.334 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.468 ' C ' ' HG ' ' A' ' 166' ' ' SER . 78.1 p -69.14 -19.47 64.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.635 -0.426 . . . . 1.0 111.072 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 33.7 t -149.83 91.07 1.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.155 0.502 . . . . 1.0 109.989 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 115' ' ' ARG . 13.6 tp -58.97 -39.68 82.47 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.32 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.572 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 14.4 mp0 -42.75 -14.01 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.971 0.36 . . . . 1.0 111.971 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.519 ' N ' ' O ' ' A' ' 112' ' ' LEU . 55.3 t0 -93.1 0.45 57.26 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.582 0.706 . . . . 1.0 110.401 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 112' ' ' LEU . 36.8 mmt180 -132.16 -39.13 1.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 1.0 113.266 -177.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.684 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.91 134.7 55.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 122.19 0.995 . . . . 1.0 110.96 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 118' ' ' PHE . 38.1 mmt180 -71.47 -69.97 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.064 -1.022 . . . . 1.0 110.433 -177.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.625 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -37.29 146.84 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.968 -0.56 . . . . 1.0 110.347 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 p-10 -105.24 11.19 33.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.767 0.318 . . . . 1.0 110.962 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -140.49 141.38 35.37 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.267 0.556 . . . . 1.0 111.173 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.1 mm -121.09 126.91 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-N 115.251 -0.886 . . . . 1.0 109.498 178.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.555 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.0 m-70 -118.56 26.74 9.37 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.141 -0.481 . . . . 1.0 111.69 -178.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 3.8 m 165.21 151.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.449 . . . . 1.0 110.276 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.4 pp -163.79 158.12 19.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.681 -0.69 . . . . 1.0 110.78 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.14 117.97 26.59 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.505 -0.554 . . . . 1.0 109.505 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 23.2 t -101.92 105.01 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-N 116.235 -0.438 . . . . 1.0 110.109 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.517 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.83 -44.2 28.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.82 -0.627 . . . . 1.0 111.177 179.39 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.405 ' CG ' ' O ' ' A' ' 87' ' ' SER . 33.0 tp10 -157.72 150.25 22.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 120.695 -0.402 . . . . 1.0 111.277 -178.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.554 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.6 79.7 0.29 Allowed Glycine 0 C--O 1.229 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.0 112.322 177.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 146' ' ' LEU . 45.3 t -31.6 148.38 0.01 OUTLIER 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.345 0.593 . . . . 1.0 111.242 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.554 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 41.7 m95 -124.3 163.07 22.44 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.096 -0.956 . . . . 1.0 111.289 -177.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.9 t -132.46 138.34 52.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 N-CA-C 108.754 -0.832 . . . . 1.0 108.754 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 43.4 mt -110.39 141.74 43.04 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.679 -0.489 . . . . 1.0 109.679 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -117.74 135.3 54.13 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.209 0.318 . . . . 1.0 110.896 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -48.35 -42.08 30.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.33 167.27 19.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.208 0.528 . . . . 1.0 110.181 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.4 m -72.94 175.22 6.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.858 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 62.0 16.69 8.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.856 -1.065 . . . . 1.0 109.796 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 39.24 77.86 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.533 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -146.57 41.18 1.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.723 0.297 . . . . 1.0 110.48 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.5 -142.8 3.54 Favored Glycine 0 N--CA 1.463 0.485 0 N-CA-C 111.31 -0.716 . . . . 1.0 111.31 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -73.5 166.76 22.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 120.786 -0.366 . . . . 1.0 110.154 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -146.27 136.44 23.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.009 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -128.1 130.3 47.95 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 109.557 -0.535 . . . . 1.0 109.557 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 45.4 tp -85.51 126.95 34.25 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.342 0.591 . . . . 1.0 111.219 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.438 ' O ' ' OG ' ' A' ' 130' ' ' SER . 25.6 mt -114.75 106.5 14.28 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.156 -0.929 . . . . 1.0 109.819 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.59 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.7 160.81 65.97 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.291 -179.669 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.75 112.62 1.26 Allowed 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.302 2.001 . . . . 1.0 110.868 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.99 -152.55 12.35 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 110.538 -1.025 . . . . 1.0 110.538 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 49.0 p-10 -125.94 134.72 51.44 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.09 0.472 . . . . 1.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -124.83 124.62 42.48 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.924 -0.58 . . . . 1.0 109.638 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . 0.53 ' C ' ' OG ' ' A' ' 123' ' ' SER . 95.2 mtt-85 -112.97 1.8 15.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.626 0.25 . . . . 1.0 110.369 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.677 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.9 ptm180 -160.83 162.61 32.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.556 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.528 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -75.76 -24.06 56.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.138 -0.937 . . . . 1.0 112.314 -178.233 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.677 ' NE2' HH21 ' A' ' 153' ' ' ARG . 1.1 mt-30 -63.89 -20.18 65.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.282 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . 0.479 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 52.6 t0 -51.22 -49.31 61.32 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.365 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.424 ' HE1' ' CB ' ' A' ' 159' ' ' ALA . 26.1 p90 -96.58 19.05 12.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.026 0.441 . . . . 1.0 110.505 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.07 73.95 0.34 Allowed Glycine 0 CA--C 1.52 0.389 0 N-CA-C 111.227 -0.749 . . . . 1.0 111.227 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.477 ' O ' ' CE2' ' A' ' 154' ' ' TYR . . . -116.45 141.92 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 1.0 111.337 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -66.79 -38.68 87.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.5 -1.227 . . . . 1.0 110.238 177.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -145.21 -172.51 3.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.019 0.438 . . . . 1.0 110.265 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.411 ' CB ' ' CD2' ' A' ' 122' ' ' HIS . . . -108.83 -2.06 18.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.822 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -53.99 118.13 3.76 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.001 0.429 . . . . 1.0 111.239 -178.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.87 131.23 72.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.463 -0.79 . . . . 1.0 109.49 178.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.31 -28.57 4.3 Favored Glycine 0 N--CA 1.465 0.605 0 N-CA-C 111.659 -0.576 . . . . 1.0 111.659 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.468 ' HG ' ' C ' ' A' ' 110' ' ' SER . 7.9 m -159.47 -172.3 3.66 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.938 -0.393 . . . . 1.0 109.938 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.3 pp -173.57 145.06 1.17 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.433 -0.507 . . . . 1.0 111.56 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.467 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 6.2 ptm180 -133.84 164.76 26.54 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.067 0.46 . . . . 1.0 110.285 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.33 147.03 25.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.581 -0.896 . . . . 1.0 108.581 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 61.2 t -79.55 84.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.157 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.8 mp . . . . . 0 N--CA 1.465 0.291 0 N-CA-C 109.66 -0.496 . . . . 1.0 109.66 179.154 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.529 0 N-CA-C 110.523 -1.031 . . . . 1.0 110.523 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -171.88 106.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.996 -0.282 . . . . 1.0 110.724 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.73 170.36 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 121.129 0.49 . . . . 1.0 111.059 -178.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.6 m -127.41 120.41 28.38 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.226 -1.027 . . . . 1.0 108.226 177.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.4 mt -105.87 133.43 50.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.938 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -114.83 129.39 56.69 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.505 -0.771 . . . . 1.0 111.026 -178.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.535 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.5 tt0 -56.03 -23.16 31.45 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.308 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -123.73 155.22 38.25 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.045 0.45 . . . . 1.0 110.465 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.84 -174.48 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.558 -0.746 . . . . 1.0 110.501 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.46 28.64 0.61 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 110.964 -0.855 . . . . 1.0 110.964 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.546 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 6.1 m-85 49.71 67.24 0.93 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.921 -0.4 . . . . 1.0 109.921 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -128.15 -160.83 1.05 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.953 0.406 . . . . 1.0 110.58 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.92 -151.74 0.73 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.535 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.1 mtm180 -69.3 148.95 49.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.705 0.288 . . . . 1.0 110.782 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.5 p-80 -135.42 145.71 47.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.308 0.575 . . . . 1.0 110.284 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.9 t80 -140.89 141.95 34.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.127 -0.942 . . . . 1.0 109.809 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.558 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 66.7 tt0 -110.53 120.89 43.88 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.124 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -107.92 126.52 52.78 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.033 0.444 . . . . 1.0 110.747 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -117.58 12.23 14.01 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.55 -0.75 . . . . 1.0 110.385 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 35.5 p -156.94 167.09 31.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.191 0.52 . . . . 1.0 110.425 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 53.8 p-10 -58.1 142.56 46.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.555 -0.748 . . . . 1.0 111.684 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.75 147.17 44.48 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.904 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -115.45 -16.29 11.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.614 -0.721 . . . . 1.0 111.908 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -150.18 109.96 4.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 1.0 109.989 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 20.9 mt -108.43 2.36 22.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.388 -0.823 . . . . 1.0 110.41 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.615 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 10.3 mt-30 -56.89 -41.06 89.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.141 -0.482 . . . . 1.0 110.698 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.3 Cg_exo -59.34 -36.47 94.3 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.058 1.838 . . . . 1.0 111.999 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -94.21 -47.51 6.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.843 0.354 . . . . 1.0 111.24 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -120.09 127.79 52.86 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.338 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -91.26 -6.8 52.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.854 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.615 ' NE ' HD22 ' A' ' 34' ' ' ASN . 3.4 mmm-85 177.59 120.58 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t -102.09 111.35 23.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 1.0 110.498 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.615 HD22 ' NE ' ' A' ' 32' ' ' ARG . 19.2 m120 -106.01 -3.72 21.34 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.247 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.546 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 3.8 t -157.11 155.64 31.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.801 0.334 . . . . 1.0 110.371 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . 0.439 ' N ' ' HG ' ' A' ' 35' ' ' SER . . . -153.04 155.25 36.52 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.205 -179.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -132.7 122.04 24.01 Favored 'General case' 0 C--O 1.217 -0.641 0 N-CA-C 108.794 -0.817 . . . . 1.0 108.794 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.67 116.32 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.29 0.567 . . . . 1.0 109.799 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.29 -43.97 31.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.335 -0.848 . . . . 1.0 110.979 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.4 t -161.89 152.79 17.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 109.226 -0.657 . . . . 1.0 109.226 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.82 176.38 49.33 Favored Glycine 0 C--N 1.317 -0.501 0 N-CA-C 111.07 -0.812 . . . . 1.0 111.07 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.1 m -113.02 139.68 48.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 178.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.445 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 55.3 m95 -128.18 138.88 52.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.225 0.536 . . . . 1.0 111.268 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -107.43 127.19 53.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.357 -0.838 . . . . 1.0 109.282 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.4 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 10.2 mp -108.65 129.84 55.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.536 -0.756 . . . . 1.0 109.297 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -112.23 131.65 55.37 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.631 0.729 . . . . 1.0 111.094 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.9 pt-20 -58.88 -35.42 72.96 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.067 -0.97 . . . . 1.0 111.072 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -108.57 154.22 41.72 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.689 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -66.05 159.12 50.9 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.843 2.362 . . . . 1.0 112.866 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.599 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.8 OUTLIER 62.94 43.3 6.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.917 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 44.2 72.74 0.18 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.836 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.0 m -141.2 157.77 44.8 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.743 -0.466 . . . . 1.0 109.743 -178.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.36 -146.84 21.16 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.78 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.599 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.7 tp -79.72 144.02 34.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.971 -0.614 . . . . 1.0 110.282 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -120.73 150.7 40.57 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.45 0.167 . . . . 1.0 110.872 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -126.73 126.26 43.18 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-O 120.83 0.348 . . . . 1.0 111.318 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -82.94 122.74 28.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.955 -0.566 . . . . 1.0 109.495 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.6 mp -121.19 146.21 47.02 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.066 -0.516 . . . . 1.0 110.189 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.55 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 36.9 mtp180 -134.09 159.19 41.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.277 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.6 ptm180 -35.09 125.67 0.57 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.804 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 -178.64 32.92 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.683 -0.967 . . . . 1.0 110.683 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 42.2 p-10 -116.4 126.99 54.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.02 0.438 . . . . 1.0 110.608 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.453 ' O ' ' OG ' ' A' ' 35' ' ' SER . 43.8 m-85 -121.43 113.94 20.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.815 -0.63 . . . . 1.0 109.43 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.5 -2.83 53.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.637 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -147.95 140.77 24.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.835 -0.802 . . . . 1.0 108.835 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.495 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.8 p-80 -62.13 -42.03 98.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.06 0.457 . . . . 1.0 110.799 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -52.16 -8.63 0.08 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.606 -0.725 . . . . 1.0 110.665 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.495 ' H ' ' C ' ' A' ' 66' ' ' HIS . 16.9 mm-40 -83.58 -36.06 24.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.552 -0.459 . . . . 1.0 111.363 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.434 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -90.85 15.93 10.35 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.709 -0.396 . . . . 1.0 111.265 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.495 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 44.3 mtt 84.0 14.22 0.3 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 124.175 0.922 . . . . 1.0 109.574 -178.254 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.711 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.188 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.471 0.606 0 CA-C-O 120.782 0.325 . . . . 1.0 110.785 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -104.45 4.95 33.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.648 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 p -163.17 162.56 25.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.263 0.554 . . . . 1.0 110.61 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.0 p -157.46 148.45 21.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 1.0 110.058 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.599 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 4.3 ptm180 -127.93 149.86 50.14 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.75 0.31 . . . . 1.0 110.397 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.9 tp -99.08 129.11 45.33 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.253 -1.017 . . . . 1.0 108.253 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.5 mt -90.89 114.17 60.52 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 109.893 -0.41 . . . . 1.0 109.893 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo . . . . . 0 N--CA 1.5 1.911 0 C-N-CA 121.97 1.78 . . . . 1.0 113.215 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.231 0.122 0 N-CA-C 109.664 -0.495 . . . . 1.0 109.664 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -129.78 119.26 23.12 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.706 -0.225 . . . . 1.0 110.96 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -147.86 133.78 19.13 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.6 tt -147.51 146.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.962 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -125.71 103.69 7.96 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 123.389 0.43 . . . . 1.0 111.511 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.21 149.1 25.33 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.157 0.503 . . . . 1.0 111.839 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -125.44 138.92 54.02 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.823 -0.626 . . . . 1.0 112.396 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.469 ' N ' ' CD ' ' A' ' 94' ' ' GLU . 1.2 mm-40 -57.19 -55.25 37.22 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.803 -0.635 . . . . 1.0 111.2 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.424 ' O ' ' OG ' ' A' ' 123' ' ' SER . 75.7 mtp180 -109.68 173.24 6.42 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.238 -178.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 . . . . . 0 C--N 1.332 -0.188 0 CA-C-N 115.61 -0.723 . . . . 1.0 111.27 179.657 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.603 0 N-CA-C 110.874 -0.891 . . . . 1.0 110.874 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.471 ' NE2' ' H ' ' A' ' 102' ' ' MET . 53.9 tp60 -56.34 156.43 5.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.231 0.538 . . . . 1.0 110.617 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.471 ' H ' ' NE2' ' A' ' 101' ' ' GLN . 0.4 OUTLIER -127.4 146.06 50.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.954 -0.566 . . . . 1.0 110.651 -179.752 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.6 tt -141.8 140.49 30.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -114.31 143.6 44.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.573 0.701 . . . . 1.0 110.949 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.4 ' CE2' HD11 ' A' ' 112' ' ' LEU . 86.1 m-85 -130.37 154.38 47.75 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 114.781 -1.1 . . . . 1.0 110.739 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.61 11.23 1.65 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 1.0 111.151 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.964 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.5 pt-20 -160.79 79.11 0.62 Allowed 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 119.221 -0.419 . . . . 1.0 109.918 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.964 ' O ' ' O ' ' A' ' 107' ' ' GLU . 55.5 p30 18.77 167.96 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 122.434 1.112 . . . . 1.0 113.634 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 10.5 t -148.0 109.7 4.45 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 120.737 -1.227 . . . . 1.0 110.505 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.459 ' O ' ' OG ' ' A' ' 137' ' ' SER . 78.2 p -68.53 -18.58 64.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.309 -0.405 . . . . 1.0 110.9 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.423 ' SG ' ' O ' ' A' ' 110' ' ' SER . 85.1 m -151.84 88.7 1.42 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 1.0 109.819 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.564 ' O ' ' N ' ' A' ' 114' ' ' ASP . 11.9 tp -61.01 -41.49 96.64 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.163 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.5 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 24.3 mp0 -43.16 -10.29 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.285 -0.416 . . . . 1.0 112.113 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.564 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.7 t0 -95.13 -22.83 17.61 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 1.0 110.434 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.511 ' N ' ' O ' ' A' ' 112' ' ' LEU . 34.5 mmt180 -107.06 -38.67 5.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.136 0.791 . . . . 1.0 113.136 -178.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.66 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -119.11 138.58 52.8 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 122.035 0.922 . . . . 1.0 110.811 -179.828 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 118' ' ' PHE . 32.1 mmt180 -72.21 -73.67 0.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.11 -0.994 . . . . 1.0 110.447 -177.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.616 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 98.1 m-85 -33.23 143.22 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.485 0 O-C-N 123.588 0.555 . . . . 1.0 110.515 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -103.07 6.49 38.66 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.079 0.466 . . . . 1.0 110.853 -178.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -137.68 141.59 41.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.753 -0.658 . . . . 1.0 111.017 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 41.8 mm -121.19 116.94 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.258 -0.883 . . . . 1.0 109.582 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.438 ' O ' ' CB ' ' A' ' 123' ' ' SER . 37.7 m-70 -109.44 29.97 7.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.581 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.8 p 163.33 149.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.095 0.474 . . . . 1.0 110.078 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.9 pp -163.3 157.52 20.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.338 -178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.91 119.62 29.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.792 0.33 . . . . 1.0 110.161 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 44.3 t -103.17 104.01 15.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.588 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.4 OUTLIER -77.91 -40.76 38.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.658 -0.701 . . . . 1.0 111.331 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -137.21 146.37 44.77 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.102 0.477 . . . . 1.0 111.26 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.55 -171.39 2.36 Favored Glycine 0 CA--C 1.519 0.327 0 N-CA-C 111.177 -0.769 . . . . 1.0 111.177 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.3 m -119.37 157.12 28.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.318 0.58 . . . . 1.0 109.877 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -129.98 162.27 29.05 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.452 -0.795 . . . . 1.0 110.753 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 47.0 t -132.32 138.34 52.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 N-CA-C 109.181 -0.674 . . . . 1.0 109.181 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 39.3 mt -110.75 143.18 41.66 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.793 -0.447 . . . . 1.0 109.793 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -117.97 133.35 56.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.756 0.312 . . . . 1.0 110.904 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 -47.41 -30.38 3.28 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.943 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.41 ' C ' ' CD1' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -140.27 177.13 8.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 1.0 110.493 -179.677 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 137' ' ' SER . . . . . 0.464 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -83.37 172.29 12.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.637 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . 0.464 ' N ' ' OG ' ' A' ' 137' ' ' SER . 6.2 m120 64.24 19.21 11.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.17 -0.923 . . . . 1.0 110.078 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 35.59 78.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.706 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -147.38 36.79 0.91 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.185 0.516 . . . . 1.0 110.388 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -149.25 -141.77 3.49 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 111.163 -0.775 . . . . 1.0 111.163 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.25 164.89 25.98 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.058 -0.349 . . . . 1.0 110.058 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.495 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.99 137.59 29.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.791 -179.681 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -127.56 124.2 37.61 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.558 -0.534 . . . . 1.0 109.558 178.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.7 tp -81.0 127.22 32.33 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.806 -0.634 . . . . 1.0 111.048 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.1 mt -115.32 105.09 12.46 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.643 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.599 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.8 mtm -80.76 159.84 68.07 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.383 -0.372 . . . . 1.0 110.105 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -56.06 115.99 2.86 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.27 1.98 . . . . 1.0 110.966 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 174.75 -151.29 12.22 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 110.513 -1.035 . . . . 1.0 110.513 -179.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.44 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 42.2 p-10 -128.55 131.92 48.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.977 0.417 . . . . 1.0 110.954 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 14.6 m-85 -122.14 127.97 50.72 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.019 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -115.52 -1.1 12.86 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.719 0.295 . . . . 1.0 110.692 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -156.96 163.1 39.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.305 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.539 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -75.96 -22.34 56.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.055 -0.975 . . . . 1.0 111.827 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.539 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.42 -21.47 66.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.249 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -49.75 -47.32 50.87 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.909 -178.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.486 ' HE1' ' HB1' ' A' ' 159' ' ' ALA . 30.5 p90 -102.48 17.57 23.3 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.175 0.512 . . . . 1.0 109.95 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.57 74.17 0.32 Allowed Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.467 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.486 ' HB1' ' HE1' ' A' ' 157' ' ' TRP . . . -92.58 -171.24 2.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.35 0.595 . . . . 1.0 110.907 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.58 -35.58 3.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.985 -1.007 . . . . 1.0 112.277 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.53 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 0.3 OUTLIER -145.67 -27.4 0.45 Allowed 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 111.696 0.258 . . . . 1.0 111.696 -178.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.53 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 96.92 0.38 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 124.36 1.038 . . . . 1.0 110.736 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -66.55 116.07 7.12 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.139 -178.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 60.5 t -118.8 128.79 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.198 -0.91 . . . . 1.0 110.415 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.443 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -104.65 -26.02 6.65 Favored Glycine 0 N--CA 1.464 0.53 0 N-CA-C 111.393 -0.683 . . . . 1.0 111.393 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.445 ' HG ' ' C ' ' A' ' 110' ' ' SER . 4.6 m -159.44 -173.69 4.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.787 -0.365 . . . . 1.0 110.03 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.5 pp -171.51 144.32 1.9 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.521 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.55 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 4.9 ptm180 -135.8 164.04 28.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.4 0.619 . . . . 1.0 109.908 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.847 HH11 ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.48 150.02 21.08 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.008 -0.997 . . . . 1.0 109.171 178.329 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 44.6 t -82.95 83.59 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.189 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 2.0 mp . . . . . 0 N--CA 1.465 0.296 0 CA-C-N 116.104 -0.498 . . . . 1.0 109.978 179.263 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.616 0 N-CA-C 110.599 -1.0 . . . . 1.0 110.599 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -172.02 112.7 0.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 121.145 -0.222 . . . . 1.0 110.79 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.417 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -120.07 173.91 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.31 0 O-C-N 123.174 0.296 . . . . 1.0 111.057 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 29.4 m -131.36 120.62 23.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.299 -1.0 . . . . 1.0 108.299 177.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -105.12 132.64 51.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.898 -1.046 . . . . 1.0 110.027 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -114.89 129.4 56.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.241 -0.89 . . . . 1.0 111.354 -178.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.534 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 80.9 tt0 -55.45 -26.73 43.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.197 -0.911 . . . . 1.0 110.389 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -122.86 154.71 37.92 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.027 0.441 . . . . 1.0 110.209 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.5 ptp85 -58.32 -173.92 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.541 -0.754 . . . . 1.0 110.257 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.53 27.24 0.48 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.555 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.8 m-85 49.91 67.45 0.9 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.074 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -127.19 -160.16 0.98 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.991 0.424 . . . . 1.0 110.485 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.61 -149.08 0.75 Allowed Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.882 -0.887 . . . . 1.0 110.882 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.534 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 89.8 mtm-85 -72.49 149.8 43.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.682 0.277 . . . . 1.0 110.78 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -137.48 148.8 46.34 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.279 0.562 . . . . 1.0 110.35 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.525 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.9 t80 -141.86 142.18 33.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.924 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.525 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 77.0 tt0 -110.8 122.56 48.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.121 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.33 126.59 54.38 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.707 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.6 p -118.85 11.47 12.62 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.501 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.2 p -156.1 168.8 26.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.055 -0.52 . . . . 1.0 110.536 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -59.51 138.52 57.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.68 -0.691 . . . . 1.0 111.392 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.08 143.64 48.15 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.224 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 27.6 p -111.35 -18.59 12.87 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.793 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -148.14 110.07 4.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 1.0 110.405 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -108.11 1.0 21.98 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.179 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 47.1 mt-30 -53.34 -48.21 93.38 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.632 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 21.0 Cg_endo -56.86 -35.24 98.19 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.255 1.303 . . . . 1.0 112.881 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -91.36 -46.9 7.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.244 0.545 . . . . 1.0 110.945 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 mt -119.84 128.18 53.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.329 -0.851 . . . . 1.0 111.469 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -91.0 -15.54 29.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.351 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.456 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 59.7 ttm-85 -176.13 120.08 0.16 Allowed 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.706 -0.85 . . . . 1.0 108.706 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.7 t -99.53 109.91 22.4 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.348 -0.241 . . . . 1.0 110.348 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -103.37 -3.29 25.71 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.435 -0.348 . . . . 1.0 110.228 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.555 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.1 t -157.84 156.36 31.3 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.192 -0.299 . . . . 1.0 110.192 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.13 155.36 36.59 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.224 -0.444 . . . . 1.0 110.719 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.3 mtp85 -133.89 122.02 22.56 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.791 -0.818 . . . . 1.0 108.791 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.3 t -107.19 117.55 53.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.27 0.557 . . . . 1.0 110.333 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -78.77 -43.45 25.49 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.064 -0.971 . . . . 1.0 110.874 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.487 ' HG ' ' N ' ' A' ' 41' ' ' GLY . 35.8 t -162.96 162.02 25.9 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.424 -0.584 . . . . 1.0 109.424 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.487 ' N ' ' HG ' ' A' ' 40' ' ' SER . . . 78.67 177.17 48.7 Favored Glycine 0 C--N 1.315 -0.637 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.7 m -114.24 132.58 56.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.645 -0.502 . . . . 1.0 109.645 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.438 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 53.4 m95 -120.27 146.49 46.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.898 -0.592 . . . . 1.0 110.661 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.462 ' SD ' ' C ' ' A' ' 56' ' ' TYR . 22.0 tpp -120.49 131.18 54.6 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.549 -0.751 . . . . 1.0 109.212 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 10.4 mp -109.58 131.27 55.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.664 -0.698 . . . . 1.0 109.838 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -111.69 133.09 54.16 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.579 0.704 . . . . 1.0 111.687 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -57.65 -36.89 72.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.125 -0.943 . . . . 1.0 111.389 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.7 mt-30 -108.11 153.25 41.91 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.635 -178.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -63.6 159.43 40.88 Favored 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.458 2.106 . . . . 1.0 112.172 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.654 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.53 36.9 13.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.254 -0.884 . . . . 1.0 111.332 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 50.77 75.96 0.17 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.057 -0.974 . . . . 1.0 111.071 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.3 m -144.07 152.97 41.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.105 0.479 . . . . 1.0 110.244 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.84 -148.16 21.53 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.038 -0.601 . . . . 1.0 111.801 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.594 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.1 tp -75.49 143.58 42.49 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.038 -0.581 . . . . 1.0 110.262 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -120.84 150.79 40.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.482 0.182 . . . . 1.0 110.591 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 26.1 m-85 -124.99 124.12 41.32 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-O 120.841 0.353 . . . . 1.0 110.585 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -83.1 123.07 29.16 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.068 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.0 mp -119.37 144.07 47.08 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.415 -0.812 . . . . 1.0 110.03 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -132.4 158.91 40.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.121 -0.945 . . . . 1.0 110.141 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.7 ttp85 -37.09 125.32 0.94 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.997 -0.547 . . . . 1.0 110.763 -178.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.58 -179.97 32.01 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.53 -1.028 . . . . 1.0 110.53 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -114.14 136.23 53.16 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.897 0.379 . . . . 1.0 110.19 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.446 ' O ' ' OG ' ' A' ' 35' ' ' SER . 44.0 m-85 -130.37 112.9 13.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 1.0 109.616 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.83 -3.85 55.59 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.033 -0.531 . . . . 1.0 111.411 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.428 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 78.9 m-20 -147.6 135.7 21.36 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.13 -0.693 . . . . 1.0 109.13 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.581 ' H ' ' CD2' ' A' ' 66' ' ' HIS . 5.1 p80 -56.34 -41.06 75.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.045 0.45 . . . . 1.0 111.057 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -54.52 -6.96 0.13 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.785 -0.643 . . . . 1.0 110.617 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.496 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -82.89 -34.43 26.67 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.152 -0.619 . . . . 1.0 111.606 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . . . . . . . . . 2.3 p90 -94.51 15.68 17.3 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.743 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 70.2 mtp 76.18 27.89 0.85 Allowed 'General case' 0 C--O 1.224 -0.252 0 O-C-N 124.341 1.025 . . . . 1.0 109.679 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.851 0 C-N-CA 119.974 -1.108 . . . . 1.0 112.073 -179.125 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.454 -0.272 0 N-CA-C 109.212 -0.662 . . . . 1.0 109.212 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -122.2 13.42 10.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.247 -0.433 . . . . 1.0 110.829 -178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.4 p -163.63 162.8 24.43 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.171 0.51 . . . . 1.0 110.644 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -157.55 148.9 21.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.604 -0.726 . . . . 1.0 110.327 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.611 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 2.1 ptm180 -128.23 150.38 50.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.761 -0.459 . . . . 1.0 109.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.438 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt -101.43 124.14 46.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.088 -1.079 . . . . 1.0 108.088 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.418 ' N ' HD22 ' A' ' 81' ' ' LEU . 3.0 mt -85.65 115.75 62.83 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 109.796 -0.446 . . . . 1.0 109.796 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo . . . . . 0 N--CA 1.501 1.969 0 C-N-CA 122.34 2.027 . . . . 1.0 113.021 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.231 0.115 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -132.3 120.12 21.68 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.486 -0.325 . . . . 1.0 110.914 -179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -145.45 135.3 23.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.838 -0.345 . . . . 1.0 110.178 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.0 tt -148.27 144.86 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.047 -0.261 . . . . 1.0 110.582 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -124.42 99.92 6.43 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.563 0.54 . . . . 1.0 111.471 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.15 152.36 27.8 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.638 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -129.57 137.84 50.96 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.448 -0.796 . . . . 1.0 111.79 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.601 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -54.8 -56.85 14.87 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.362 -0.835 . . . . 1.0 110.978 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.601 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 78.0 mtp180 -105.57 173.87 6.12 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 110.107 -0.331 . . . . 1.0 110.107 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 . . . . . 0 CA--C 1.511 -0.537 0 CA-C-N 115.829 -0.623 . . . . 1.0 110.163 179.085 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.445 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.501 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 56.5 tp60 -68.62 145.48 53.89 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.461 0.648 . . . . 1.0 111.26 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.491 ' SD ' ' O ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 151.0 51.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 1.0 111.187 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.409 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 9.4 tt -145.15 139.16 22.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -112.38 143.72 43.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.381 0.61 . . . . 1.0 110.578 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.49 ' CD1' ' SG ' ' A' ' 109' ' ' CYS . 88.6 m-85 -129.18 154.81 46.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.514 -1.221 . . . . 1.0 110.522 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.0 p -143.79 9.61 1.55 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.329 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.934 ' O ' ' O ' ' A' ' 108' ' ' ASP . 8.1 pt-20 -160.25 78.33 0.65 Allowed 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 118.851 -0.595 . . . . 1.0 109.424 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.934 ' O ' ' O ' ' A' ' 107' ' ' GLU . 12.9 p-10 22.44 167.7 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 122.491 1.139 . . . . 1.0 113.278 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.49 ' SG ' ' CD1' ' A' ' 105' ' ' PHE . 9.8 m -146.95 106.42 3.92 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 120.342 -1.474 . . . . 1.0 109.548 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.427 ' O ' ' OG ' ' A' ' 166' ' ' SER . 80.9 p -67.46 -22.53 65.49 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.395 -0.522 . . . . 1.0 110.675 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 72.0 m -143.96 95.57 2.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.246 0.546 . . . . 1.0 110.554 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.532 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.1 tp -63.62 -44.54 93.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.416 -0.811 . . . . 1.0 110.373 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.434 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 98.0 mm-40 -47.2 -9.15 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.245 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.532 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.1 m-20 -96.8 -24.99 15.65 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.988 0.423 . . . . 1.0 110.381 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.0 mmt-85 -109.41 -36.69 5.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.849 -0.614 . . . . 1.0 111.682 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.409 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 3.7 t80 -125.53 120.67 31.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.146 0.498 . . . . 1.0 109.902 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -60.36 -60.06 4.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.488 -0.778 . . . . 1.0 110.942 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -40.39 137.84 1.01 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.803 -0.443 . . . . 1.0 109.803 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . 0.434 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 62.9 m-20 -101.94 2.38 37.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.097 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -135.13 137.88 43.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.227 0.537 . . . . 1.0 110.555 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.0 mm -120.99 122.2 67.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.025 178.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -112.31 21.85 15.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.413 -0.812 . . . . 1.0 111.046 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.499 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.8 p 169.29 153.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.064 0.459 . . . . 1.0 109.937 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -165.33 158.31 16.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.523 -0.762 . . . . 1.0 110.079 -178.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . 0.406 ' ND2' HD11 ' A' ' 127' ' ' LEU . 0.1 OUTLIER -125.09 119.08 27.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.361 -179.726 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.6 t -102.95 104.92 17.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 115.925 -0.58 . . . . 1.0 109.785 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.57 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.82 -41.14 30.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.516 -0.766 . . . . 1.0 111.315 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -140.59 147.11 38.91 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.511 -0.476 . . . . 1.0 110.745 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 60.51 -175.46 4.56 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.079 -0.809 . . . . 1.0 111.079 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.1 m -117.91 153.15 34.06 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.406 -0.59 . . . . 1.0 109.406 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -126.42 159.39 33.43 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.562 -0.744 . . . . 1.0 110.73 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.4 t -130.67 136.44 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.28 -0.637 . . . . 1.0 109.28 178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 37.3 mt -107.82 141.42 39.42 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 110.219 -0.289 . . . . 1.0 110.219 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -117.58 134.35 54.97 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.268 0.355 . . . . 1.0 110.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -45.74 -50.75 13.52 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.57 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.72 166.06 16.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.288 0.566 . . . . 1.0 110.279 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.1 m -68.6 177.04 2.62 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.101 -0.954 . . . . 1.0 110.936 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 12.2 m120 58.76 22.16 9.75 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.356 -1.293 . . . . 1.0 110.057 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 36.36 76.94 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.435 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -146.41 41.2 1.14 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.252 0.548 . . . . 1.0 110.166 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.52 -146.64 4.38 Favored Glycine 0 N--CA 1.462 0.386 0 N-CA-C 111.618 -0.593 . . . . 1.0 111.618 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 85.1 mtt85 -69.94 168.39 15.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.86 135.16 21.76 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 123.851 0.719 . . . . 1.0 110.89 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -127.25 137.92 52.98 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.5 126.23 36.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.937 0.399 . . . . 1.0 110.565 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 24.0 mt -114.93 102.73 10.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.522 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.611 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -81.62 161.92 59.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 116.374 -0.375 . . . . 1.0 110.708 -178.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.61 119.15 5.95 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 121.41 1.406 . . . . 1.0 111.522 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.73 -152.42 19.45 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.344 -1.102 . . . . 1.0 110.344 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -127.15 136.4 52.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.77 0.319 . . . . 1.0 110.352 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.513 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 27.6 m-85 -126.6 129.01 47.71 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.172 -0.467 . . . . 1.0 109.766 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -116.33 -3.1 11.97 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.882 0.373 . . . . 1.0 110.291 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.663 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -156.19 159.16 38.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.518 0.675 . . . . 1.0 110.191 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.468 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.8 p90 -74.68 -20.87 59.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.562 -1.199 . . . . 1.0 112.286 -177.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.663 ' NE2' HH21 ' A' ' 153' ' ' ARG . 50.1 mt-30 -68.44 -19.48 64.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.252 -0.431 . . . . 1.0 111.09 -179.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . 0.513 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 54.4 t0 -51.5 -50.13 60.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.101 -0.5 . . . . 1.0 110.914 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.468 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 14.4 p90 -94.43 21.5 7.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.041 0.448 . . . . 1.0 110.443 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.68 75.18 0.23 Allowed Glycine 0 CA--C 1.519 0.343 0 N-CA-C 111.148 -0.781 . . . . 1.0 111.148 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.429 ' CB ' ' HE1' ' A' ' 157' ' ' TRP . . . -117.82 147.91 42.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.124 0.488 . . . . 1.0 110.03 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 160' ' ' THR . . . . . 0.488 ' O ' ' ND2' ' A' ' 161' ' ' ASN . 15.1 t -76.49 -20.51 56.89 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.003 -0.998 . . . . 1.0 109.91 177.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 160' ' ' THR . 12.1 m120 -162.3 -171.04 2.66 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.5 -0.48 . . . . 1.0 110.497 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -108.82 -10.81 15.1 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.569 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -47.28 117.03 1.59 Allowed 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 120.614 0.245 . . . . 1.0 111.266 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 55.8 t -131.14 124.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.76 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -100.05 -24.62 9.58 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 111.464 -0.654 . . . . 1.0 111.464 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 110' ' ' SER . 6.0 m -159.82 -171.0 3.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.006 -0.368 . . . . 1.0 110.006 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 pp -172.54 142.17 1.22 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.945 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -132.93 162.66 31.04 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.861 -0.422 . . . . 1.0 109.861 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.437 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -95.49 154.3 17.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.542 -0.754 . . . . 1.0 109.63 178.522 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 49.4 t -88.25 88.62 2.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 O-C-N 122.105 -0.372 . . . . 1.0 111.944 -178.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.8 mp . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 121.137 0.494 . . . . 1.0 109.88 179.389 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.512 0 N-CA-C 110.818 -0.913 . . . . 1.0 110.818 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -173.78 98.92 0.11 Allowed 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.829 -0.348 . . . . 1.0 110.571 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.02 164.48 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-O 120.781 0.324 . . . . 1.0 110.487 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 32.9 m -124.17 119.94 30.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.919 -1.141 . . . . 1.0 107.919 177.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.0 mt -104.17 133.88 48.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.799 -1.091 . . . . 1.0 109.776 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -116.12 126.5 53.8 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.383 -0.826 . . . . 1.0 111.067 -178.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.532 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 79.2 tt0 -52.74 -33.63 49.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.657 -0.701 . . . . 1.0 110.289 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -113.35 161.29 17.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.245 0.545 . . . . 1.0 110.655 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ptt-85 -65.22 -175.94 0.26 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.271 -0.877 . . . . 1.0 110.673 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.61 26.29 1.04 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 110.662 -0.975 . . . . 1.0 110.662 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 50.53 70.05 0.56 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.346 -0.427 . . . . 1.0 110.102 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -133.43 -159.78 0.99 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.914 0.388 . . . . 1.0 110.319 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.28 -152.1 0.82 Allowed Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.731 -0.947 . . . . 1.0 110.731 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.532 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 91.1 mtm-85 -68.83 146.01 53.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.673 0.273 . . . . 1.0 110.998 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -136.64 153.79 50.82 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 121.223 0.535 . . . . 1.0 110.688 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 8.2 t80 -147.4 141.78 26.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.253 -0.885 . . . . 1.0 110.086 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.453 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.2 tt0 -110.21 124.72 52.1 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.571 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -114.42 126.53 55.08 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.337 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t -117.28 9.89 13.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.877 -0.601 . . . . 1.0 110.189 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.3 m -154.4 166.37 33.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.892 -0.594 . . . . 1.0 110.563 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -59.25 138.67 57.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.5 -0.773 . . . . 1.0 111.576 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.28 142.21 48.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.412 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.515 ' O ' ' OG ' ' A' ' 78' ' ' SER . 21.0 p -109.82 -10.07 14.78 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.66 -0.7 . . . . 1.0 112.274 -178.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -156.88 114.4 3.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.291 0.567 . . . . 1.0 110.09 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -116.93 1.26 12.63 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.512 -0.767 . . . . 1.0 110.75 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.6 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 4.4 mt-30 -52.93 -43.24 93.7 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.31 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.6 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 37.6 Cg_exo -58.62 -33.51 98.23 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.063 1.842 . . . . 1.0 111.616 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -95.5 -53.1 3.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 120.734 -0.386 . . . . 1.0 110.754 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 mt -116.81 127.61 54.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 1.0 110.804 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 t -94.74 -7.12 41.47 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.862 -0.608 . . . . 1.0 112.148 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.401 ' CD ' HD22 ' A' ' 34' ' ' ASN . 35.8 ttm180 -151.83 -55.29 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.229 0.455 . . . . 1.0 112.229 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.9 t 62.34 80.03 0.24 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 1.0 110.975 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.401 HD22 ' CD ' ' A' ' 32' ' ' ARG . 94.7 m-20 -94.64 3.44 55.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.733 -0.212 . . . . 1.0 111.551 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 p -157.33 159.09 37.14 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.839 -0.345 . . . . 1.0 110.419 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.15 155.24 33.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 1.0 111.512 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.452 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 26.4 mtp85 -134.89 124.48 25.08 Favored 'General case' 0 C--O 1.211 -0.96 0 N-CA-C 108.801 -0.815 . . . . 1.0 108.801 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.1 t -108.92 134.48 50.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.06 -0.719 . . . . 1.0 109.06 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.25 -43.39 8.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 1.0 110.241 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 p -159.58 156.52 28.16 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.735 -0.839 . . . . 1.0 108.735 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.46 174.18 50.21 Favored Glycine 0 C--N 1.316 -0.547 0 N-CA-C 110.959 -0.856 . . . . 1.0 110.959 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.6 m -111.74 142.55 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.415 -0.587 . . . . 1.0 109.415 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 54.6 m95 -131.06 150.47 52.13 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.45 0.643 . . . . 1.0 111.254 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.498 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 37.6 ttm -128.47 133.26 48.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.964 -1.016 . . . . 1.0 108.908 178.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.92 137.6 47.47 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -110.95 132.01 54.57 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.628 0.728 . . . . 1.0 110.277 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.585 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -59.36 -35.09 73.25 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.184 -0.916 . . . . 1.0 110.962 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.405 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.7 mt-30 -110.44 152.43 43.31 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.602 -178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -63.05 157.09 50.91 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.592 2.195 . . . . 1.0 113.133 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.628 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.8 OUTLIER 64.33 35.95 9.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.3 -0.864 . . . . 1.0 111.268 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 51.89 76.28 0.18 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.01 -0.996 . . . . 1.0 111.119 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.5 m -144.98 154.87 43.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.015 0.436 . . . . 1.0 109.976 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.88 -149.79 22.56 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.97 -0.633 . . . . 1.0 112.143 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.585 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.3 tp -75.24 142.74 43.34 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.023 -0.589 . . . . 1.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 2.9 pt20 -121.1 151.92 39.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -128.77 125.89 38.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.294 -0.412 . . . . 1.0 110.881 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -84.52 122.69 29.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.986 0.422 . . . . 1.0 110.471 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.6 mp -117.25 146.1 43.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.329 0.585 . . . . 1.0 110.06 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' C ' ' A' ' 60' ' ' ARG . 40.1 mtp180 -131.76 160.82 34.43 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.374 -0.83 . . . . 1.0 109.896 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.5 ttt180 -37.25 125.51 0.99 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.769 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.7 -178.42 33.14 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.508 -1.037 . . . . 1.0 110.508 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.452 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 70.9 m-20 -117.77 124.63 48.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.902 0.382 . . . . 1.0 110.533 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -117.26 113.27 21.93 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.196 -0.668 . . . . 1.0 109.196 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.413 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.91 -2.89 55.43 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.707 -179.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.413 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.4 m-20 -147.98 139.23 23.48 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.576 -0.898 . . . . 1.0 108.576 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.556 ' H ' ' HD1' ' A' ' 66' ' ' HIS . 12.2 p-80 -59.24 -43.52 92.39 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.599 -0.44 . . . . 1.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 98.7 mm-40 -50.77 -9.46 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.86 -0.609 . . . . 1.0 111.12 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.478 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.1 mm-40 -82.36 -35.57 27.66 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.265 -0.574 . . . . 1.0 111.15 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.431 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.53 17.79 7.02 Favored 'General case' 0 CA--C 1.507 -0.673 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.534 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 37.6 mtt 80.37 16.47 0.69 Allowed 'General case' 0 CA--C 1.521 -0.152 0 O-C-N 124.013 0.82 . . . . 1.0 109.94 -178.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.472 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . . . . . . 0 C--N 1.337 0.624 0 N-CA-C 110.576 -1.009 . . . . 1.0 110.576 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.52 -0.204 0 N-CA-C 109.301 -0.629 . . . . 1.0 109.301 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.404 ' O ' ' OG ' ' A' ' 78' ' ' SER . 85.7 mtm-85 -124.34 5.09 8.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.372 -0.376 . . . . 1.0 111.628 -178.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.515 ' OG ' ' O ' ' A' ' 24' ' ' THR . 30.7 m -165.06 162.23 20.21 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.238 0.542 . . . . 1.0 111.202 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.1 p -154.42 146.72 23.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.285 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.439 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 4.5 ptm180 -128.42 150.58 50.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.415 -0.357 . . . . 1.0 110.192 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.7 tp -99.58 134.57 42.28 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.046 -1.094 . . . . 1.0 108.046 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.4 mt -94.82 131.33 30.7 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.737 -0.468 . . . . 1.0 109.737 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 N--CA 1.498 1.759 0 C-N-CA 122.159 1.906 . . . . 1.0 113.158 -178.715 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.461 0.121 0 N-CA-C 109.869 -0.419 . . . . 1.0 109.869 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.591 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 8.2 m80 -134.09 119.79 19.36 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.52 -0.309 . . . . 1.0 111.013 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -142.24 134.01 27.0 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.617 -0.433 . . . . 1.0 110.398 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.5 tt -145.52 140.5 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.83 0.347 . . . . 1.0 110.769 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.546 ' NH2' ' SD ' ' A' ' 102' ' ' MET . 77.0 mtp85 -120.14 98.03 5.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.164 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -79.17 140.89 37.63 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.126 0.489 . . . . 1.0 110.998 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -118.21 134.9 54.61 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-N 115.359 -0.837 . . . . 1.0 111.141 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -55.18 -59.18 5.13 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.688 179.378 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.48 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.3 mtt85 -98.68 162.93 12.86 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.44 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.677 0.751 . . . . 1.0 111.017 178.075 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.413 0 N-CA-C 110.835 -0.906 . . . . 1.0 110.835 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.417 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 9.4 tp-100 -65.7 143.85 57.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 1.0 110.926 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.546 ' SD ' ' NH2' ' A' ' 91' ' ' ARG . 2.1 ptm -129.82 152.06 49.72 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.673 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.9 tt -144.38 140.81 24.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.504 -0.554 . . . . 1.0 109.504 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . 0.503 ' OE1' ' NH1' ' A' ' 91' ' ' ARG . 80.6 tt0 -115.04 146.81 40.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.637 0.732 . . . . 1.0 111.398 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -132.17 155.58 47.94 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 114.647 -1.16 . . . . 1.0 110.737 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.8 p -144.04 15.84 1.72 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.526 -0.761 . . . . 1.0 110.314 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.2 pm0 -151.54 -172.97 4.37 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.602 -0.439 . . . . 1.0 110.286 178.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 66.4 t0 -74.76 140.17 43.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.771 0.319 . . . . 1.0 110.865 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.518 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.9 m -133.71 91.38 2.83 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.56 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -64.68 -27.28 68.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.37 -0.377 . . . . 1.0 111.082 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.4 t -137.79 95.66 3.09 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.285 0.564 . . . . 1.0 110.429 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -60.62 -41.24 94.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.156 -0.929 . . . . 1.0 110.423 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.532 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 10.8 mp0 -47.83 -13.37 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.895 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.445 ' H ' ' C ' ' A' ' 112' ' ' LEU . 82.3 m-20 -91.46 1.41 57.15 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.767 0.794 . . . . 1.0 109.714 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.1 mmt-85 -131.02 -40.11 1.18 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.09 -1.413 . . . . 1.0 113.613 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.654 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.61 137.29 54.39 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 122.29 1.043 . . . . 1.0 111.471 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 118' ' ' PHE . 29.4 mmt180 -69.83 -69.19 0.36 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 121.47 -0.768 . . . . 1.0 111.137 -177.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.601 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 81.3 m-85 -37.86 145.73 0.07 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.313 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -104.21 9.18 36.22 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.77 0.319 . . . . 1.0 111.028 -178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -138.49 140.22 39.11 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.147 0.498 . . . . 1.0 111.204 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.402 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 36.8 mm -120.96 124.04 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 115.33 -0.85 . . . . 1.0 109.25 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -112.8 21.26 15.7 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.733 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.5 p 169.77 153.7 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.067 0.461 . . . . 1.0 109.959 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.5 pp -164.2 158.21 18.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.568 -178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.25 115.11 19.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.659 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.5 t -98.72 104.84 16.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 109.458 -0.571 . . . . 1.0 109.458 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.513 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.86 -39.59 42.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 1.0 111.262 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -146.65 148.83 32.46 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.848 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 66.47 175.13 6.35 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.772 -0.931 . . . . 1.0 110.772 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 m -116.83 150.54 38.21 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.058 -0.719 . . . . 1.0 109.058 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.416 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 43.8 m95 -124.09 167.38 14.3 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.638 -178.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 39.9 t -138.42 105.63 3.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.558 -0.292 . . . . 1.0 110.331 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 13.3 mt -78.62 142.78 36.97 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.068 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -121.55 136.69 54.93 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.711 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -47.88 -46.8 31.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.519 -0.309 . . . . 1.0 110.412 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -127.8 165.27 20.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.421 0.629 . . . . 1.0 110.343 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 55.6 m -69.92 -179.11 1.74 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.96 -1.018 . . . . 1.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . 0.433 ' CB ' HH21 ' A' ' 140' ' ' ARG . 15.4 m120 55.92 19.6 3.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.555 -1.202 . . . . 1.0 109.466 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.569 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 17.4 m-85 37.67 77.22 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.593 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.433 HH21 ' CB ' ' A' ' 138' ' ' ASN . 76.9 mtm180 -145.22 41.98 1.28 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.029 0.442 . . . . 1.0 110.637 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -154.5 -145.78 4.25 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 111.397 -0.681 . . . . 1.0 111.397 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.28 164.31 25.95 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.835 -0.432 . . . . 1.0 109.835 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.534 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.43 137.47 30.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.395 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -129.9 139.74 51.08 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.086 -0.709 . . . . 1.0 109.086 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 tp -93.18 125.76 37.94 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.494 0.664 . . . . 1.0 111.959 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.563 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.4 mm? -112.42 98.39 7.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.751 -1.113 . . . . 1.0 108.758 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.516 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -75.8 164.18 62.19 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 109.9 -0.407 . . . . 1.0 109.9 -179.203 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -58.68 118.62 5.53 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 C-N-CA 120.665 0.91 . . . . 1.0 110.445 178.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 171.7 -155.58 24.28 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.59 -1.004 . . . . 1.0 110.59 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -125.56 135.07 51.84 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.805 0.336 . . . . 1.0 110.766 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.487 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.8 m-85 -125.26 130.56 52.3 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.161 -0.472 . . . . 1.0 109.849 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -115.81 -2.74 12.31 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.828 0.347 . . . . 1.0 110.087 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -156.78 159.91 38.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.579 0.704 . . . . 1.0 110.088 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.4 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 7.7 p90 -73.68 -19.85 60.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.639 -1.164 . . . . 1.0 112.201 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.32 -19.6 63.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.368 -0.378 . . . . 1.0 111.402 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -51.33 -47.82 62.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.944 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.4 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 27.2 p90 -95.82 22.67 7.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.954 0.406 . . . . 1.0 110.654 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.56 74.4 0.29 Allowed Glycine 0 CA--C 1.52 0.384 0 N-CA-C 111.248 -0.741 . . . . 1.0 111.248 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -119.06 148.31 43.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.525 0.678 . . . . 1.0 111.018 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 160' ' ' THR . . . . . 0.496 ' O ' ' ND2' ' A' ' 161' ' ' ASN . 0.0 OUTLIER -75.77 -25.67 56.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.277 -1.329 . . . . 1.0 109.874 177.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.496 ' ND2' ' O ' ' A' ' 160' ' ' THR . 13.8 m120 -158.15 -171.19 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.042 0.449 . . . . 1.0 110.508 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 121' ' ' ILE . . . -107.59 -18.17 13.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.693 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -37.71 118.88 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.85 0.357 . . . . 1.0 111.866 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 18.9 t -122.36 159.38 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 115.858 -0.61 . . . . 1.0 109.65 178.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.406 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -136.72 -34.88 0.21 Allowed Glycine 0 N--CA 1.462 0.4 0 N-CA-C 111.207 -0.757 . . . . 1.0 111.207 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.4 p -158.11 -174.06 4.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.847 0.356 . . . . 1.0 110.109 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -169.53 137.56 1.81 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.143 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.569 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 12.4 ptp180 -133.17 154.45 50.61 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.591 ' NH1' ' ND1' ' A' ' 88' ' ' HIS . 0.0 OUTLIER -84.84 152.35 23.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.962 -0.563 . . . . 1.0 109.653 178.428 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 47.3 t -88.01 83.13 2.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.262 -0.426 . . . . 1.0 111.559 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.0 mp . . . . . 0 N--CA 1.465 0.303 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.336 179.014 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 110.602 -0.999 . . . . 1.0 110.602 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -169.67 138.63 1.89 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.29 -0.263 . . . . 1.0 110.29 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.437 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -147.03 168.77 4.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.337 -0.392 . . . . 1.0 110.786 179.474 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.1 m -128.39 120.67 27.41 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.325 -0.991 . . . . 1.0 108.325 175.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.25 132.77 50.15 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.318 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -115.35 125.9 53.77 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.331 -0.849 . . . . 1.0 110.883 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -53.96 -27.37 30.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.613 -0.721 . . . . 1.0 110.633 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -119.48 154.57 33.58 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.119 0.485 . . . . 1.0 110.142 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 12' ' ' PHE . 32.4 ptt85 -59.39 -172.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.515 -0.766 . . . . 1.0 110.266 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.65 25.49 0.2 Allowed Glycine 0 N--CA 1.461 0.304 0 N-CA-C 111.008 -0.837 . . . . 1.0 111.008 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 7.8 m-85 51.69 69.01 0.71 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.062 -0.348 . . . . 1.0 110.062 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -131.17 -158.83 0.92 Allowed 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.008 0.432 . . . . 1.0 110.635 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.57 -151.96 0.43 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.875 -0.89 . . . . 1.0 110.875 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -68.97 146.81 52.43 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.961 -0.296 . . . . 1.0 110.621 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -136.48 150.29 48.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.221 0.534 . . . . 1.0 110.196 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -143.78 142.09 30.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.396 -0.82 . . . . 1.0 110.089 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.7 tt0 -110.48 122.18 47.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.958 -0.564 . . . . 1.0 110.313 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.22 127.91 55.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.456 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 79.4 p -118.66 12.99 13.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.407 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 54.9 m -158.63 172.71 17.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.543 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 46.8 p-10 -62.3 137.49 58.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.572 -0.74 . . . . 1.0 111.279 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.82 149.17 52.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.783 -0.644 . . . . 1.0 110.093 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 p -119.46 -18.4 8.51 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.26 -0.882 . . . . 1.0 112.196 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -143.54 109.52 5.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.994 0.426 . . . . 1.0 110.074 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.406 ' O ' ' N ' ' A' ' 30' ' ' LEU . 19.8 mt -116.17 -5.57 11.88 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.735 -0.666 . . . . 1.0 110.421 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.59 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -45.33 -52.45 21.69 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.889 -0.596 . . . . 1.0 109.92 178.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.3 Cg_endo -54.19 -30.29 60.54 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 C-N-CA 121.97 1.78 . . . . 1.0 111.767 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.529 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -96.27 -55.14 3.04 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.843 0.354 . . . . 1.0 110.273 -178.832 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.4 mt -117.4 125.28 50.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.867 -0.606 . . . . 1.0 110.274 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -93.59 -9.77 36.97 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.825 -0.625 . . . . 1.0 111.752 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.446 ' CD ' HD22 ' A' ' 34' ' ' ASN . 43.5 ttm180 -147.32 -63.71 0.28 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.737 -178.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 51.8 t 71.01 83.61 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.31 0.381 . . . . 1.0 110.06 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.446 HD22 ' CD ' ' A' ' 32' ' ' ARG . 92.1 m-20 -97.29 5.74 49.47 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.945 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.553 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 2.0 t -160.32 158.05 29.07 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.67 -0.412 . . . . 1.0 109.978 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.99 155.37 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.048 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.437 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.6 mtp85 -133.54 121.66 22.44 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 108.506 -0.924 . . . . 1.0 108.506 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -107.51 117.78 53.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.397 0.618 . . . . 1.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -77.24 -43.64 32.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.91 -1.041 . . . . 1.0 110.508 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.4 t -163.38 162.89 25.16 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.31 176.33 48.58 Favored Glycine 0 C--N 1.317 -0.508 0 N-CA-C 110.982 -0.847 . . . . 1.0 110.982 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.4 m -112.09 126.29 55.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.571 -0.529 . . . . 1.0 109.571 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.452 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 50.8 m95 -115.31 149.28 38.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.856 -0.611 . . . . 1.0 111.091 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 2.1 ttt -128.46 133.27 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.408 -0.814 . . . . 1.0 109.592 178.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.417 ' CD2' ' N ' ' A' ' 45' ' ' LEU . 0.2 OUTLIER -110.84 140.33 45.38 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.761 -178.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.713 ' HH ' HH11 ' A' ' 80' ' ' ARG . 27.5 m-85 -113.48 132.38 55.68 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.269 0.556 . . . . 1.0 110.898 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.516 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.2 pt-20 -60.34 -36.19 77.41 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.539 -0.755 . . . . 1.0 110.263 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -100.87 151.53 37.63 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.286 -0.87 . . . . 1.0 110.038 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.485 ' C ' HD21 ' A' ' 50' ' ' ASN . 18.6 Cg_endo -55.32 149.77 44.44 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 121.792 1.662 . . . . 1.0 110.689 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.737 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.5 OUTLIER 71.24 -116.88 0.08 Allowed 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.572 -0.899 . . . . 1.0 108.572 -177.874 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -151.74 70.92 0.96 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.778 -0.646 . . . . 1.0 109.884 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -138.08 15.4 2.84 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.82 0.343 . . . . 1.0 110.903 -178.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.8 -176.66 14.5 Favored Glycine 0 C--N 1.321 -0.285 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.516 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.5 tp -51.75 150.0 4.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -123.87 153.39 41.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.911 0.386 . . . . 1.0 110.877 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -132.46 125.9 31.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.159 178.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -83.9 124.02 30.55 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.255 -0.429 . . . . 1.0 110.414 -179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 mp -121.15 146.86 46.32 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.351 0.596 . . . . 1.0 110.383 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.402 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtp180 -132.67 160.41 36.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.108 -0.951 . . . . 1.0 110.562 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 59' ' ' ARG . 79.6 ttt-85 -38.47 125.04 1.34 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.617 -0.719 . . . . 1.0 110.441 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.59 -179.73 32.2 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.382 -1.087 . . . . 1.0 110.382 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -114.63 131.8 56.59 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.866 0.365 . . . . 1.0 110.297 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.426 ' O ' ' OG ' ' A' ' 35' ' ' SER . 41.3 m-85 -125.11 113.34 17.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.049 -0.523 . . . . 1.0 109.851 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.32 -4.18 56.09 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.416 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 72.1 m-20 -147.43 141.99 26.53 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.529 ' C ' ' H ' ' A' ' 68' ' ' GLN . 15.5 p-80 -62.12 -41.75 98.55 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.466 . . . . 1.0 111.215 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -53.73 -6.51 0.08 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.702 -0.681 . . . . 1.0 110.363 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.529 ' H ' ' C ' ' A' ' 66' ' ' HIS . 19.4 mm-40 -83.66 -34.86 24.92 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.613 -0.435 . . . . 1.0 111.354 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.489 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -94.13 18.21 11.19 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.668 -0.413 . . . . 1.0 110.901 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.626 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 4.2 mtt 80.03 17.23 0.72 Allowed 'General case' 0 C--N 1.338 0.096 0 O-C-N 123.593 0.558 . . . . 1.0 110.774 -178.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.855 0 N-CA-C 110.097 -1.201 . . . . 1.0 110.097 178.878 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -115.65 4.2 14.06 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 120.667 0.27 . . . . 1.0 111.514 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.7 p -162.84 160.93 25.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.058 0.456 . . . . 1.0 110.584 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.77 148.29 22.43 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.577 -0.738 . . . . 1.0 110.605 -178.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.713 HH11 ' HH ' ' A' ' 46' ' ' TYR . 5.5 ptm180 -128.18 150.03 50.18 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 110.027 -0.361 . . . . 1.0 110.027 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.452 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.6 tt -101.8 124.27 47.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.887 -0.783 . . . . 1.0 108.887 178.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.445 HG23 HD12 ' A' ' 82' ' ' ILE . 6.4 mt -85.34 116.09 64.07 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 115.99 -0.55 . . . . 1.0 109.974 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo . . . . . 0 N--CA 1.498 1.761 0 C-N-CA 122.364 2.043 . . . . 1.0 113.107 179.882 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 CA--C 1.52 -0.199 0 N-CA-C 109.712 -0.477 . . . . 1.0 109.712 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -134.91 120.01 18.74 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 121.116 -0.233 . . . . 1.0 110.932 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -146.55 133.57 20.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.3 tt -147.2 150.53 14.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.605 -0.271 . . . . 1.0 110.494 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -126.5 98.11 5.29 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.947 -0.57 . . . . 1.0 111.697 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.11 129.81 38.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.537 . . . . 1.0 110.136 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.571 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 46.1 m-85 -107.68 136.53 47.28 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.363 -0.835 . . . . 1.0 110.944 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.528 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.91 -69.45 0.16 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.832 -0.622 . . . . 1.0 111.761 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 33.2 mtt-85 -96.85 176.44 5.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.744 -0.662 . . . . 1.0 110.892 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.443 ' OE1' ' N ' ' A' ' 96' ' ' GLU . 59.1 mp0 . . . . . 0 CA--C 1.509 -0.598 0 CA-C-N 115.391 -0.822 . . . . 1.0 109.445 179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -58.42 148.58 27.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.037 -0.357 . . . . 1.0 110.037 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.571 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 7.9 ttp -131.63 152.42 50.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.995 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.458 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.1 tt -146.92 141.67 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.171 -0.678 . . . . 1.0 109.171 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -111.29 141.55 44.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.406 0.622 . . . . 1.0 110.466 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -129.42 153.53 47.84 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 114.714 -1.13 . . . . 1.0 110.42 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -141.66 29.9 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.641 -0.708 . . . . 1.0 110.738 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -170.94 -167.81 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.461 -0.495 . . . . 1.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.438 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 55.3 p-10 -76.83 144.83 38.82 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.69 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 6.2 m -135.02 89.43 2.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.997 -0.547 . . . . 1.0 109.779 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.1 m -64.46 -36.35 83.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.834 0.349 . . . . 1.0 111.454 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.0 m -131.65 84.96 2.21 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.426 0.631 . . . . 1.0 110.323 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.597 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.4 tp -59.27 -38.95 81.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.097 -0.956 . . . . 1.0 110.019 -178.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.561 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 22.1 mp0 -43.45 -9.64 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.281 -0.418 . . . . 1.0 111.511 178.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.597 ' H ' ' C ' ' A' ' 112' ' ' LEU . 87.2 m-20 -93.89 -21.94 18.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.982 0.42 . . . . 1.0 110.86 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.4 mmt180 -110.11 -38.65 5.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.974 -0.557 . . . . 1.0 112.383 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.729 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -118.95 137.28 53.6 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.756 1.265 . . . . 1.0 111.142 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 118' ' ' PHE . 84.5 mmt-85 -73.78 -74.32 0.19 Allowed 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.275 -1.516 . . . . 1.0 110.364 -178.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.686 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 91.5 m-85 -31.53 143.65 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 123.499 0.499 . . . . 1.0 110.598 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -104.73 11.69 33.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 1.0 110.726 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -140.0 139.38 36.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.237 0.541 . . . . 1.0 110.902 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.4 mm -120.41 123.46 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.369 -0.832 . . . . 1.0 109.51 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.447 ' O ' ' CB ' ' A' ' 123' ' ' SER . 20.4 m-70 -110.8 22.25 15.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.516 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 0.5 OUTLIER 165.2 157.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.921 -0.312 . . . . 1.0 110.479 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.551 ' CD2' ' CD1' ' A' ' 151' ' ' TYR . 0.0 OUTLIER -158.91 164.01 36.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.184 179.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -130.46 103.4 6.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.284 -0.636 . . . . 1.0 109.284 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . 0.466 HG11 ' H ' ' A' ' 149' ' ' GLY . 0.6 OUTLIER -101.4 110.42 28.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.7 -0.852 . . . . 1.0 108.7 179.234 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.62 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -81.66 -39.22 24.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.419 -0.809 . . . . 1.0 111.249 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.484 ' O ' ' O ' ' A' ' 129' ' ' GLY . 43.6 mm-40 -121.53 160.34 24.46 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.372 0.606 . . . . 1.0 111.039 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 34.62 -159.4 0.01 OUTLIER Glycine 0 CA--C 1.53 1.016 0 CA-C-N 114.191 -1.368 . . . . 1.0 110.993 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.555 ' HG ' ' H ' ' A' ' 131' ' ' TRP . 1.7 t -120.26 -175.93 3.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.994 0.426 . . . . 1.0 109.891 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.555 ' H ' ' HG ' ' A' ' 130' ' ' SER . 75.0 m95 -150.71 168.97 22.75 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.269 -178.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 57.5 t -137.42 131.44 44.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.534 -0.543 . . . . 1.0 109.534 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.07 143.0 33.86 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 110.205 -0.295 . . . . 1.0 110.205 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . 0.526 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 14.2 m-85 -119.17 133.22 55.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.445 -0.343 . . . . 1.0 110.088 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.421 ' OE2' ' O ' ' A' ' 135' ' ' GLU . 4.3 tm-20 -50.89 -29.86 13.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.088 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.416 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -139.79 176.7 8.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.119 0.485 . . . . 1.0 110.107 -179.523 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.2 m -82.8 171.76 13.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.329 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 10.1 m120 64.78 18.33 11.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.114 -0.948 . . . . 1.0 110.247 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.455 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 3.2 m-85 37.39 79.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.663 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 50.4 ttm-85 -148.55 37.51 0.83 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.968 0.414 . . . . 1.0 110.422 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -149.36 -144.33 3.93 Favored Glycine 0 CA--C 1.521 0.442 0 N-CA-C 111.333 -0.707 . . . . 1.0 111.333 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -73.01 159.06 34.25 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.077 -0.342 . . . . 1.0 110.077 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.626 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 88.6 mt-30 -138.81 134.6 33.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.007 -0.542 . . . . 1.0 111.047 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -129.65 140.72 51.08 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.291 -0.633 . . . . 1.0 109.291 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 tp -95.95 128.37 42.78 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.725 0.641 . . . . 1.0 110.588 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.591 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -113.45 96.92 6.14 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.971 -1.013 . . . . 1.0 109.764 179.73 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.592 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.6 OUTLIER -68.89 154.57 94.77 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 114.89 -1.05 . . . . 1.0 110.235 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.55 112.97 1.25 Allowed 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.233 1.955 . . . . 1.0 111.372 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . 0.466 ' H ' HG11 ' A' ' 126' ' ' VAL . . . 176.06 -150.83 10.98 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.421 -1.072 . . . . 1.0 110.421 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -128.66 125.76 38.74 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.298 -0.451 . . . . 1.0 111.175 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.551 ' CD1' ' CD2' ' A' ' 124' ' ' LEU . 3.8 m-85 -117.66 128.38 54.86 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.315 -0.624 . . . . 1.0 109.315 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -107.47 -5.22 17.76 Favored 'General case' 0 CA--C 1.518 -0.25 0 O-C-N 123.685 0.616 . . . . 1.0 110.797 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -154.13 172.22 17.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.688 -0.687 . . . . 1.0 110.545 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.45 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 26.6 p90 -85.21 -21.82 28.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.097 -0.956 . . . . 1.0 112.495 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -64.53 -23.29 67.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.006 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . 0.505 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.3 t0 -44.2 -54.33 5.74 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.946 0.403 . . . . 1.0 111.068 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.45 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 28.7 p90 -92.67 24.13 3.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.753 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 50.39 75.23 0.22 Allowed Glycine 0 CA--C 1.52 0.383 0 N-CA-C 111.217 -0.753 . . . . 1.0 111.217 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -119.65 145.67 46.26 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.884 -0.413 . . . . 1.0 109.884 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.7 t -76.23 -10.73 59.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.92 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.531 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 30.2 t-20 -171.95 -164.53 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.449 -0.5 . . . . 1.0 110.156 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.531 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -112.13 -16.42 13.03 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 116.37 -0.377 . . . . 1.0 110.328 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.437 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.7 mtt180 -30.12 116.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.285 0.365 . . . . 1.0 111.751 -178.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . 0.45 ' CG1' ' N ' ' A' ' 165' ' ' GLY . 57.6 t -126.43 162.9 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.135 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.476 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -146.07 -34.85 0.06 OUTLIER Glycine 0 CA--C 1.516 0.133 0 N-CA-C 111.604 -0.598 . . . . 1.0 111.604 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 11.6 p -160.19 173.0 16.4 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 120.932 0.396 . . . . 1.0 110.753 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -158.59 154.19 26.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 1.0 112.186 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.526 ' NE ' ' OH ' ' A' ' 134' ' ' TYR . 17.0 ptp180 -145.35 153.49 41.29 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.409 -0.517 . . . . 1.0 110.441 178.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.04 149.14 28.25 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.43 -0.581 . . . . 1.0 109.43 177.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 170' ' ' VAL . 25.9 m -81.73 78.12 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.373 0.606 . . . . 1.0 112.416 -178.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.9 mp . . . . . 0 C--N 1.329 -0.285 0 O-C-N 121.834 -0.541 . . . . 1.0 110.181 179.175 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.541 0 N-CA-C 110.456 -1.057 . . . . 1.0 110.456 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . 0.569 ' NZ ' ' OE2' ' A' ' 18' ' ' GLU . 59.5 tttm -173.18 102.16 0.13 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.534 0.206 . . . . 1.0 110.66 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.6 169.87 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.853 -178.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 26.6 m -129.37 123.27 31.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.41 -0.959 . . . . 1.0 108.41 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.6 mt -107.83 133.09 52.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.941 -1.027 . . . . 1.0 110.184 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -115.36 126.22 54.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.346 -0.843 . . . . 1.0 111.111 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -52.9 -32.96 48.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.626 -0.715 . . . . 1.0 110.664 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -115.42 150.0 37.11 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.304 0.574 . . . . 1.0 110.481 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' C ' ' N ' ' A' ' 12' ' ' PHE . 20.1 ptt-85 -54.93 -173.32 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.613 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.32 23.22 0.26 Allowed Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.427 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.3 m-85 52.78 68.24 0.86 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.482 -0.359 . . . . 1.0 110.287 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -130.41 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.0 0.429 . . . . 1.0 110.516 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.82 -150.76 0.25 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.943 -0.863 . . . . 1.0 110.943 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -69.71 146.9 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.804 0.335 . . . . 1.0 110.622 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -136.26 144.14 44.64 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.279 0.561 . . . . 1.0 110.433 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.556 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.2 t80 -137.81 141.52 40.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.309 -0.86 . . . . 1.0 109.893 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.569 ' OE2' ' NZ ' ' A' ' 3' ' ' LYS . 17.2 tt0 -111.22 122.17 47.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.368 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.8 126.3 53.64 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.627 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -117.99 13.33 13.92 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.745 -0.662 . . . . 1.0 110.377 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.0 m -158.21 168.18 27.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.647 -178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.34 140.64 53.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.534 -0.757 . . . . 1.0 111.211 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.88 153.1 49.59 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.534 -0.757 . . . . 1.0 110.601 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.7 p -120.88 -11.46 8.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.437 -0.801 . . . . 1.0 112.4 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.15 116.44 5.72 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.42 0.629 . . . . 1.0 110.897 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.426 ' O ' ' N ' ' A' ' 30' ' ' LEU . 6.5 mp -110.4 -3.11 16.29 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.483 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.559 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 35.8 mt-30 -52.95 -51.23 76.52 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.948 -0.301 . . . . 1.0 110.597 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 17.1 Cg_endo -54.76 -35.93 89.23 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 121.274 1.316 . . . . 1.0 112.292 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -94.81 -51.31 4.75 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 120.177 -0.609 . . . . 1.0 111.001 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.426 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.2 mt -118.19 127.61 53.91 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.618 -0.719 . . . . 1.0 110.824 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.3 t -94.24 -10.41 33.03 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.76 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -145.7 -58.79 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.749 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 41.0 t 62.58 80.73 0.22 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -96.57 4.78 51.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.573 -0.285 . . . . 1.0 111.245 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.6 p -155.88 157.6 36.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.864 0.364 . . . . 1.0 110.368 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.71 154.71 34.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.967 -178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -134.79 123.32 23.4 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.732 -0.84 . . . . 1.0 108.732 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.4 t -108.75 133.5 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -96.74 -41.48 8.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.367 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.8 p -160.85 157.28 26.4 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.99 176.28 49.38 Favored Glycine 0 C--N 1.315 -0.583 0 N-CA-C 110.924 -0.87 . . . . 1.0 110.924 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.9 m -112.55 147.19 37.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 51.8 m95 -132.46 151.28 51.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 1.0 110.776 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.45 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 13.9 tpp -124.19 129.01 50.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.133 -1.062 . . . . 1.0 108.133 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 10.4 mp -109.81 131.46 55.04 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.101 -0.499 . . . . 1.0 109.858 -179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -109.19 129.52 55.49 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.899 0.38 . . . . 1.0 111.927 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.46 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 19.7 pt-20 -53.61 -32.32 50.68 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.418 -0.81 . . . . 1.0 111.097 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.68 ' CG ' ' H ' ' A' ' 53' ' ' GLY . 9.7 pt20 -113.83 156.72 43.4 Favored Pre-proline 0 CA--C 1.514 -0.404 0 N-CA-C 109.442 -0.577 . . . . 1.0 109.442 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -56.39 147.39 68.28 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 121.127 1.218 . . . . 1.0 111.968 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.806 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.3 OUTLIER 82.88 -124.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.279 -1.328 . . . . 1.0 109.588 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.3 m-85 -150.12 75.05 1.23 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.052 179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -134.78 -56.52 0.83 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 112.455 0.539 . . . . 1.0 112.455 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.68 ' H ' ' CG ' ' A' ' 48' ' ' GLN . . . -61.97 -163.05 0.26 Allowed Glycine 0 C--N 1.314 -0.677 0 C-N-CA 120.07 -1.062 . . . . 1.0 111.305 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.46 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.7 tp -59.02 147.61 33.94 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.908 -0.646 . . . . 1.0 110.143 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -121.34 149.8 42.4 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.994 0.184 . . . . 1.0 110.864 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.45 ' O ' ' SD ' ' A' ' 44' ' ' MET . 22.0 m-85 -126.51 127.1 44.81 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.151 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -81.71 121.63 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.558 0.694 . . . . 1.0 109.692 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -111.87 132.57 54.63 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 114.769 -1.105 . . . . 1.0 109.77 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.7 ttp180 -127.96 156.03 43.32 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.287 -0.869 . . . . 1.0 109.746 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' A' ' 59' ' ' ARG . 36.9 ptt180 -37.35 126.87 1.05 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.763 -0.653 . . . . 1.0 111.454 -178.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.9 -178.3 30.09 Favored Glycine 0 CA--C 1.521 0.459 0 N-CA-C 111.166 -0.773 . . . . 1.0 111.166 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.0 p-10 -116.43 127.48 54.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.094 0.474 . . . . 1.0 110.335 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -121.47 113.27 19.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.272 -0.64 . . . . 1.0 109.272 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.432 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.49 -4.6 53.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.381 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 81.9 m-20 -147.89 133.53 18.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.137 -0.69 . . . . 1.0 109.137 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.519 ' C ' ' H ' ' A' ' 68' ' ' GLN . 4.5 p80 -56.17 -40.97 74.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 1.0 111.127 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -51.93 -8.36 0.07 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.537 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.519 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.2 mm-40 -84.39 -32.93 23.91 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.838 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -96.57 17.94 15.22 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 121.021 -0.272 . . . . 1.0 111.43 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.432 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 41.1 mtt 82.9 9.86 0.62 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 123.941 0.775 . . . . 1.0 109.815 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.406 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.343 0.964 0 C-N-CA 120.306 -0.949 . . . . 1.0 111.218 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 120.671 0.272 . . . . 1.0 111.044 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 26' ' ' LEU . 89.8 mtm180 -110.68 9.43 22.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.271 -0.422 . . . . 1.0 110.692 -177.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.4 p -160.46 159.27 30.67 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.497 0.665 . . . . 1.0 110.968 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.9 p -154.66 146.49 23.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.081 -0.963 . . . . 1.0 110.356 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -127.67 146.4 50.57 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.795 0.331 . . . . 1.0 110.108 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.9 tp -94.44 126.76 39.91 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.451 -0.944 . . . . 1.0 108.451 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.429 HD12 HG23 ' A' ' 82' ' ' ILE . 2.6 mt -91.32 114.94 63.35 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 109.222 -0.658 . . . . 1.0 109.222 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 N--CA 1.499 1.824 0 C-N-CA 122.087 1.858 . . . . 1.0 113.479 -179.837 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 CA--C 1.523 -0.076 0 CA-C-O 120.903 0.382 . . . . 1.0 110.157 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -137.26 112.2 8.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.803 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -140.18 135.02 31.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.699 0.285 . . . . 1.0 110.27 178.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.9 tt -148.93 145.76 17.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.929 -0.309 . . . . 1.0 110.813 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -126.14 97.37 5.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.73 -0.668 . . . . 1.0 111.352 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.95 142.57 39.98 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.166 0.508 . . . . 1.0 111.187 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -117.59 134.8 54.48 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.367 -0.833 . . . . 1.0 110.86 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.437 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.2 tm-20 -53.45 -61.79 2.07 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.568 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.442 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.4 mtp85 -100.33 170.48 8.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.364 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.713 -0.676 . . . . 1.0 110.43 179.067 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.689 0 N-CA-C 111.083 -0.807 . . . . 1.0 111.083 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.78 145.11 53.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.815 0.34 . . . . 1.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.2 ptm -131.41 157.24 43.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.262 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.7 tt -148.98 142.85 18.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 109.989 -0.374 . . . . 1.0 109.989 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -113.62 142.41 46.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.447 0.642 . . . . 1.0 110.84 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -129.5 156.66 43.78 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 114.556 -1.202 . . . . 1.0 110.331 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.6 p -143.61 26.06 1.61 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.586 -0.734 . . . . 1.0 110.636 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -167.74 -166.82 0.78 Allowed 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.627 -0.429 . . . . 1.0 110.37 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 54.2 p-10 -77.11 143.92 38.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.792 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.2 m -133.16 92.85 3.08 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.949 -0.569 . . . . 1.0 109.793 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.473 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.0 OUTLIER -67.2 -27.69 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.469 -0.332 . . . . 1.0 111.323 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 13.6 m -136.84 96.45 3.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.25 0.548 . . . . 1.0 110.863 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.542 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.4 tp -64.58 -44.25 91.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.346 -0.843 . . . . 1.0 110.44 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -47.87 -7.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.348 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.542 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.7 m-20 -96.21 -25.45 15.81 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.061 0.458 . . . . 1.0 110.318 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.417 ' N ' ' O ' ' A' ' 112' ' ' LEU . 25.7 mmt85 -108.78 -35.41 6.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.648 -0.705 . . . . 1.0 111.463 -179.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -126.12 121.09 31.86 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.001 0.429 . . . . 1.0 109.898 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.3 mtt-85 -60.11 -65.92 0.6 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.225 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.437 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 94.0 m-85 -39.5 142.35 0.29 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -104.18 2.85 32.27 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.715 0.293 . . . . 1.0 111.345 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -131.72 137.4 48.23 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.241 0.543 . . . . 1.0 111.221 -178.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.5 mm -122.75 126.08 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.101 -0.954 . . . . 1.0 109.502 178.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 23.3 m-70 -113.64 18.13 17.74 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.105 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.0 p 173.84 153.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.987 0.422 . . . . 1.0 110.288 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 pp -162.75 156.71 20.68 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.443 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.96 108.74 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.88 -0.6 . . . . 1.0 109.846 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -102.84 110.9 30.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.773 -0.825 . . . . 1.0 108.773 178.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.576 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.4 OUTLIER -80.09 -39.25 30.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.033 -0.985 . . . . 1.0 111.158 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.512 ' O ' ' O ' ' A' ' 129' ' ' GLY . 66.3 mm-40 -137.6 169.15 18.27 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-O 121.853 0.835 . . . . 1.0 110.74 -179.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.83 177.58 0.01 OUTLIER Glycine 0 C--N 1.311 -0.853 0 CA-C-N 113.622 -1.626 . . . . 1.0 110.828 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -118.64 148.05 43.13 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.261 -0.644 . . . . 1.0 109.261 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.473 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 27.5 m95 -120.17 166.48 13.39 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.479 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 2.0 p -141.46 98.0 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.889 179.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.7 mt -66.78 141.1 57.84 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.418 -0.513 . . . . 1.0 111.299 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -117.75 131.65 56.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.636 . . . . 1.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -45.3 -49.76 12.47 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.432 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.411 ' CD1' ' H ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -123.82 170.48 10.51 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.206 0.527 . . . . 1.0 110.179 -178.45 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.5 p -75.43 174.79 9.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.236 -0.893 . . . . 1.0 110.898 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 60.01 16.63 6.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.467 -1.242 . . . . 1.0 110.037 -179.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 40.06 78.01 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.718 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.411 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 96.4 mtt180 -146.58 44.85 1.21 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.73 0.3 . . . . 1.0 110.551 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -158.39 -139.42 2.69 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 111.187 -0.765 . . . . 1.0 111.187 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -78.19 169.04 18.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.024 0.44 . . . . 1.0 109.942 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.432 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -147.83 139.21 23.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.757 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . 0.427 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.7 m-85 -129.07 139.71 51.89 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.363 -0.977 . . . . 1.0 108.363 177.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.35 126.17 39.44 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.056 0.455 . . . . 1.0 110.743 -178.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.585 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.4 mm? -112.26 101.82 10.02 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.635 -0.711 . . . . 1.0 109.237 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.584 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.98 159.37 68.59 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.645 -0.707 . . . . 1.0 109.729 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -54.29 120.76 8.52 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.276 1.984 . . . . 1.0 111.844 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 166.3 -159.09 32.3 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 110.734 -0.947 . . . . 1.0 110.734 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.487 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 67.8 t0 -119.47 135.21 54.86 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.192 -0.504 . . . . 1.0 110.645 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.487 ' N ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 m-85 -126.55 128.45 46.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.017 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -115.4 -5.53 12.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.991 0.424 . . . . 1.0 110.332 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.669 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.4 ptm180 -154.25 161.13 42.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.843 -0.617 . . . . 1.0 110.436 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.417 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -76.18 -20.32 57.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.898 -1.047 . . . . 1.0 112.443 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.669 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.3 mt-30 -68.97 -18.69 64.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.981 0.419 . . . . 1.0 111.021 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -51.06 -49.04 61.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.973 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.417 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 16.0 p90 -97.29 21.86 9.46 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.244 -0.434 . . . . 1.0 110.568 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.05 74.83 0.26 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.009 -0.836 . . . . 1.0 111.009 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -117.94 149.24 41.23 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 121.034 0.445 . . . . 1.0 110.211 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -80.39 -10.5 59.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.014 178.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.667 HD21 ' HE ' ' A' ' 163' ' ' ARG . 58.3 t30 -172.22 -170.52 0.74 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.456 -0.498 . . . . 1.0 110.406 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.556 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -108.72 -13.31 14.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.493 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.667 ' HE ' HD21 ' A' ' 161' ' ' ASN . 19.1 ptp180 -43.35 121.31 2.18 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.51 0.671 . . . . 1.0 111.504 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 38.5 t -133.08 131.85 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.422 -0.808 . . . . 1.0 109.876 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.65 -29.29 3.93 Favored Glycine 0 N--CA 1.464 0.529 0 N-CA-C 111.477 -0.649 . . . . 1.0 111.477 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 110' ' ' SER . 21.0 m -162.98 174.42 12.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.905 0.383 . . . . 1.0 110.988 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.79 139.72 17.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 1.0 111.015 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -129.28 144.81 51.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.59 0.71 . . . . 1.0 109.485 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.718 ' CD ' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -79.27 150.43 31.54 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.314 -1.312 . . . . 1.0 109.083 178.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 58.3 t -90.21 81.23 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.927 0.394 . . . . 1.0 111.375 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.1 mp . . . . . 0 C--N 1.329 -0.301 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.253 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.711 0 N-CA-C 110.534 -1.027 . . . . 1.0 110.534 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -171.11 111.32 0.35 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.107 -0.237 . . . . 1.0 110.734 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.427 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 171.18 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.173 0.511 . . . . 1.0 111.493 -178.854 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.0 m -128.16 120.34 27.11 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 177.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.5 mt -105.25 133.33 50.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.085 -0.961 . . . . 1.0 110.305 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -115.29 130.44 56.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.304 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.453 ' O ' ' O ' ' A' ' 32' ' ' ARG . 84.0 tt0 -55.18 -24.22 25.82 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.643 -0.708 . . . . 1.0 110.244 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -124.94 161.81 25.83 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.302 0.572 . . . . 1.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -65.62 -173.81 0.17 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.47 -0.786 . . . . 1.0 111.048 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.8 25.25 0.57 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.815 -0.914 . . . . 1.0 110.815 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 51.6 67.85 0.89 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.648 -0.276 . . . . 1.0 110.312 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -129.64 -156.8 0.78 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.961 0.41 . . . . 1.0 110.523 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.43 -149.73 0.41 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -71.71 148.26 46.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.717 0.294 . . . . 1.0 110.577 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.98 149.72 48.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.391 0.615 . . . . 1.0 110.299 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.3 t80 -144.13 141.86 30.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.196 -0.911 . . . . 1.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.557 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.1 tt0 -110.57 121.38 45.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.467 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 t -108.85 126.01 52.6 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.943 0.401 . . . . 1.0 110.734 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 84.4 p -117.75 12.58 13.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.723 -0.672 . . . . 1.0 110.529 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -156.46 172.49 18.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.654 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -62.18 138.85 58.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.574 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.468 ' C ' ' HH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -134.59 143.23 47.23 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.328 179.561 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.0 p -111.21 -17.41 13.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.774 -0.648 . . . . 1.0 112.067 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -150.53 112.16 4.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.145 0.498 . . . . 1.0 110.208 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.0 mt -108.84 2.39 21.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.582 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 43.7 mt-30 -52.05 -51.57 70.06 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.214 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.582 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.3 Cg_endo -55.96 -34.97 93.62 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.509 1.473 . . . . 1.0 112.789 -178.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -91.27 -45.91 8.35 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.183 0.516 . . . . 1.0 110.807 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.7 mt -122.66 129.06 51.42 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.509 -0.768 . . . . 1.0 111.305 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -92.4 -14.67 28.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 8' ' ' GLU . 62.2 ttp180 -176.47 119.69 0.14 Allowed 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 108.745 -0.835 . . . . 1.0 108.745 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -99.2 112.97 25.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.677 0.275 . . . . 1.0 110.598 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -105.0 -4.44 22.04 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.598 0.237 . . . . 1.0 110.473 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.6 p -157.1 157.78 35.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.91 0.386 . . . . 1.0 110.552 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 154.79 34.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.069 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -132.81 122.06 23.9 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 108.783 -0.821 . . . . 1.0 108.783 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.18 115.89 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.276 0.56 . . . . 1.0 110.028 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -77.58 -42.18 36.14 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.936 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.5 t -163.6 159.86 22.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 109.223 -0.658 . . . . 1.0 109.223 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.17 177.5 50.91 Favored Glycine 0 C--N 1.315 -0.623 0 N-CA-C 111.057 -0.817 . . . . 1.0 111.057 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.5 m -112.62 141.27 46.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.344 -0.613 . . . . 1.0 109.344 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.468 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 55.0 m95 -130.37 141.01 50.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.145 0.497 . . . . 1.0 110.903 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.425 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 12.6 tpp -114.86 130.81 56.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.55 -0.75 . . . . 1.0 109.457 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 10.4 mp -109.34 130.25 55.5 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.796 -0.638 . . . . 1.0 109.448 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -109.71 133.42 53.15 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.429 0.633 . . . . 1.0 111.671 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.6 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.55 -35.57 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.259 -0.882 . . . . 1.0 111.402 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -109.42 152.83 42.92 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.562 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -63.59 158.68 44.58 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.446 2.097 . . . . 1.0 112.493 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.606 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.8 OUTLIER 63.84 37.03 9.97 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.937 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.468 ' HH ' ' C ' ' A' ' 23' ' ' HIS . 3.2 m-85 50.06 76.12 0.15 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.306 -0.861 . . . . 1.0 111.108 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.6 m -144.04 153.12 41.87 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.009 0.433 . . . . 1.0 110.313 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 -148.63 21.77 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.053 -0.594 . . . . 1.0 111.88 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.6 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.8 tp -75.58 143.74 42.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.368 -0.416 . . . . 1.0 110.59 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.573 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.6 OUTLIER -120.18 153.25 36.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.581 0.229 . . . . 1.0 110.486 179.543 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.425 ' O ' ' SD ' ' A' ' 44' ' ' MET . 29.6 m-85 -126.45 124.63 40.58 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.932 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -83.8 122.51 28.77 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.178 0.513 . . . . 1.0 110.146 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 mp -119.85 145.36 46.73 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.636 -0.711 . . . . 1.0 109.973 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.642 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 68.4 mtm180 -132.26 158.57 41.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.541 -0.754 . . . . 1.0 109.949 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.413 ' C ' ' O ' ' A' ' 59' ' ' ARG . 61.6 ttp180 -36.1 126.48 0.75 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.032 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.61 -178.89 32.83 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.501 -1.039 . . . . 1.0 110.501 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -115.31 129.46 56.61 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.008 0.432 . . . . 1.0 110.154 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -123.53 113.04 18.2 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.996 -0.547 . . . . 1.0 109.538 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.89 -3.75 54.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.249 -0.432 . . . . 1.0 111.654 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -146.6 137.22 23.94 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.971 -0.751 . . . . 1.0 108.971 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.583 ' H ' ' CD2' ' A' ' 66' ' ' HIS . 4.7 p80 -57.98 -41.64 83.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 1.0 110.694 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.63 -8.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.807 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.477 ' H ' ' C ' ' A' ' 66' ' ' HIS . 22.8 mm-40 -81.57 -34.09 31.25 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.647 -0.421 . . . . 1.0 111.317 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . . . . . . . . . 2.5 p90 -94.75 17.41 13.58 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.871 -0.331 . . . . 1.0 110.86 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 58.2 mtt 72.71 28.99 2.04 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 124.209 0.943 . . . . 1.0 110.128 -178.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.444 -0.822 0 C-N-CA 120.667 -0.777 . . . . 1.0 111.599 -179.188 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 108.981 -0.748 . . . . 1.0 108.981 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 85.3 mtm-85 -123.23 12.29 9.51 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.003 -0.544 . . . . 1.0 111.468 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.1 p -163.38 163.13 25.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.182 0.515 . . . . 1.0 110.592 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.4 p -157.58 148.37 21.19 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.489 -0.778 . . . . 1.0 110.546 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -128.08 150.18 50.07 Favored 'General case' 0 CA--C 1.513 -0.442 0 N-CA-C 109.844 -0.428 . . . . 1.0 109.844 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.468 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 3.7 tt -101.69 121.71 42.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.825 -1.176 . . . . 1.0 107.825 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.2 mt -86.08 120.41 72.45 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.011 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo . . . . . 0 N--CA 1.496 1.655 0 C-N-CA 121.598 1.532 . . . . 1.0 113.077 -179.844 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.7 p . . . . . 0 CA--C 1.515 -0.378 0 N-CA-C 109.881 -0.414 . . . . 1.0 109.881 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -127.58 102.48 6.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.895 0.332 . . . . 1.0 111.895 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 57.1 mtt180 -136.06 138.21 41.9 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.669 -0.413 . . . . 1.0 110.598 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.3 tt -148.44 144.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-N 116.483 -0.326 . . . . 1.0 110.847 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -122.87 97.91 5.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.367 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.47 139.8 39.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.449 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -120.17 135.76 54.86 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.892 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.51 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.42 -62.36 1.77 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.817 -0.629 . . . . 1.0 111.239 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 34.7 mtt-85 -99.18 165.25 11.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.278 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 . . . . . 0 CA--C 1.511 -0.551 0 CA-C-N 115.648 -0.705 . . . . 1.0 110.06 178.806 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.321 0 N-CA-C 110.393 -1.083 . . . . 1.0 110.393 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -66.2 140.23 58.16 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.535 -0.466 . . . . 1.0 110.235 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.8 ptm -132.26 154.19 49.89 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.122 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tt -148.16 140.6 18.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.436 -0.579 . . . . 1.0 109.436 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.53 143.04 44.37 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.717 0.77 . . . . 1.0 110.68 -179.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -129.38 154.25 47.09 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 114.764 -1.107 . . . . 1.0 110.472 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.24 22.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.541 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.61 -170.66 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.625 -0.43 . . . . 1.0 110.552 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 54.5 p-10 -77.91 144.15 37.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.741 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.8 m -137.0 93.1 2.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.09 -31.21 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.034 0.445 . . . . 1.0 111.086 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.7 m -136.82 90.3 2.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.408 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.581 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.9 tp -60.48 -39.84 89.13 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.19 -178.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.541 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 18.4 mp0 -43.69 -9.19 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.147 -0.479 . . . . 1.0 112.268 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.581 ' H ' ' C ' ' A' ' 112' ' ' LEU . 65.8 t0 -94.69 -22.07 18.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.163 0.506 . . . . 1.0 110.215 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.442 ' N ' ' O ' ' A' ' 112' ' ' LEU . 82.5 mmt-85 -107.93 -37.14 6.17 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.446 -0.797 . . . . 1.0 112.821 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.664 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.67 136.84 54.73 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 122.51 1.148 . . . . 1.0 110.752 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.444 ' O ' ' C ' ' A' ' 118' ' ' PHE . 71.1 mtp180 -72.55 -71.46 0.29 Allowed 'General case' 0 C--N 1.315 -0.933 0 O-C-N 120.718 -1.239 . . . . 1.0 110.684 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.608 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.1 m-85 -34.61 146.4 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.631 . . . . 1.0 110.31 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -105.14 8.02 33.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.796 0.332 . . . . 1.0 110.713 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -139.02 142.27 38.28 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.238 0.542 . . . . 1.0 110.816 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 36.5 mm -121.3 123.2 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 115.566 -0.743 . . . . 1.0 109.267 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.404 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 19.6 m-70 -112.14 24.54 12.49 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.501 -0.318 . . . . 1.0 111.634 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 1.6 p 166.28 150.54 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.074 0.464 . . . . 1.0 109.94 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -161.29 156.94 24.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.286 -178.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.76 115.7 22.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 24.4 t -100.56 105.18 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.111 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.515 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.21 -44.39 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 1.0 110.774 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -159.1 158.56 33.18 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.747 0.308 . . . . 1.0 110.861 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.54 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.16 73.84 0.68 Allowed Glycine 0 CA--C 1.508 -0.348 0 C-N-CA 121.45 -0.405 . . . . 1.0 112.38 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 129' ' ' GLY . 8.1 t -31.87 146.78 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.899 0.381 . . . . 1.0 110.596 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.54 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 30.8 m95 -122.1 169.23 11.07 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.075 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 2.3 p -141.47 96.86 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 121.017 0.437 . . . . 1.0 110.756 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.4 mt -68.04 142.01 56.01 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.04 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -118.15 130.75 56.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.785 -0.643 . . . . 1.0 109.98 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -44.25 -48.61 9.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.999 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.413 ' C ' ' CD1' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.68 175.28 6.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.442 0.639 . . . . 1.0 110.57 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.8 m -81.45 172.35 13.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.522 -0.763 . . . . 1.0 110.817 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 63.0 t30 64.04 17.24 10.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 37.01 78.88 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.952 -0.567 . . . . 1.0 111.665 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -148.52 39.7 0.9 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.12 0.486 . . . . 1.0 110.302 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.83 -137.67 2.57 Favored Glycine 0 N--CA 1.465 0.571 0 N-CA-C 111.157 -0.777 . . . . 1.0 111.157 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -80.27 167.81 19.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.102 0.477 . . . . 1.0 110.308 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.573 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -146.58 141.97 27.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.544 -0.753 . . . . 1.0 111.11 -179.08 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 9.0 m-85 -130.76 142.27 50.4 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.341 -0.985 . . . . 1.0 108.341 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 46.2 tp -94.84 124.2 38.74 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.169 0.509 . . . . 1.0 111.329 -179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.591 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.3 mm? -113.7 88.94 2.96 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.529 -0.76 . . . . 1.0 108.951 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 4.5 mtm -70.82 162.66 70.39 Favored Pre-proline 0 CA--C 1.531 0.246 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.22 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.23 116.69 3.22 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 121.621 1.547 . . . . 1.0 111.221 178.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.88 -157.46 22.61 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 110.698 -0.961 . . . . 1.0 110.698 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -128.04 114.52 17.18 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.04 0.447 . . . . 1.0 110.519 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 31.2 m-85 -106.01 130.69 53.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 1.0 109.954 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -116.12 -0.69 12.63 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.792 0.329 . . . . 1.0 110.491 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.672 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.2 ptm180 -158.97 165.7 33.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.362 0.601 . . . . 1.0 110.484 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.413 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -77.19 -23.14 51.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.295 -0.866 . . . . 1.0 112.615 -178.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.672 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.9 mt-30 -67.53 -20.36 65.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.447 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -49.97 -48.72 52.06 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.381 -0.372 . . . . 1.0 110.808 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.413 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 23.1 p90 -96.6 20.96 9.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.09 -0.504 . . . . 1.0 110.573 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.59 74.78 0.27 Allowed Glycine 0 CA--C 1.521 0.446 0 N-CA-C 111.204 -0.758 . . . . 1.0 111.204 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -119.1 148.53 42.94 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.257 0.551 . . . . 1.0 110.377 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.6 t -77.76 -10.86 59.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.969 -1.014 . . . . 1.0 110.356 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.544 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 32.6 t-20 -171.76 -169.02 0.64 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.45 -0.5 . . . . 1.0 110.366 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.544 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -109.12 -8.69 15.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.625 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -44.3 116.25 0.99 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.891 0.377 . . . . 1.0 111.772 -178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 36.8 t -128.31 131.25 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.814 -0.63 . . . . 1.0 109.677 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.402 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -108.65 -28.42 4.55 Favored Glycine 0 N--CA 1.463 0.443 0 N-CA-C 111.694 -0.562 . . . . 1.0 111.694 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.8 p -160.74 -168.58 2.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.704 0.288 . . . . 1.0 110.514 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.8 pp -173.06 137.1 0.69 Allowed 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.532 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.642 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 1.3 ttm180 -131.04 149.77 52.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.559 0.695 . . . . 1.0 109.706 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.87 155.97 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.951 -1.022 . . . . 1.0 109.953 178.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 45.9 t -93.29 79.39 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.879 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 N--CA 1.464 0.256 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.654 179.229 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -174.1 101.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.925 -0.31 . . . . 1.0 110.56 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.2 168.78 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 CA-C-N 116.47 -0.332 . . . . 1.0 110.533 -178.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 26.6 m -127.44 122.17 32.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 176.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.7 mt -104.79 132.7 50.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.328 -0.851 . . . . 1.0 110.438 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -114.82 126.87 55.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.373 -0.83 . . . . 1.0 110.863 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.512 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.2 tt0 -54.49 -32.23 57.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.597 -0.728 . . . . 1.0 110.72 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -115.22 152.16 33.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.217 0.532 . . . . 1.0 110.262 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 12' ' ' PHE . 19.3 ptt-85 -56.83 -171.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.393 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.63 23.97 0.07 OUTLIER Glycine 0 N--CA 1.46 0.292 0 N-CA-C 111.135 -0.786 . . . . 1.0 111.135 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 10' ' ' ARG . 11.8 m-85 52.64 69.02 0.74 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.47 -0.365 . . . . 1.0 110.213 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -129.76 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.917 0.389 . . . . 1.0 110.473 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.33 -151.22 0.11 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.03 -0.828 . . . . 1.0 111.03 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.512 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.6 mtm180 -68.73 146.61 52.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.771 0.32 . . . . 1.0 110.755 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -136.49 143.88 44.04 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.155 0.502 . . . . 1.0 110.261 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE1' ' O ' ' A' ' 18' ' ' GLU . 11.3 t80 -137.39 141.52 41.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.293 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.445 ' O ' ' CE1' ' A' ' 17' ' ' TYR . 19.5 tt0 -110.33 127.84 55.25 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.403 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -115.45 127.11 55.1 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.607 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -118.41 10.31 12.67 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.894 -0.594 . . . . 1.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.0 m -156.45 169.97 23.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 1.0 110.745 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -59.42 137.49 57.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.947 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.58 150.1 51.64 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.774 -0.648 . . . . 1.0 109.924 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.5 p -119.65 -16.8 8.77 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.524 -0.762 . . . . 1.0 112.131 -178.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.491 ' OD1' ' NE2' ' A' ' 27' ' ' GLN . 15.2 t30 -144.75 111.04 5.56 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.912 0.387 . . . . 1.0 110.188 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.1 mt -117.73 -5.72 11.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.866 -0.606 . . . . 1.0 110.58 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.603 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -45.1 -53.13 17.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.263 179.202 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.603 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 12.8 Cg_endo -54.17 -29.99 58.94 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 C-N-CA 122.078 1.852 . . . . 1.0 111.96 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -95.17 -51.44 4.62 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 120.751 -0.38 . . . . 1.0 110.43 -178.738 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.6 126.8 52.07 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.5 t -95.89 -11.61 26.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.909 -0.587 . . . . 1.0 111.491 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -142.22 -53.12 0.42 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.612 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . 0.464 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 20.3 t 55.97 67.84 0.95 Allowed 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 1.0 109.885 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -89.05 4.54 47.99 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.161 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.2 p -154.85 157.63 38.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.088 -0.338 . . . . 1.0 110.088 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.56 155.51 36.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.858 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.4 mtp85 -135.21 122.77 22.06 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.802 -0.814 . . . . 1.0 108.802 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.5 t -108.26 133.11 54.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.153 0.501 . . . . 1.0 110.133 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.64 -39.5 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.419 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 96.3 p -162.96 155.72 19.03 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 176.06 49.7 Favored Glycine 0 CA--C 1.522 0.474 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.0 m -111.26 147.53 34.86 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.706 -0.479 . . . . 1.0 109.706 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.411 ' CE2' HD12 ' A' ' 81' ' ' LEU . 56.5 m95 -132.1 150.86 52.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.81 -0.632 . . . . 1.0 111.246 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.503 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 21.4 tpp -127.38 129.58 47.84 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.881 -0.785 . . . . 1.0 108.881 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.15 137.82 47.37 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.105 -0.498 . . . . 1.0 109.757 -178.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -112.73 129.95 56.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.955 0.407 . . . . 1.0 110.554 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 3.2 pt-20 -54.55 -33.93 60.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.791 -0.64 . . . . 1.0 110.295 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -105.7 154.32 39.35 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.174 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -55.43 150.37 42.47 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.23 1.954 . . . . 1.0 111.212 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.826 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.4 OUTLIER 78.61 -120.2 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 124.035 0.834 . . . . 1.0 109.103 -178.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.57 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 13.1 m-85 -141.98 79.06 1.65 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.665 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.9 t -152.73 166.22 32.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.825 -0.435 . . . . 1.0 109.825 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.15 -150.07 31.66 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.289 -0.725 . . . . 1.0 111.289 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.604 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.5 tp -78.73 142.78 36.77 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.255 -0.276 . . . . 1.0 110.255 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.15 150.41 41.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.297 -0.26 . . . . 1.0 110.297 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.503 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.1 m-85 -127.5 127.04 43.34 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.389 -0.369 . . . . 1.0 110.732 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -82.83 122.96 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.392 0.615 . . . . 1.0 109.719 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 58' ' ' LEU . 3.2 mm? -109.71 136.09 49.6 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.136 -0.938 . . . . 1.0 110.343 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 60' ' ' ARG . 38.5 mtm-85 -127.0 149.14 50.03 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.15 -0.932 . . . . 1.0 109.856 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 59' ' ' ARG . 27.4 ptt180 -34.44 126.93 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.985 -0.552 . . . . 1.0 111.389 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 153.36 -177.38 30.97 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.637 -0.985 . . . . 1.0 110.637 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -115.31 130.81 57.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.869 0.366 . . . . 1.0 110.195 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.89 112.11 16.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 1.0 109.536 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.437 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -89.59 -4.45 57.84 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.827 -0.624 . . . . 1.0 110.991 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 83.2 m-20 -147.3 148.44 31.41 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.723 -0.473 . . . . 1.0 109.723 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.548 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.2 p-80 -67.66 -42.53 82.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.019 0.437 . . . . 1.0 111.338 -179.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.523 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 4.6 pt20 -50.79 -8.58 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.734 -0.666 . . . . 1.0 110.519 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.548 ' H ' ' C ' ' A' ' 66' ' ' HIS . 24.9 mm-40 -82.42 -33.35 28.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.355 -0.384 . . . . 1.0 111.256 -177.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.518 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -98.1 21.72 10.41 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 119.27 -0.395 . . . . 1.0 110.907 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.436 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 57.6 mtp 80.46 10.48 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.58 0.55 . . . . 1.0 110.256 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.42 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.339 0.704 0 N-CA-C 111.096 -0.801 . . . . 1.0 111.096 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.469 0.488 0 N-CA-C 109.884 -0.413 . . . . 1.0 109.884 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -122.68 7.62 9.44 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.553 -0.294 . . . . 1.0 111.092 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.7 p -163.76 161.78 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.428 . . . . 1.0 110.653 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.7 p -154.81 146.05 22.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.026 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.2 ptm180 -127.61 146.66 50.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.102 -0.333 . . . . 1.0 110.102 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.411 HD12 ' CE2' ' A' ' 43' ' ' TRP . 29.8 tp -96.19 130.0 43.37 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.494 -0.558 . . . . 1.0 109.494 178.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -92.05 114.56 62.5 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.017 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo . . . . . 0 N--CA 1.497 1.678 0 C-N-CA 122.439 2.093 . . . . 1.0 112.776 179.892 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 CA--C 1.522 -0.118 0 N-CA-C 109.787 -0.449 . . . . 1.0 109.787 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.6 m80 -132.43 121.78 23.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.548 -0.296 . . . . 1.0 111.032 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -147.92 136.59 21.77 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 1.0 110.288 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.6 tt -150.94 149.92 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.517 -0.311 . . . . 1.0 110.535 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -130.09 100.55 5.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.389 0.614 . . . . 1.0 111.445 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.2 mt -77.44 139.43 39.66 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.645 -0.707 . . . . 1.0 110.301 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.603 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 54.6 m-85 -115.27 139.28 50.1 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.603 0.716 . . . . 1.0 111.138 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.509 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.6 OUTLIER -59.27 -63.54 1.27 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.395 -0.821 . . . . 1.0 111.512 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.5 mmm-85 -96.07 174.09 7.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.113 0.482 . . . . 1.0 110.955 -178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 115.547 -0.751 . . . . 1.0 110.988 -179.714 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.323 0 N-CA-C 111.527 -0.629 . . . . 1.0 111.527 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -61.4 146.6 47.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.374 . . . . 1.0 110.398 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.603 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 5.9 ttp -133.36 149.1 51.87 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.82 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.421 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -141.19 142.46 29.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 109.8 -0.444 . . . . 1.0 109.8 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -112.38 136.71 51.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.417 0.627 . . . . 1.0 110.647 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -122.41 156.13 34.65 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.844 -1.071 . . . . 1.0 110.256 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -142.82 13.03 1.88 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.396 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -156.33 -168.69 2.8 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 120.616 -0.434 . . . . 1.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -76.63 145.16 39.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.42 . . . . 1.0 110.801 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.453 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 13.5 m -133.47 93.2 3.11 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.04 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 78.2 p -67.75 -28.29 67.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.319 -0.401 . . . . 1.0 111.247 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.2 t -138.26 97.05 3.29 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.328 0.585 . . . . 1.0 111.174 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.556 ' C ' ' H ' ' A' ' 114' ' ' ASP . 3.5 mt -63.82 -40.49 96.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.172 -0.922 . . . . 1.0 110.505 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.452 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 25.9 mm-40 -46.21 -11.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.896 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.556 ' H ' ' C ' ' A' ' 112' ' ' LEU . 38.5 t70 -96.21 -25.83 15.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.804 0.335 . . . . 1.0 110.547 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.3 mmt180 -110.31 -41.05 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 1.0 111.546 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.421 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 5.1 t80 -122.41 116.68 24.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.15 0.5 . . . . 1.0 110.408 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 118' ' ' PHE . 23.5 mmm180 -56.67 -67.81 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.444 -0.798 . . . . 1.0 111.16 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.509 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 80.0 m-85 -38.08 139.98 0.31 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.51 -0.313 . . . . 1.0 110.304 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . 0.452 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 81.2 m-20 -100.43 2.84 42.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.914 -178.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -132.76 142.27 48.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.191 0.52 . . . . 1.0 111.151 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.8 mm -122.92 120.64 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 CA-C-N 115.518 -0.765 . . . . 1.0 109.52 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.456 ' O ' ' CB ' ' A' ' 123' ' ' SER . 30.7 m-70 -110.94 28.48 8.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 1.0 111.514 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.456 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.7 t 162.27 151.06 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 120.986 0.422 . . . . 1.0 110.695 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 pp -163.73 158.79 20.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.573 -0.74 . . . . 1.0 110.371 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -126.33 119.1 26.49 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.848 -0.427 . . . . 1.0 109.848 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 26.5 t -100.9 105.42 17.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 109.722 -0.473 . . . . 1.0 109.722 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.593 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.69 -41.67 30.53 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.634 -0.712 . . . . 1.0 111.263 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -140.34 146.29 38.26 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.976 0.417 . . . . 1.0 110.87 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 61.21 -175.39 5.46 Favored Glycine 0 CA--C 1.518 0.242 0 N-CA-C 111.183 -0.767 . . . . 1.0 111.183 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 146' ' ' LEU . 8.4 t -117.65 154.38 31.7 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.655 -0.498 . . . . 1.0 109.655 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.3 m95 -127.64 160.21 32.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.808 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 65.7 t -132.26 135.38 58.17 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 N-CA-C 109.659 -0.497 . . . . 1.0 109.659 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 23.5 mt -107.77 143.29 36.52 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.238 -0.282 . . . . 1.0 110.238 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -118.79 133.07 56.1 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.755 0.312 . . . . 1.0 110.629 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -43.27 -52.23 5.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.958 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.423 HD12 ' C ' ' A' ' 140' ' ' ARG . 0.5 OUTLIER -121.99 172.3 8.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.176 0.513 . . . . 1.0 110.181 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.7 m -75.56 170.05 16.9 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.529 -0.76 . . . . 1.0 110.918 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 62.0 t30 66.37 16.94 10.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.279 -0.873 . . . . 1.0 109.982 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.478 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 1.4 m-85 38.55 80.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 1.0 111.679 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.423 ' C ' HD12 ' A' ' 136' ' ' LEU . 51.3 ttp180 -149.48 42.11 0.89 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.983 0.421 . . . . 1.0 109.904 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.44 -135.11 2.17 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 111.309 -0.716 . . . . 1.0 111.309 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -82.98 168.54 16.9 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.962 -0.384 . . . . 1.0 109.962 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.38 137.82 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.116 -0.493 . . . . 1.0 110.919 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -128.22 132.11 48.8 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.162 -0.681 . . . . 1.0 109.162 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -87.53 126.65 35.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.083 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.443 ' O ' ' OG ' ' A' ' 130' ' ' SER . 21.8 mt -115.43 99.9 7.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.993 -0.549 . . . . 1.0 109.599 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.422 ' O ' ' OH ' ' A' ' 151' ' ' TYR . 5.2 mtm -81.94 156.77 69.66 Favored Pre-proline 0 C--N 1.327 -0.373 0 C-N-CA 120.704 -0.398 . . . . 1.0 110.604 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.39 120.33 3.13 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 C-N-CA 122.081 1.854 . . . . 1.0 111.569 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.54 -154.81 24.9 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.431 -1.068 . . . . 1.0 110.431 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -127.02 135.98 51.59 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.835 0.35 . . . . 1.0 110.458 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.518 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 11.9 m-85 -126.87 130.97 51.21 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.754 -0.461 . . . . 1.0 109.754 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -119.39 -0.37 10.94 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.747 0.308 . . . . 1.0 110.589 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -158.15 163.11 37.9 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 121.173 0.511 . . . . 1.0 109.947 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.572 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -76.19 -18.48 59.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.354 -0.839 . . . . 1.0 111.918 -178.436 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.572 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -67.62 -21.68 65.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 1.0 110.712 -179.028 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -50.27 -48.42 54.86 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.614 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.544 ' HE1' ' HB3' ' A' ' 159' ' ' ALA . 21.7 p90 -102.27 19.41 18.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 1.0 110.562 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 76.67 0.16 Allowed Glycine 0 CA--C 1.52 0.354 0 N-CA-C 111.272 -0.731 . . . . 1.0 111.272 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.544 ' HB3' ' HE1' ' A' ' 157' ' ' TRP . . . -94.12 -169.75 2.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.037 0.446 . . . . 1.0 110.115 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 1.2 t -123.49 -36.31 2.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.542 -0.754 . . . . 1.0 111.776 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.548 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 0.2 OUTLIER -145.64 -24.1 0.47 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 1.0 111.61 -178.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.548 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 93.23 0.8 0.09 Allowed 'General case' 0 N--CA 1.465 0.305 0 O-C-N 124.031 0.832 . . . . 1.0 110.68 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -67.98 116.07 8.22 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.849 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.2 125.28 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.115 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -102.07 -24.59 8.41 Favored Glycine 0 N--CA 1.464 0.503 0 N-CA-C 111.507 -0.637 . . . . 1.0 111.507 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.9 p -161.51 171.21 18.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.88 0.371 . . . . 1.0 110.68 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.73 148.5 24.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.98 -0.555 . . . . 1.0 111.617 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.478 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 15.4 ptp180 -138.17 154.2 49.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.363 . . . . 1.0 110.094 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -86.66 155.94 20.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.043 -0.526 . . . . 1.0 110.053 178.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.07 85.62 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 1.0 111.191 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.034 -0.53 . . . . 1.0 110.436 179.341 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.532 0 N-CA-C 110.694 -0.963 . . . . 1.0 110.694 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.9 tttt -172.91 106.24 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.891 -0.324 . . . . 1.0 110.321 179.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.26 168.48 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 116.468 -0.333 . . . . 1.0 110.595 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.0 m -127.63 121.72 31.23 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 177.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.8 mt -105.67 132.97 51.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.047 -0.979 . . . . 1.0 110.262 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -115.06 127.26 55.51 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.307 -0.86 . . . . 1.0 110.909 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.426 ' OE1' ' OD1' ' A' ' 9' ' ' ASP . 6.9 tm-20 -53.94 -32.86 55.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.557 -0.747 . . . . 1.0 110.588 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . 0.426 ' OD1' ' OE1' ' A' ' 8' ' ' GLU . 90.4 m-20 -115.74 152.14 33.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.292 0.568 . . . . 1.0 110.292 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.44 ' C ' ' N ' ' A' ' 12' ' ' PHE . 32.5 ptt85 -57.04 -172.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.494 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.81 22.65 0.3 Allowed Glycine 0 CA--C 1.517 0.207 0 N-CA-C 110.918 -0.873 . . . . 1.0 110.918 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.44 ' N ' ' C ' ' A' ' 10' ' ' ARG . 10.3 m-85 53.23 67.37 1.01 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.26 -0.274 . . . . 1.0 110.26 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' A' ' 12' ' ' PHE . 10.9 mm100 -129.8 -158.65 0.9 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.138 0.494 . . . . 1.0 110.594 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.67 -149.97 0.67 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -70.83 147.13 49.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.681 0.277 . . . . 1.0 110.701 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -136.49 146.6 46.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.187 0.518 . . . . 1.0 110.299 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -139.63 141.43 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.383 -0.826 . . . . 1.0 109.978 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 62.1 tt0 -111.07 122.92 49.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.336 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.6 126.83 54.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.464 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.3 p -117.43 10.29 13.55 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.345 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.8 m -156.88 169.02 25.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.732 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.8 139.68 56.03 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.639 -0.709 . . . . 1.0 111.244 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.61 155.33 49.3 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.64 -0.709 . . . . 1.0 110.409 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -123.66 -15.03 7.14 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.382 -0.826 . . . . 1.0 112.326 -179.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -138.08 112.97 9.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.954 0.406 . . . . 1.0 110.408 -178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 mp -115.95 -9.74 11.73 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.063 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -48.61 -52.53 43.84 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.46 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.576 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 16.8 Cg_endo -55.39 -33.69 86.46 Favored 'Trans proline' 0 C--N 1.316 -1.181 0 C-N-CA 121.848 1.699 . . . . 1.0 112.103 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -95.0 -49.43 5.55 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 120.388 -0.525 . . . . 1.0 110.68 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 mt -121.66 126.32 48.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.668 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 t -95.01 -12.85 25.92 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.909 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -143.39 -51.17 0.34 Allowed 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 116.167 -0.469 . . . . 1.0 111.737 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.5 t 56.88 78.5 0.22 Allowed 'General case' 0 C--N 1.314 -0.955 0 O-C-N 122.134 -0.354 . . . . 1.0 110.099 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 -95.19 5.69 51.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.294 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.6 p -158.13 158.32 34.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 1.0 110.254 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.79 154.3 32.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.942 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.9 mtp85 -133.05 121.95 23.45 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.598 -0.89 . . . . 1.0 108.598 178.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.8 133.19 53.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.627 -0.509 . . . . 1.0 109.627 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.59 -43.94 7.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.744 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.2 t -160.82 154.09 21.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.95 177.59 50.99 Favored Glycine 0 C--N 1.317 -0.5 0 N-CA-C 111.194 -0.762 . . . . 1.0 111.194 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.1 m -112.16 134.05 53.93 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.589 -0.522 . . . . 1.0 109.589 178.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.414 ' CE2' HD12 ' A' ' 81' ' ' LEU . 58.4 m95 -121.96 142.41 50.33 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.017 -0.538 . . . . 1.0 111.179 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.48 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 10.4 tpp -120.15 130.29 54.53 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.546 -0.752 . . . . 1.0 109.172 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' A' ' 45' ' ' LEU . 0.2 OUTLIER -111.49 138.96 47.33 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.084 -0.507 . . . . 1.0 109.808 -178.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -111.58 130.99 55.57 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.322 0.582 . . . . 1.0 110.979 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -55.39 -30.7 60.88 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.12 -0.945 . . . . 1.0 110.532 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.554 HE21 ' CA ' ' A' ' 53' ' ' GLY . 15.0 pt20 -114.87 156.29 45.25 Favored Pre-proline 0 N--CA 1.465 0.297 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.46 ' C ' HD21 ' A' ' 50' ' ' ASN . 14.4 Cg_endo -52.94 152.38 17.96 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 121.753 1.635 . . . . 1.0 111.911 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.737 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.5 OUTLIER 70.32 -120.48 0.11 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.747 -1.115 . . . . 1.0 109.313 -178.448 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER -153.64 76.28 1.08 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.648 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.545 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 30.7 t -143.29 16.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.541 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . 0.554 ' CA ' HE21 ' A' ' 48' ' ' GLN . . . -133.11 -168.93 12.05 Favored Glycine 0 N--CA 1.464 0.549 0 N-CA-C 111.33 -0.708 . . . . 1.0 111.33 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.4 tp -55.34 145.54 21.82 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 109.522 -0.547 . . . . 1.0 109.522 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -122.33 152.49 40.07 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.903 0.383 . . . . 1.0 110.624 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.48 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.0 m-85 -130.52 125.92 35.52 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.945 -0.57 . . . . 1.0 110.731 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -84.15 123.93 30.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.885 -0.598 . . . . 1.0 110.26 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.0 mp -121.26 145.91 47.37 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.582 -0.735 . . . . 1.0 110.686 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.406 ' O ' ' C ' ' A' ' 60' ' ' ARG . 43.8 mtp180 -132.51 158.66 41.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.293 179.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 59' ' ' ARG . 40.5 ptt180 -35.14 127.56 0.54 Allowed 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.701 -0.681 . . . . 1.0 111.116 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.79 -178.3 30.0 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 110.873 -0.891 . . . . 1.0 110.873 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.442 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.5 p-10 -116.92 128.01 54.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.08 0.467 . . . . 1.0 110.435 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -120.46 112.72 19.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 1.0 109.6 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.86 -3.71 57.15 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.283 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -148.28 141.34 24.93 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.49 -0.559 . . . . 1.0 109.49 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.513 ' C ' ' H ' ' A' ' 68' ' ' GLN . 25.6 p-80 -62.57 -40.1 95.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.096 0.474 . . . . 1.0 111.166 -179.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -54.56 -6.78 0.12 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.355 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.513 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -84.5 -34.65 23.31 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.779 -0.368 . . . . 1.0 111.363 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -95.1 18.42 12.21 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 119.225 -0.417 . . . . 1.0 111.063 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.472 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 39.9 mtt 82.37 12.92 0.54 Allowed 'General case' 0 N--CA 1.463 0.225 0 O-C-N 123.884 0.74 . . . . 1.0 110.128 -178.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.416 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.343 0.926 0 C-N-CA 120.526 -0.845 . . . . 1.0 111.311 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.471 0.575 0 N-CA-C 110.362 -0.236 . . . . 1.0 110.362 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -126.09 8.51 7.33 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.742 0.306 . . . . 1.0 110.928 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 p -163.45 161.21 24.14 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.144 0.497 . . . . 1.0 110.789 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 27.4 p -154.75 146.98 23.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.456 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.7 ptm180 -127.84 148.01 50.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.224 -0.288 . . . . 1.0 110.224 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.414 HD12 ' CE2' ' A' ' 43' ' ' TRP . 19.9 tp -98.64 127.3 44.52 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.858 -0.793 . . . . 1.0 108.858 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.405 ' N ' HD13 ' A' ' 81' ' ' LEU . 2.8 mt -93.16 120.49 66.8 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.189 -0.459 . . . . 1.0 109.827 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo . . . . . 0 N--CA 1.495 1.591 0 C-N-CA 122.145 1.897 . . . . 1.0 112.884 179.671 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.462 0.135 0 N-CA-C 109.752 -0.462 . . . . 1.0 109.752 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.8 m-70 -132.52 128.43 37.3 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.887 0.375 . . . . 1.0 110.926 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -155.1 133.91 12.11 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.679 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.6 tt -146.21 150.12 15.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.442 -0.344 . . . . 1.0 110.754 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.4 98.28 5.0 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.25 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.24 137.63 38.22 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.326 0.584 . . . . 1.0 111.43 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.45 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 56.9 m-85 -111.93 134.42 53.49 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 115.11 -0.95 . . . . 1.0 110.841 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.466 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.9 tm-20 -52.98 -56.93 12.35 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.511 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -104.1 171.5 7.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.564 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.63 -0.714 . . . . 1.0 110.311 179.088 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.762 0 N-CA-C 111.407 -0.677 . . . . 1.0 111.407 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -58.31 146.83 32.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.988 -0.375 . . . . 1.0 109.988 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.455 ' HG2' ' N ' ' A' ' 103' ' ' ILE . 11.7 ttp -131.54 153.06 50.22 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.897 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.455 ' N ' ' HG2' ' A' ' 102' ' ' MET . 11.9 tt -146.51 142.12 20.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.5 -0.556 . . . . 1.0 109.5 177.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -112.54 143.41 43.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.47 0.653 . . . . 1.0 110.427 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -129.52 156.96 43.31 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 114.814 -1.084 . . . . 1.0 110.567 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.6 p -143.73 15.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.433 -0.803 . . . . 1.0 110.592 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.413 ' C ' ' NE ' ' A' ' 169' ' ' ARG . 16.8 pt-20 -156.6 -168.55 2.73 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.202 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.631 ' N ' ' NE ' ' A' ' 169' ' ' ARG . 49.1 p30 -79.87 147.98 31.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.805 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.479 ' O ' ' OG ' ' A' ' 166' ' ' SER . 2.2 t -138.03 93.95 2.83 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.013 -0.54 . . . . 1.0 109.996 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.3 p -65.04 -22.28 66.96 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.809 -0.357 . . . . 1.0 111.209 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 16.4 t -140.56 94.23 2.71 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.311 0.577 . . . . 1.0 110.618 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.57 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.0 tp -62.62 -43.5 98.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.342 -0.845 . . . . 1.0 110.299 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.65 ' NE2' HD21 ' A' ' 119' ' ' ASN . 22.5 mp0 -48.93 -7.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.925 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.57 ' H ' ' C ' ' A' ' 112' ' ' LEU . 45.7 t0 -94.88 -26.49 16.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.945 0.402 . . . . 1.0 110.346 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.8 mmt180 -108.31 -34.46 6.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.191 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.452 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 5.3 t80 -124.23 118.48 26.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.12 0.486 . . . . 1.0 109.871 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -54.51 -67.62 0.25 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.529 -0.76 . . . . 1.0 111.12 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.466 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 92.6 m-85 -40.14 141.66 0.45 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.233 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . 0.65 HD21 ' NE2' ' A' ' 113' ' ' GLN . 19.1 t-20 -102.22 2.32 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.809 0.338 . . . . 1.0 111.35 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -130.24 138.86 50.76 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.219 0.533 . . . . 1.0 111.045 -178.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 37.4 mm -122.2 125.9 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 CA-C-N 115.303 -0.862 . . . . 1.0 109.358 178.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.522 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.5 m-70 -114.06 17.57 17.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.473 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.522 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 3.2 m 170.5 156.08 0.06 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.997 0.427 . . . . 1.0 110.965 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.443 ' CD2' ' CD1' ' A' ' 151' ' ' TYR . 0.0 OUTLIER -160.11 162.08 33.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.818 179.466 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.57 112.31 16.04 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.045 -0.724 . . . . 1.0 109.045 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 40.4 t -101.72 103.95 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.634 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.587 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.55 -37.45 36.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.75 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 129' ' ' GLY . 31.1 tp10 -138.87 158.34 44.39 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.875 0.369 . . . . 1.0 110.416 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.433 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.08 -173.2 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 111.078 -0.809 . . . . 1.0 111.078 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.497 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.7 OUTLIER -115.71 176.18 5.2 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.384 -0.598 . . . . 1.0 109.384 179.545 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.497 ' CD1' ' C ' ' A' ' 130' ' ' SER . 67.3 m95 -147.12 161.1 41.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.694 -0.684 . . . . 1.0 110.346 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 60.1 t -132.05 134.01 60.13 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 116.058 -0.519 . . . . 1.0 109.771 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.48 143.53 37.32 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . 0.536 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 13.6 m-85 -119.43 131.9 55.72 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.041 0.448 . . . . 1.0 110.306 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -47.69 -23.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.945 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.425 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -147.75 179.67 7.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.061 0.458 . . . . 1.0 110.199 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.5 p -84.8 170.58 13.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.023 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . 0.61 ' ND2' ' HE ' ' A' ' 140' ' ' ARG . 57.5 t30 66.01 16.37 10.44 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.049 -0.978 . . . . 1.0 110.262 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.545 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 5.1 m-85 40.37 78.66 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.801 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.61 ' HE ' ' ND2' ' A' ' 138' ' ' ASN . 90.9 mtt-85 -147.94 37.38 0.87 Allowed 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 120.905 0.383 . . . . 1.0 110.658 179.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -148.3 -145.64 4.19 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.428 -0.669 . . . . 1.0 111.428 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -74.34 157.45 35.72 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 110.18 -0.304 . . . . 1.0 110.18 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.472 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 66.1 mt-30 -133.75 133.66 42.02 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.538 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -128.5 133.3 48.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.305 -0.628 . . . . 1.0 109.305 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.54 128.72 37.48 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.363 0.602 . . . . 1.0 110.587 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.605 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.34 90.55 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.194 -0.912 . . . . 1.0 109.103 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -68.86 150.72 97.54 Favored Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 114.857 -1.065 . . . . 1.0 111.097 -178.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -44.93 119.22 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 C-N-CA 121.404 1.403 . . . . 1.0 111.298 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 166.2 -151.0 19.02 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.405 -1.078 . . . . 1.0 110.405 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -136.01 125.54 25.19 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.676 0.274 . . . . 1.0 110.614 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 3.1 m-85 -116.43 129.41 56.21 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.325 -0.62 . . . . 1.0 109.325 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . 0.428 ' CA ' ' HG ' ' A' ' 123' ' ' SER . 72.9 mtm-85 -107.24 -1.54 21.69 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.02 0.438 . . . . 1.0 110.432 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.663 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -156.99 163.03 39.56 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.474 0.654 . . . . 1.0 110.867 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.535 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 9.1 p90 -78.28 -21.08 50.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.905 -1.043 . . . . 1.0 112.565 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.663 ' NE2' HH21 ' A' ' 153' ' ' ARG . 55.0 mt-30 -68.8 -20.03 64.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.93 -0.577 . . . . 1.0 111.167 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -51.96 -48.42 64.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.86 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.535 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 16.8 p90 -95.77 20.92 9.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.84 75.76 0.2 Allowed Glycine 0 CA--C 1.521 0.429 0 N-CA-C 111.212 -0.755 . . . . 1.0 111.212 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.46 ' CB ' ' HE1' ' A' ' 157' ' ' TRP . . . -118.85 149.24 41.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.086 0.469 . . . . 1.0 110.146 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 13.4 t -76.93 -21.3 55.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.254 -0.884 . . . . 1.0 110.207 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -163.33 -170.1 2.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.879 0.371 . . . . 1.0 110.492 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -108.91 -7.12 15.5 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.102 -0.499 . . . . 1.0 110.577 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -49.23 119.56 3.39 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.067 0.461 . . . . 1.0 111.121 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.9 t -135.05 121.25 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.372 -0.831 . . . . 1.0 109.382 177.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.403 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -100.54 -23.09 10.48 Favored Glycine 0 N--CA 1.467 0.717 0 N-CA-C 111.716 -0.554 . . . . 1.0 111.716 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.661 ' HG ' ' N ' ' A' ' 167' ' ' LEU . 5.2 t -156.77 179.94 8.8 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.266 -0.573 . . . . 1.0 110.314 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.661 ' N ' ' HG ' ' A' ' 166' ' ' SER . 1.5 pp -166.29 142.65 4.92 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.002 -0.544 . . . . 1.0 111.165 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.545 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 13.4 ptp180 -136.15 152.57 50.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.836 0.351 . . . . 1.0 110.123 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.631 ' NE ' ' N ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -81.01 159.16 24.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.193 -0.669 . . . . 1.0 109.193 177.792 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.405 ' O ' HG21 ' A' ' 170' ' ' VAL . 27.1 m -92.41 66.14 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.791 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 19.5 mt . . . . . 0 C--N 1.327 -0.389 0 CA-C-O 121.441 0.639 . . . . 1.0 110.948 179.441 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.369 0 N-CA-C 110.726 -0.95 . . . . 1.0 110.726 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -174.77 100.4 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.673 -0.411 . . . . 1.0 110.24 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.4 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -119.99 164.8 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 CA-C-N 116.264 -0.426 . . . . 1.0 110.278 -178.902 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.8 m -124.16 118.6 27.25 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.29 -1.004 . . . . 1.0 108.29 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.8 mt -102.79 133.14 48.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.853 -1.067 . . . . 1.0 109.853 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -115.92 126.1 53.45 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.499 -0.773 . . . . 1.0 111.005 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.533 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 82.0 tt0 -53.51 -31.57 46.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.608 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -115.16 153.67 30.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.283 0.564 . . . . 1.0 110.439 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.42 ' C ' ' N ' ' A' ' 12' ' ' PHE . 4.4 ptm180 -58.63 -173.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.609 -0.723 . . . . 1.0 110.265 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.47 26.84 0.25 Allowed Glycine 0 N--CA 1.462 0.388 0 N-CA-C 110.956 -0.858 . . . . 1.0 110.956 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.5 m-85 50.28 70.94 0.45 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.362 -0.419 . . . . 1.0 110.279 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -132.0 -158.81 0.92 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.92 0.391 . . . . 1.0 110.532 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.89 -151.93 0.3 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.533 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 89.0 mtm180 -68.77 146.57 52.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 1.0 110.768 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.3 p-80 -136.03 152.66 51.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.247 0.546 . . . . 1.0 110.377 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.531 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -146.69 141.51 26.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.494 -0.776 . . . . 1.0 110.294 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.531 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.0 tt0 -110.2 123.1 49.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.057 -0.52 . . . . 1.0 110.177 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.423 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.1 t -112.69 126.92 55.92 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.86 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -117.49 10.85 13.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.353 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.0 p -154.34 165.95 34.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.61 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.437 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 47.1 p-10 -58.32 141.65 50.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.549 -0.75 . . . . 1.0 111.446 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.423 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -136.19 146.22 46.59 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.389 -0.823 . . . . 1.0 110.484 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.6 p -112.78 -16.17 12.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.738 -0.664 . . . . 1.0 111.651 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -151.03 117.48 5.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.271 0.558 . . . . 1.0 110.667 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.4 mt -118.24 -0.41 11.54 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.283 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.581 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 45.6 mt-30 -46.39 -53.44 23.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.795 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.4 Cg_endo -54.35 -30.35 62.45 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.842 1.695 . . . . 1.0 111.977 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.433 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -96.27 -54.32 3.32 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.586 -0.446 . . . . 1.0 110.664 -179.062 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -117.74 126.95 53.4 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.756 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.2 t -95.28 -9.45 33.07 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.746 -0.661 . . . . 1.0 111.499 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 94.4 mtm-85 -146.36 -59.56 0.3 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t 64.8 76.37 0.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 1.0 110.004 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -92.55 3.78 54.85 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.999 -0.546 . . . . 1.0 111.383 -178.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.0 p -158.67 158.76 34.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.818 0.342 . . . . 1.0 110.274 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.92 155.73 34.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.995 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 25.3 mtp180 -134.67 123.62 24.01 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 108.96 -0.756 . . . . 1.0 108.96 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.06 132.66 56.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.364 -0.606 . . . . 1.0 109.364 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -93.92 -43.59 8.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.627 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.7 t -160.99 151.84 18.46 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.269 -0.423 . . . . 1.0 109.874 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.26 175.78 47.58 Favored Glycine 0 C--N 1.319 -0.405 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.4 m -113.02 137.52 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.509 -0.552 . . . . 1.0 109.509 178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 46.8 m95 -124.02 155.98 37.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.242 0.544 . . . . 1.0 110.904 -178.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.4 tpt -127.78 129.1 46.47 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.694 -0.854 . . . . 1.0 108.694 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.7 mt -108.69 130.33 55.35 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.419 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 73.3 m-85 -108.26 131.61 54.53 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.665 0.745 . . . . 1.0 110.758 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.607 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 4.7 pt-20 -59.25 -35.11 73.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.711 -1.131 . . . . 1.0 110.347 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.403 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.3 mt-30 -111.0 153.41 43.85 Favored Pre-proline 0 N--CA 1.462 0.146 0 CA-C-N 116.446 -0.343 . . . . 1.0 110.49 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.93 159.17 43.44 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.443 2.095 . . . . 1.0 112.623 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.651 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.64 39.21 11.53 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.731 -0.668 . . . . 1.0 111.023 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.419 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 5.2 m-85 48.17 74.22 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 1.0 110.746 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.8 m -141.5 153.15 44.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.063 0.459 . . . . 1.0 110.168 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.42 -147.26 19.95 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.91 -0.662 . . . . 1.0 111.675 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.607 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 37.2 tp -80.31 146.0 31.82 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.388 -0.406 . . . . 1.0 110.647 -179.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.416 ' NE2' ' H ' ' A' ' 145' ' ' LEU . 12.1 pt20 -121.78 150.86 41.26 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.839 0.352 . . . . 1.0 110.537 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.419 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 24.7 m-85 -127.53 132.54 49.9 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.236 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -80.77 118.3 22.18 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.576 0.703 . . . . 1.0 109.961 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -111.71 133.89 53.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.131 -0.94 . . . . 1.0 109.704 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.4 ptt85 -133.65 162.12 32.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.441 -0.799 . . . . 1.0 110.204 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -41.06 123.88 2.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.322 -0.399 . . . . 1.0 110.91 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.08 178.63 33.27 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.86 -0.896 . . . . 1.0 110.86 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.4 p-10 -115.29 124.43 51.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.206 0.527 . . . . 1.0 110.222 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -119.32 112.46 19.48 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.244 -0.651 . . . . 1.0 109.244 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.24 -4.04 54.65 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.496 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.9 m-20 -147.58 138.34 23.37 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.398 -0.593 . . . . 1.0 109.398 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.533 ' H ' ' CD2' ' A' ' 66' ' ' HIS . 5.7 p80 -58.48 -40.96 84.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.133 0.492 . . . . 1.0 110.969 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -54.3 -7.82 0.17 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.709 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.485 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -81.89 -34.82 29.79 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.386 -0.526 . . . . 1.0 111.05 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.75 13.19 18.91 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.963 -0.295 . . . . 1.0 110.311 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.411 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 52.6 mtt 74.51 35.98 0.66 Allowed 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.915 0.759 . . . . 1.0 109.967 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.419 ' HA2' ' CE1' ' A' ' 56' ' ' TYR . . . . . . . . 0 CA--C 1.531 1.057 0 C-N-CA 120.158 -1.02 . . . . 1.0 111.463 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.518 -0.259 0 N-CA-C 108.607 -0.886 . . . . 1.0 108.607 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -121.49 4.12 10.19 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.867 -0.606 . . . . 1.0 111.566 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.2 p -163.22 162.69 25.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.177 0.513 . . . . 1.0 110.543 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 25.2 p -155.55 147.26 23.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 1.0 110.188 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.08 146.46 50.36 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.933 -0.395 . . . . 1.0 109.933 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.0 tp -96.41 136.15 37.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.485 -0.932 . . . . 1.0 108.485 178.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mt -96.41 112.91 61.42 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.606 -0.516 . . . . 1.0 109.606 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo . . . . . 0 N--CA 1.498 1.783 0 C-N-CA 122.143 1.895 . . . . 1.0 113.224 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 m . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.835 0.35 . . . . 1.0 110.244 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -136.06 114.69 11.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 1.0 110.94 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -142.29 133.76 26.55 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.195 -0.298 . . . . 1.0 110.195 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.9 tt -145.93 143.29 21.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.387 -0.37 . . . . 1.0 111.007 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -121.58 101.75 7.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.447 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.9 mt -82.89 139.29 33.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.964 -0.562 . . . . 1.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.471 ' CE1' ' CG ' ' A' ' 102' ' ' MET . 67.7 m-85 -115.15 136.96 52.55 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.527 0.679 . . . . 1.0 111.276 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.588 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 17.4 pt-20 -58.48 -47.12 85.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.278 -0.874 . . . . 1.0 110.354 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.493 ' N ' ' CG ' ' A' ' 94' ' ' GLU . 24.7 mtt85 -115.22 165.91 12.42 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.086 -0.506 . . . . 1.0 111.089 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 . . . . . 0 CA--C 1.507 -0.682 0 CA-C-N 115.312 -0.858 . . . . 1.0 110.354 179.027 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.413 0 N-CA-C 110.828 -0.909 . . . . 1.0 110.828 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.588 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 11.6 tp-100 -61.39 139.45 58.19 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.917 -0.313 . . . . 1.0 110.205 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.724 ' SD ' ' N ' ' A' ' 103' ' ' ILE . 4.3 tmm? -131.73 137.66 48.32 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.585 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.724 ' N ' ' SD ' ' A' ' 102' ' ' MET . 8.3 tt -134.37 137.41 51.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.094 -0.706 . . . . 1.0 109.094 178.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -111.33 146.88 36.3 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.526 0.679 . . . . 1.0 110.362 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.408 ' CZ ' ' CD1' ' A' ' 112' ' ' LEU . 89.0 m-85 -130.27 155.67 45.93 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.037 -0.983 . . . . 1.0 110.466 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.6 p -143.77 27.76 1.47 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.681 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.408 ' CD ' ' N ' ' A' ' 107' ' ' GLU . 1.4 pm0 -168.08 -167.68 0.86 Allowed 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.713 -0.395 . . . . 1.0 110.47 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -81.64 147.34 29.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.419 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.521 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 3.2 m -139.16 97.05 3.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.44 -30.88 71.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.901 0.382 . . . . 1.0 110.983 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 51.5 m -137.74 93.14 2.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.982 -0.553 . . . . 1.0 110.511 -179.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.528 ' O ' ' N ' ' A' ' 115' ' ' ARG . 13.4 tp -60.59 -39.19 87.19 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.448 -0.796 . . . . 1.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.552 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 25.3 mp0 -43.86 -13.49 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.634 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 112' ' ' LEU . 93.6 m-20 -93.82 2.07 56.29 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.189 0.519 . . . . 1.0 110.751 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.3 mmt180 -133.59 -39.87 0.89 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.886 -1.052 . . . . 1.0 112.654 -177.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.727 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -123.1 136.08 54.65 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 122.061 0.934 . . . . 1.0 111.136 -179.036 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 118' ' ' PHE . 20.3 mmm180 -72.44 -70.09 0.36 Allowed 'General case' 0 C--N 1.315 -0.898 0 O-C-N 121.059 -1.026 . . . . 1.0 110.367 -178.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.672 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 61.0 m-85 -31.51 143.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.618 0.574 . . . . 1.0 110.187 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -105.03 6.79 33.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.998 0.428 . . . . 1.0 110.522 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -139.74 139.86 36.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.937 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.401 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 42.0 mm -120.11 120.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.385 -0.825 . . . . 1.0 109.108 178.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -110.59 22.29 15.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 1.0 111.584 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.478 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.8 p 169.08 151.71 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.071 0.463 . . . . 1.0 110.015 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -161.96 157.11 23.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 1.0 110.183 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -125.01 117.67 24.53 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 22.0 t -101.59 105.07 17.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 109.597 -0.52 . . . . 1.0 109.597 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.583 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.8 OUTLIER -78.54 -40.95 33.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.787 -0.642 . . . . 1.0 111.494 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.7 mm-40 -139.69 167.3 22.42 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.443 0.639 . . . . 1.0 110.633 -178.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 44.26 -179.49 0.01 OUTLIER Glycine 0 C--N 1.315 -0.637 0 CA-C-N 113.911 -1.495 . . . . 1.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 20.2 m -119.4 149.63 41.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.358 -0.608 . . . . 1.0 109.358 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.459 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 37.2 m95 -121.61 167.19 13.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.822 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 2.0 p -141.8 96.5 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.911 -0.315 . . . . 1.0 110.917 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 7.7 mt -66.53 142.63 57.45 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.389 -0.524 . . . . 1.0 110.966 -178.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -117.8 129.96 55.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.773 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -43.21 -49.11 6.62 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.053 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.415 ' C ' ' CD1' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.39 175.45 7.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.197 0.522 . . . . 1.0 110.559 -179.122 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -81.81 172.78 12.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.562 -0.745 . . . . 1.0 110.508 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 38.4 m-20 63.44 17.65 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.29 -0.868 . . . . 1.0 110.278 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.429 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 7.4 m-85 36.29 77.89 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.174 -0.467 . . . . 1.0 111.71 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 52.9 ttm-85 -147.0 39.87 1.04 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.953 0.406 . . . . 1.0 110.64 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -154.51 -138.62 2.65 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.105 -0.798 . . . . 1.0 111.105 -178.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -79.27 169.59 17.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.93 0.395 . . . . 1.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.94 137.91 21.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.747 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . 0.428 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 17.8 m-85 -125.48 137.97 53.98 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 108.609 -0.886 . . . . 1.0 108.609 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.416 ' H ' ' NE2' ' A' ' 55' ' ' GLN . 38.5 tp -95.05 126.37 40.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.339 0.59 . . . . 1.0 111.149 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.579 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.6 mm? -114.33 109.31 18.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.208 -0.905 . . . . 1.0 109.832 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -83.26 166.66 33.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 116.295 -0.411 . . . . 1.0 110.1 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -62.01 114.03 2.13 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.979 1.786 . . . . 1.0 111.223 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.43 -150.87 11.3 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.587 -1.005 . . . . 1.0 110.587 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 66.6 t0 -128.56 134.62 48.68 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.815 0.34 . . . . 1.0 110.551 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.6 m-85 -125.95 131.4 52.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.209 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -117.22 -1.31 11.86 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.952 0.406 . . . . 1.0 110.419 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.662 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -157.16 165.3 36.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.892 -0.595 . . . . 1.0 110.402 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 14.4 p90 -79.39 -20.77 46.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.261 -0.881 . . . . 1.0 112.253 -177.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.662 ' NE2' HH21 ' A' ' 153' ' ' ARG . 51.8 mt-30 -68.6 -19.61 64.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 1.0 111.218 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -51.37 -48.81 62.42 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.894 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.451 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 17.8 p90 -97.64 20.74 11.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.714 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.92 75.57 0.21 Allowed Glycine 0 CA--C 1.518 0.223 0 N-CA-C 111.125 -0.79 . . . . 1.0 111.125 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.43 ' CB ' ' HE1' ' A' ' 157' ' ' TRP . . . -117.84 149.59 40.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 121.069 0.461 . . . . 1.0 110.274 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.3 t -79.11 -12.46 60.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.354 -0.839 . . . . 1.0 110.238 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.557 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 9.0 t-20 -170.5 -171.25 1.04 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.996 0.427 . . . . 1.0 110.486 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.557 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -108.98 -8.83 15.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.624 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -48.37 123.88 7.18 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 121.498 0.666 . . . . 1.0 111.171 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 41.5 t -131.28 133.78 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.924 178.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.464 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -111.19 -31.18 2.92 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 111.715 -0.554 . . . . 1.0 111.715 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 9.3 p -158.84 -169.46 2.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.763 0.316 . . . . 1.0 110.462 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 pp -173.03 138.1 0.74 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.794 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.6 141.96 50.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.57 0.7 . . . . 1.0 109.878 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.748 ' CD ' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -77.22 145.91 37.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.155 178.135 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 48.7 t -82.52 88.32 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.691 -0.404 . . . . 1.0 111.839 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.1 mp . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.187 -0.46 . . . . 1.0 110.496 179.368 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.246 0 N-CA-C 110.752 -0.939 . . . . 1.0 110.752 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 tttt -176.34 100.87 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.498 -0.481 . . . . 1.0 110.319 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.422 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -118.89 165.38 14.26 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.659 -179.401 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 26.9 m -124.0 120.3 32.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.542 -0.91 . . . . 1.0 108.542 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.4 mt -104.11 132.87 49.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.94 -1.027 . . . . 1.0 109.845 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -115.05 124.99 53.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.938 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -52.71 -29.85 29.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.596 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -117.23 154.96 30.26 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.112 0.482 . . . . 1.0 110.298 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 12' ' ' PHE . 11.5 ptm180 -59.86 -172.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.548 -0.751 . . . . 1.0 110.362 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.11 25.71 0.27 Allowed Glycine 0 N--CA 1.461 0.336 0 N-CA-C 111.086 -0.805 . . . . 1.0 111.086 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.55 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 51.44 69.17 0.69 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.527 -0.337 . . . . 1.0 110.25 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -131.28 -156.58 0.76 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.032 0.444 . . . . 1.0 110.521 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.12 -153.15 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.071 -0.812 . . . . 1.0 111.071 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -69.25 148.33 49.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.74 0.305 . . . . 1.0 110.712 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -136.64 152.57 50.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.138 0.494 . . . . 1.0 110.453 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.526 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -145.13 140.98 28.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.2 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.526 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.8 tt0 -110.3 123.63 50.17 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.269 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.499 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.2 t -112.58 127.0 55.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.737 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.7 t -118.06 15.52 14.16 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.026 -0.533 . . . . 1.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.1 p -158.89 167.58 29.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.458 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.458 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 54.1 p-10 -57.75 141.36 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.502 -0.772 . . . . 1.0 111.388 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.499 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.43 145.14 44.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.198 179.693 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 p -112.16 -16.66 12.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.735 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.8 120.34 6.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.1 0.476 . . . . 1.0 110.624 -179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.3 mt -119.1 0.11 11.19 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.586 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 31.5 mt-30 -48.41 -52.13 45.62 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.784 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.8 Cg_endo -54.55 -32.58 74.92 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.933 1.756 . . . . 1.0 112.22 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -94.37 -52.37 4.37 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 120.527 -0.469 . . . . 1.0 110.555 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.2 mt -116.95 127.07 53.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.714 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -95.13 -10.56 30.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.47 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -145.55 -61.97 0.34 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.28 -0.418 . . . . 1.0 111.475 -178.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.8 t 66.83 81.32 0.2 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.779 -0.452 . . . . 1.0 109.779 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.565 ' ND2' ' HD1' ' A' ' 66' ' ' HIS . 2.4 t30 -96.93 1.78 50.84 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 120.687 0.28 . . . . 1.0 110.966 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.55 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.9 t -155.2 156.51 35.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.835 0.35 . . . . 1.0 110.087 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.4 153.72 34.15 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.912 -0.585 . . . . 1.0 110.926 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.5 mtp180 -136.05 123.41 21.94 Favored 'General case' 0 C--O 1.206 -1.189 0 N-CA-C 109.347 -0.612 . . . . 1.0 109.347 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.513 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.5 p -109.66 132.0 59.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.036 0.446 . . . . 1.0 110.259 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -85.41 -42.59 14.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.231 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 t -163.95 150.42 11.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.937 -0.394 . . . . 1.0 109.937 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.56 177.81 42.73 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 110.745 -0.942 . . . . 1.0 110.745 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -111.85 140.8 46.2 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.594 -0.521 . . . . 1.0 109.594 178.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 57.2 m95 -128.46 133.75 48.58 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.495 0.664 . . . . 1.0 111.355 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.43 ' SD ' ' C ' ' A' ' 56' ' ' TYR . 27.5 tpp -107.45 129.37 54.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.294 -0.866 . . . . 1.0 109.233 178.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.409 ' CD1' ' N ' ' A' ' 45' ' ' LEU . 9.9 mp -109.32 130.86 55.48 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.868 -0.605 . . . . 1.0 109.832 -179.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -111.09 130.65 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 1.0 111.402 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.586 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 9.3 pt-20 -56.69 -37.26 70.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.767 -0.651 . . . . 1.0 111.214 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.431 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 5.2 mt-30 -106.29 153.53 40.33 Favored Pre-proline 0 C--O 1.233 0.203 0 CA-C-N 115.83 -0.623 . . . . 1.0 110.688 -178.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.26 159.23 48.21 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.386 2.058 . . . . 1.0 112.208 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.639 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.4 45.04 6.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.744 -0.662 . . . . 1.0 111.149 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 42.96 74.93 0.1 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.419 -0.81 . . . . 1.0 110.837 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 m -145.38 157.31 44.05 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.061 0.458 . . . . 1.0 109.867 -178.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.7 -148.15 23.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.732 -0.746 . . . . 1.0 111.683 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.586 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.7 tp -76.83 142.41 40.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.44 -0.38 . . . . 1.0 110.202 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -119.41 150.42 40.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.487 -0.19 . . . . 1.0 110.487 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.43 ' C ' ' SD ' ' A' ' 44' ' ' MET . 18.5 m-85 -126.18 124.15 39.82 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 116.52 -0.309 . . . . 1.0 110.771 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -84.23 123.64 30.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.255 -0.43 . . . . 1.0 109.893 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.5 mp -118.32 147.33 43.59 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.82 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' A' ' 60' ' ' ARG . 31.4 mtm-85 -134.74 155.02 51.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.89 -178.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' A' ' 59' ' ' ARG . 27.7 tpt85 -32.41 125.46 0.31 Allowed 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.542 0.526 . . . . 1.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.513 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 153.62 -177.34 31.2 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.242 -1.143 . . . . 1.0 110.242 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -115.6 136.18 53.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.825 0.345 . . . . 1.0 110.186 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.425 ' O ' ' OG ' ' A' ' 35' ' ' SER . 46.2 m-85 -128.25 112.41 14.46 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.819 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.51 -4.57 55.34 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.677 -0.692 . . . . 1.0 111.339 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 19.6 m-20 -147.14 141.94 26.81 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.417 -0.586 . . . . 1.0 109.417 179.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.565 ' HD1' ' ND2' ' A' ' 34' ' ' ASN . 29.9 p-80 -63.6 -39.92 95.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.979 0.419 . . . . 1.0 111.367 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -54.43 -6.77 0.12 Allowed 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.244 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.517 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.3 mm-40 -83.65 -35.28 24.7 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.676 -0.41 . . . . 1.0 111.402 -177.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.477 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -95.92 19.53 11.36 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 119.229 -0.415 . . . . 1.0 110.978 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.439 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 48.6 mtt 81.46 12.15 0.73 Allowed 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.91 0.756 . . . . 1.0 110.35 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.403 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.342 0.88 0 C-N-CA 120.548 -0.834 . . . . 1.0 111.152 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 1.4 p . . . . . 0 N--CA 1.474 0.766 0 CA-C-O 120.689 0.28 . . . . 1.0 110.487 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -102.24 8.74 40.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.795 -0.362 . . . . 1.0 110.656 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.2 p -163.81 162.69 23.89 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.068 0.461 . . . . 1.0 110.828 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.3 p -155.34 146.88 23.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.689 -0.687 . . . . 1.0 110.273 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.3 ptm180 -128.4 150.05 50.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.455 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 38.0 tp -96.99 133.94 41.0 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.033 -0.729 . . . . 1.0 109.033 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.418 HG22 HD13 ' A' ' 82' ' ' ILE . 10.0 mt -97.18 112.7 61.6 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 N--CA 1.499 1.817 0 C-N-CA 122.353 2.035 . . . . 1.0 112.983 -179.948 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 CA--C 1.519 -0.234 0 N-CA-C 109.718 -0.475 . . . . 1.0 109.718 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -128.94 109.02 10.88 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 121.061 -0.256 . . . . 1.0 111.166 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -138.46 141.9 39.46 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 120.384 -0.526 . . . . 1.0 110.516 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.4 tt -155.52 149.86 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.491 -0.322 . . . . 1.0 110.637 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.476 ' HE ' ' CB ' ' A' ' 125' ' ' ASN . 22.8 ptt180 -131.47 103.94 6.7 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.558 0.694 . . . . 1.0 111.048 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.59 150.15 26.11 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.598 -0.728 . . . . 1.0 111.801 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -122.55 136.93 55.01 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.26 -0.882 . . . . 1.0 111.371 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.639 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.23 -52.95 61.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.276 -0.875 . . . . 1.0 111.017 179.55 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.639 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 74.5 mtp180 -109.12 177.02 4.88 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 120.843 0.354 . . . . 1.0 110.138 -178.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 57.6 mp0 . . . . . 0 CA--C 1.508 -0.668 0 CA-C-N 115.45 -0.796 . . . . 1.0 110.229 179.861 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.556 0 N-CA-C 111.076 -0.809 . . . . 1.0 111.076 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.466 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 66.4 tp60 -65.91 148.67 51.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.554 0.692 . . . . 1.0 111.174 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.64 149.17 47.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.34 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.488 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -140.5 140.46 34.09 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 109.437 -0.579 . . . . 1.0 109.437 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -113.71 132.09 55.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.369 0.604 . . . . 1.0 110.935 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.466 ' CZ ' ' CD2' ' A' ' 112' ' ' LEU . 96.9 m-85 -116.06 155.87 27.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 114.658 -1.155 . . . . 1.0 110.106 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.2 p -144.38 20.18 1.71 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.532 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -159.43 -170.8 3.07 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.595 -0.442 . . . . 1.0 110.109 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.452 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 53.6 p-10 -73.82 141.83 46.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 1.0 111.2 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.416 ' O ' ' OH ' ' A' ' 139' ' ' TYR . 2.8 m -131.17 118.91 21.14 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.259 -0.645 . . . . 1.0 109.259 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.43 ' O ' ' OG ' ' A' ' 137' ' ' SER . 87.6 p -95.86 -22.42 17.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 1.0 111.006 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 50.3 t -146.07 96.82 2.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.299 0.571 . . . . 1.0 111.839 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.541 ' O ' ' N ' ' A' ' 114' ' ' ASP . 8.3 mt -62.45 -41.19 98.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.025 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -45.15 -12.58 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.139 -0.482 . . . . 1.0 111.098 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 112' ' ' LEU . 64.5 t0 -96.77 -27.18 14.85 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.958 0.409 . . . . 1.0 110.508 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.4 mmt180 -108.77 -40.64 4.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.103 -0.498 . . . . 1.0 111.497 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.488 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 5.9 t80 -121.94 118.52 29.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.208 0.528 . . . . 1.0 110.341 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -56.51 -69.07 0.16 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.215 -0.902 . . . . 1.0 111.079 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -39.72 138.46 0.74 Allowed 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 110.059 -0.348 . . . . 1.0 110.059 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -99.81 -0.41 39.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.515 -0.312 . . . . 1.0 111.038 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -125.52 138.36 53.97 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.538 0.685 . . . . 1.0 110.854 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.5 mm -121.17 119.01 58.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 CA-C-N 114.973 -1.012 . . . . 1.0 109.617 178.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.417 ' O ' ' CB ' ' A' ' 123' ' ' SER . 23.0 m-70 -110.92 22.02 15.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.694 -0.685 . . . . 1.0 111.675 -178.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.474 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 1.8 p 166.97 152.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.865 0.364 . . . . 1.0 110.651 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . 0.518 ' CD2' ' CD1' ' A' ' 151' ' ' TYR . 0.0 OUTLIER -162.32 163.94 27.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.557 -179.518 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . 0.476 ' CB ' ' HE ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -126.92 116.06 20.24 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.009 -0.737 . . . . 1.0 109.009 179.634 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.0 t -99.72 106.38 19.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 O-C-N 123.553 0.533 . . . . 1.0 110.649 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.549 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.99 -42.74 23.3 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 124.025 0.828 . . . . 1.0 110.556 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -157.77 145.38 18.54 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.457 -0.497 . . . . 1.0 110.625 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.516 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 72.6 82.83 0.29 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 115.827 -0.624 . . . . 1.0 113.061 177.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.461 ' O ' ' O ' ' A' ' 129' ' ' GLY . 13.7 t -31.51 150.24 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.162 0.506 . . . . 1.0 110.616 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.516 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 53.3 m95 -124.12 163.49 21.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.13 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 46.4 t -134.22 137.93 50.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-N 115.881 -0.6 . . . . 1.0 109.479 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 143' ' ' GLN . 28.5 mt -109.02 140.39 42.6 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 109.166 -0.679 . . . . 1.0 109.166 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . 0.624 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 30.8 m-85 -117.27 132.36 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.89 0.376 . . . . 1.0 110.875 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.439 ' OE2' ' CZ ' ' A' ' 163' ' ' ARG . 84.6 tt0 -40.7 -55.18 2.45 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.053 -0.522 . . . . 1.0 111.08 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.45 HD12 ' C ' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -121.26 172.84 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.122 0.487 . . . . 1.0 110.098 -178.87 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 137' ' ' SER . . . . . 0.43 ' OG ' ' O ' ' A' ' 110' ' ' SER . 2.1 t -74.7 169.5 17.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.546 179.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.9 t30 66.96 15.77 10.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.231 -0.895 . . . . 1.0 110.019 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.416 ' OH ' ' O ' ' A' ' 109' ' ' CYS . 2.5 m-85 40.21 80.66 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 1.0 111.698 179.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.45 ' C ' HD12 ' A' ' 136' ' ' LEU . 61.8 ttt180 -149.89 40.57 0.81 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.2 0.524 . . . . 1.0 109.786 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -150.84 -140.43 3.18 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.281 -0.728 . . . . 1.0 111.281 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.41 ' C ' HE21 ' A' ' 143' ' ' GLN . 80.7 mtp85 -76.25 171.25 14.86 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 110.121 -0.325 . . . . 1.0 110.121 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.439 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -150.3 137.42 19.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.012 -179.706 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -127.52 141.28 51.69 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.195 -0.668 . . . . 1.0 109.195 178.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 59.1 tp -93.83 126.78 39.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.422 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 13.4 mt -116.33 90.46 3.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.83 -0.623 . . . . 1.0 109.397 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.6 mtm -73.59 161.61 78.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.939 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -49.94 113.58 1.05 Allowed 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.934 1.756 . . . . 1.0 111.31 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 173.08 -152.28 15.68 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.454 -1.058 . . . . 1.0 110.454 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.462 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 p-10 -135.48 127.19 29.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.831 0.348 . . . . 1.0 111.248 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 1.8 m-85 -118.58 133.66 55.7 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 109.385 -0.598 . . . . 1.0 109.385 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -112.85 -4.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.814 0.34 . . . . 1.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -153.42 162.81 40.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.251 0.548 . . . . 1.0 110.208 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -75.04 -19.83 59.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.134 -0.939 . . . . 1.0 112.202 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.557 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -67.48 -20.88 65.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.85 -179.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -51.64 -47.94 63.54 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 120.252 -0.579 . . . . 1.0 110.793 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.534 ' HE1' ' HB3' ' A' ' 159' ' ' ALA . 37.9 p90 -101.9 18.53 20.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 1.0 110.305 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.69 77.85 0.13 Allowed Glycine 0 C--N 1.331 0.265 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.534 ' HB3' ' HE1' ' A' ' 157' ' ' TRP . . . -96.12 -170.42 2.11 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.093 0.473 . . . . 1.0 109.995 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -34.92 2.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.462 -0.79 . . . . 1.0 111.621 -179.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.572 ' ND2' ' O ' ' A' ' 161' ' ' ASN . 0.6 OUTLIER -150.17 -15.81 0.25 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.85 0.315 . . . . 1.0 111.85 -178.86 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.518 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 88.52 -23.61 0.11 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.787 -0.642 . . . . 1.0 110.827 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.439 ' CZ ' ' OE2' ' A' ' 135' ' ' GLU . 34.2 ptt180 -42.17 119.4 1.35 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.568 0.699 . . . . 1.0 110.866 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 30.4 t -121.33 132.09 71.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.504 -0.771 . . . . 1.0 109.894 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -108.73 -26.87 5.15 Favored Glycine 0 N--CA 1.465 0.608 0 N-CA-C 111.338 -0.705 . . . . 1.0 111.338 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.7 p -163.88 169.02 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.961 0.41 . . . . 1.0 110.784 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.32 146.38 24.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.899 -0.592 . . . . 1.0 111.552 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.624 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 7.0 ptp180 -136.94 148.8 47.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.615 -0.513 . . . . 1.0 109.615 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.848 HH11 ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -82.06 152.59 26.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.219 -0.901 . . . . 1.0 109.622 177.735 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 59.2 t -85.67 85.23 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.935 0.398 . . . . 1.0 111.453 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 2.3 mp . . . . . 0 N--CA 1.464 0.267 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.35 179.131 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.664 0 N-CA-C 110.504 -1.038 . . . . 1.0 110.504 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -172.92 106.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.062 -0.255 . . . . 1.0 110.698 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.444 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.55 173.31 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 120.813 0.34 . . . . 1.0 111.264 -179.311 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 33.5 m -130.24 120.96 25.27 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.456 -0.942 . . . . 1.0 108.456 177.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -105.91 133.09 51.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.044 -0.98 . . . . 1.0 110.058 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -114.29 129.55 56.64 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.553 -0.749 . . . . 1.0 111.231 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.477 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 79.4 tt0 -56.15 -20.98 19.95 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.789 . . . . 1.0 110.324 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -127.14 154.56 44.6 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.146 0.498 . . . . 1.0 110.086 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 12' ' ' PHE . 29.0 ptt85 -58.95 -172.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.619 -0.719 . . . . 1.0 110.299 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.15 26.1 0.16 Allowed Glycine 0 N--CA 1.463 0.44 0 N-CA-C 111.083 -0.807 . . . . 1.0 111.083 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.436 ' N ' ' O ' ' A' ' 10' ' ' ARG . 5.7 m-85 50.54 66.99 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.934 -0.395 . . . . 1.0 109.934 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -126.15 -155.84 0.7 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.825 0.345 . . . . 1.0 110.469 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 39.78 -149.1 0.14 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -71.19 149.0 46.75 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.906 0.384 . . . . 1.0 110.497 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -135.01 144.78 47.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.353 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.561 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.5 t80 -140.94 142.34 34.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 1.0 110.039 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.561 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 40.5 tt0 -110.82 122.1 47.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.269 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.46 127.21 54.24 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.187 -0.461 . . . . 1.0 110.513 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -117.56 14.6 14.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 95.5 p -159.62 169.17 24.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.538 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 81' ' ' LEU . 47.7 m-20 -57.82 139.88 53.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.722 -0.672 . . . . 1.0 110.884 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.418 ' CE1' ' HH ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -134.83 148.58 50.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.552 -0.749 . . . . 1.0 110.146 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -118.84 -18.84 8.8 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.654 -0.703 . . . . 1.0 112.07 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -143.87 108.66 4.91 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.197 0.522 . . . . 1.0 109.954 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 26.0 mt -111.78 0.41 16.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.747 -0.661 . . . . 1.0 110.172 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.8 mt-30 -55.28 -42.97 98.71 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.621 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.3 Cg_exo -58.85 -36.89 96.22 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.277 1.985 . . . . 1.0 112.029 -179.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -93.33 -44.61 8.21 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.962 0.41 . . . . 1.0 111.067 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.74 127.8 49.67 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.766 -0.652 . . . . 1.0 111.444 -178.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -91.44 -11.41 37.69 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.143 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 42.0 ttm180 -176.16 120.39 0.16 Allowed 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t -101.49 107.42 18.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.115 -0.366 . . . . 1.0 110.394 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -103.56 -4.71 23.54 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.375 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.6 p -156.18 156.41 34.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.965 0.412 . . . . 1.0 110.333 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.84 155.14 36.54 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.897 -0.592 . . . . 1.0 110.997 -179.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.3 mtt-85 -136.03 122.34 20.51 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.74 -0.664 . . . . 1.0 109.567 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.465 HG12 ' H ' ' A' ' 61' ' ' GLY . 1.4 p -110.47 129.39 65.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.981 0.42 . . . . 1.0 110.948 179.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -81.06 -46.02 15.63 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.453 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.463 ' HG ' ' N ' ' A' ' 41' ' ' GLY . 46.5 t -162.37 153.33 17.55 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.018 -0.364 . . . . 1.0 110.018 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . 0.463 ' N ' ' HG ' ' A' ' 40' ' ' SER . . . 91.54 175.27 43.17 Favored Glycine 0 C--N 1.32 -0.357 0 N-CA-C 110.876 -0.89 . . . . 1.0 110.876 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 84.5 m -111.0 132.36 54.27 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.209 -0.663 . . . . 1.0 109.209 178.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.444 ' CE2' HG23 ' A' ' 4' ' ' ILE . 50.3 m95 -118.62 146.93 44.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 1.0 111.195 -179.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -117.99 127.18 53.57 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 109.246 -0.649 . . . . 1.0 109.246 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.421 ' CD1' ' N ' ' A' ' 45' ' ' LEU . 10.4 mp -108.27 127.38 53.8 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.53 -0.544 . . . . 1.0 109.53 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -103.88 131.12 51.4 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.579 0.704 . . . . 1.0 111.429 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.539 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.1 pt-20 -60.53 -35.34 75.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.908 -1.042 . . . . 1.0 109.557 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.418 ' O ' ' OG ' ' A' ' 78' ' ' SER . 6.8 mt-30 -102.24 152.59 38.3 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.066 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.514 ' C ' HD21 ' A' ' 50' ' ' ASN . 18.1 Cg_endo -56.94 151.16 51.01 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.752 1.635 . . . . 1.0 110.796 179.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.716 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.5 OUTLIER 70.26 -116.11 0.1 Allowed 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.241 -1.022 . . . . 1.0 108.241 -177.711 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -152.83 70.94 0.9 Allowed 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 178.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.7 t -137.18 18.08 2.97 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 120.785 0.326 . . . . 1.0 110.888 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -134.68 -171.18 12.42 Favored Glycine 0 CA--C 1.519 0.341 0 N-CA-C 111.069 -0.812 . . . . 1.0 111.069 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.539 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.2 tp -58.54 151.03 21.32 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.524 -0.338 . . . . 1.0 110.153 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -121.08 149.24 43.03 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.631 0.253 . . . . 1.0 111.196 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -126.09 129.18 48.6 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 116.42 -0.355 . . . . 1.0 110.849 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.462 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 21.8 t80 -82.94 120.43 25.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.419 0.628 . . . . 1.0 110.138 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -110.79 133.78 53.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.135 -0.939 . . . . 1.0 109.678 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.69 ' NH1' HH12 ' A' ' 168' ' ' ARG . 76.6 mtm180 -127.92 145.67 50.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.266 -0.879 . . . . 1.0 109.534 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.44 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.1 ttt-85 -31.71 126.8 0.22 Allowed 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.447 0.467 . . . . 1.0 111.323 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.465 ' H ' HG12 ' A' ' 38' ' ' VAL . . . 152.09 -174.34 31.1 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.472 -1.051 . . . . 1.0 110.472 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.63 133.36 56.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.004 0.43 . . . . 1.0 110.353 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -127.39 113.33 16.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.042 -0.526 . . . . 1.0 109.646 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.39 -3.68 54.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.302 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -146.63 143.48 28.84 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.395 -0.594 . . . . 1.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.54 ' C ' ' H ' ' A' ' 68' ' ' GLN . 22.7 p-80 -66.03 -42.43 89.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 1.0 110.928 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -52.01 -7.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.802 -0.635 . . . . 1.0 110.449 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.54 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.5 mm-40 -82.38 -36.14 27.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.825 -0.35 . . . . 1.0 111.212 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.7 p90 -93.53 19.58 8.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 119.391 -0.338 . . . . 1.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.44 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 66.6 mtp 79.88 17.19 0.75 Allowed 'General case' 0 C--O 1.233 0.209 0 O-C-N 123.942 0.776 . . . . 1.0 109.749 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.972 0 C-N-CA 120.898 -0.668 . . . . 1.0 112.123 179.563 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 109.053 -0.721 . . . . 1.0 109.053 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.8 mtm180 -127.94 6.25 6.02 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.477 -178.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 11.5 p -161.65 159.98 28.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.147 0.498 . . . . 1.0 110.305 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.6 p -155.8 146.98 22.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.109 -178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -127.26 145.51 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.862 -0.421 . . . . 1.0 109.862 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.407 HD11 ' CE2' ' A' ' 43' ' ' TRP . 34.3 tp -95.04 134.36 37.81 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.052 -0.722 . . . . 1.0 109.052 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mt -95.33 113.53 61.83 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 109.543 -0.54 . . . . 1.0 109.543 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 N--CA 1.498 1.763 0 C-N-CA 122.257 1.971 . . . . 1.0 112.968 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 CA--C 1.52 -0.183 0 CA-C-O 120.767 0.318 . . . . 1.0 110.377 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -136.54 111.9 9.18 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.341 -0.39 . . . . 1.0 110.981 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 43.5 mtm-85 -142.32 139.21 31.75 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.755 -0.378 . . . . 1.0 110.425 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.4 tt -152.81 153.63 8.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.063 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -133.36 112.96 12.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.294 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . 0.57 ' N ' ' CD2' ' A' ' 92' ' ' LEU . 1.5 mm? -88.92 123.47 33.3 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.419 -0.809 . . . . 1.0 109.821 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.585 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 26.6 m-85 -100.04 135.43 41.47 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 115.308 -0.86 . . . . 1.0 110.757 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.486 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.5 tm-20 -57.2 -60.58 3.4 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.585 -0.734 . . . . 1.0 111.394 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.466 ' O ' ' OG ' ' A' ' 123' ' ' SER . 84.4 mtp180 -102.2 166.8 10.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.748 -178.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 . . . . . 0 CA--C 1.516 -0.333 0 CA-C-N 115.641 -0.709 . . . . 1.0 110.711 178.812 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.837 0 N-CA-C 111.142 -0.783 . . . . 1.0 111.142 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -62.12 143.15 57.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 121.071 -0.251 . . . . 1.0 110.392 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.585 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 11.3 ttp -133.38 149.57 51.84 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.814 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.403 ' N ' ' HG2' ' A' ' 102' ' ' MET . 11.0 tt -143.0 141.8 26.48 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 N-CA-C 109.57 -0.53 . . . . 1.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -113.93 143.98 43.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 1.0 110.715 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.412 ' CE2' HD13 ' A' ' 112' ' ' LEU . 82.6 m-85 -131.36 154.83 48.18 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.011 -0.995 . . . . 1.0 110.489 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.6 p -144.52 19.85 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.805 -0.634 . . . . 1.0 111.137 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 1.019 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.0 pt-20 -167.45 83.35 0.21 Allowed 'General case' 0 C--O 1.213 -0.865 0 CA-C-O 118.025 -0.988 . . . . 1.0 109.967 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 1.019 ' O ' ' O ' ' A' ' 107' ' ' GLU . 51.9 p30 16.49 163.0 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 122.359 1.076 . . . . 1.0 113.358 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 108' ' ' ASP . 8.8 m -146.66 107.17 4.07 Favored 'General case' 0 C--N 1.308 -1.235 0 O-C-N 120.18 -1.575 . . . . 1.0 109.545 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.427 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.6 p -66.33 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.317 -0.401 . . . . 1.0 110.969 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 15.7 t -142.52 88.9 2.1 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.13 0.491 . . . . 1.0 110.208 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.59 ' C ' ' H ' ' A' ' 114' ' ' ASP . 11.7 tp -61.55 -41.71 97.77 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 115.553 -0.749 . . . . 1.0 110.265 -178.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.569 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 22.2 mp0 -43.15 -10.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.258 -0.428 . . . . 1.0 111.719 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.59 ' H ' ' C ' ' A' ' 112' ' ' LEU . 62.7 t0 -95.29 -21.81 18.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.055 0.455 . . . . 1.0 110.748 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 112' ' ' LEU . 25.2 mmt85 -108.86 -36.71 6.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.899 0.703 . . . . 1.0 112.899 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.706 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.16 138.37 54.24 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 122.2 1.0 . . . . 1.0 110.861 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.3 mmt-85 -75.33 -73.72 0.24 Allowed 'General case' 0 C--N 1.312 -1.041 0 O-C-N 120.641 -1.287 . . . . 1.0 110.62 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.683 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.4 m-85 -31.31 144.77 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.564 0 O-C-N 123.508 0.505 . . . . 1.0 110.314 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -105.6 9.25 33.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.826 0.346 . . . . 1.0 111.075 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -137.85 138.75 39.43 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.008 -0.542 . . . . 1.0 111.173 -178.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.409 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 40.6 mm -120.98 121.35 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.426 -0.807 . . . . 1.0 109.183 178.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -111.24 20.74 17.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.883 -0.599 . . . . 1.0 111.634 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 3.1 p 169.85 153.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.069 0.461 . . . . 1.0 110.273 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.5 pp -165.94 161.59 17.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.662 -0.699 . . . . 1.0 110.788 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -128.55 120.85 27.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.368 -0.378 . . . . 1.0 110.152 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.0 t -100.93 105.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.1 -0.704 . . . . 1.0 109.1 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.584 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.44 -42.2 30.62 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.932 -0.576 . . . . 1.0 111.212 -179.507 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.0 mm-40 -138.8 166.97 23.03 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.534 0.683 . . . . 1.0 110.498 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 42.96 -176.99 0.01 OUTLIER Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.953 -1.476 . . . . 1.0 111.007 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.36 152.9 35.99 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.379 -0.6 . . . . 1.0 109.379 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 39.6 m95 -125.25 168.09 13.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.697 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 1.9 p -141.83 99.27 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.733 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.57 141.08 56.93 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 120.275 -0.57 . . . . 1.0 110.789 -178.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -118.51 131.63 56.23 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.843 -0.617 . . . . 1.0 109.703 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -46.93 -49.17 20.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.033 -0.53 . . . . 1.0 111.679 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.418 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.2 175.63 6.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.318 0.58 . . . . 1.0 110.383 -178.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.7 p -82.7 170.68 14.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.437 -0.801 . . . . 1.0 110.355 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 138' ' ' ASN . 41.1 t-20 66.22 17.34 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.261 -179.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 37.13 79.25 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.0 111.751 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 28.2 ttm180 -149.59 39.24 0.79 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.026 0.441 . . . . 1.0 110.508 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.93 -143.11 3.61 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.374 -0.691 . . . . 1.0 111.374 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -74.41 168.45 19.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.985 0.421 . . . . 1.0 110.24 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.462 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 6.6 pt20 -150.57 141.35 22.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.77 -0.65 . . . . 1.0 111.449 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . 0.425 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.8 m-85 -131.02 139.33 49.95 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.494 -0.928 . . . . 1.0 108.494 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 49.4 tp -92.67 126.47 37.77 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.634 0.584 . . . . 1.0 111.617 -179.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.577 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.7 mm? -114.83 102.71 10.25 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.437 -0.802 . . . . 1.0 109.608 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 3.6 mtm -81.99 164.82 46.68 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.451 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.62 119.28 6.44 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 121.968 1.779 . . . . 1.0 111.312 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.65 -153.17 21.22 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.536 -1.026 . . . . 1.0 110.536 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -128.36 132.63 48.56 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.755 0.312 . . . . 1.0 110.387 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.466 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 33.5 m-85 -123.26 132.07 53.89 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.003 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -117.03 -6.72 11.39 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -153.05 163.96 38.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.34 0.591 . . . . 1.0 110.03 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.443 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.4 p90 -76.76 -20.55 56.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.061 -0.972 . . . . 1.0 112.239 -178.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -68.82 -19.64 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 1.0 111.065 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.76 -49.56 57.76 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.934 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.443 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 17.3 p90 -96.84 22.54 8.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.317 -0.402 . . . . 1.0 110.713 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 75.56 0.21 Allowed Glycine 0 CA--C 1.517 0.195 0 N-CA-C 111.223 -0.751 . . . . 1.0 111.223 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -118.37 147.05 43.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 110.26 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.9 t -78.21 -10.09 59.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.097 178.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.544 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 8.1 t-20 -171.99 -169.15 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.583 -0.447 . . . . 1.0 110.259 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.544 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -110.28 -18.86 13.18 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.375 -0.375 . . . . 1.0 110.659 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 162' ' ' ALA . 20.0 ptp180 -37.22 123.69 0.93 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.309 0.576 . . . . 1.0 111.695 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 22.0 t -127.32 159.84 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.02 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.435 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -135.27 -35.7 0.23 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.689 -0.687 . . . . 1.0 111.543 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.6 m -158.88 -168.36 2.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.702 0.287 . . . . 1.0 110.278 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 pp -173.36 134.24 0.52 Allowed 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.472 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.69 HH12 ' NH1' ' A' ' 59' ' ' ARG . 1.8 ttm180 -129.32 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.409 0.623 . . . . 1.0 109.643 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 10.4 ptt180 -80.27 153.44 28.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.841 -1.072 . . . . 1.0 110.075 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 47.9 t -90.33 86.03 2.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.861 0.363 . . . . 1.0 111.851 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.0 mp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.264 179.099 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.558 0 N-CA-C 110.39 -1.084 . . . . 1.0 110.39 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -171.7 105.06 0.2 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.021 -0.271 . . . . 1.0 110.398 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 167.8 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.111 0.481 . . . . 1.0 111.399 -178.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.5 m -124.87 121.4 34.4 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.029 -1.1 . . . . 1.0 108.029 177.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -106.39 133.82 50.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.015 -0.993 . . . . 1.0 110.364 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -115.8 126.85 54.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.539 -0.755 . . . . 1.0 111.256 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -53.88 -28.07 34.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 1.0 110.515 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -119.45 151.4 38.61 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.433 0.635 . . . . 1.0 110.621 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.8 ptt-85 -56.87 -175.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 1.0 110.847 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.3 25.54 0.78 Allowed Glycine 0 N--CA 1.462 0.397 0 N-CA-C 110.912 -0.875 . . . . 1.0 110.912 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 51.61 67.16 1.0 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.198 -0.297 . . . . 1.0 110.198 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -128.86 -157.91 0.85 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.085 0.469 . . . . 1.0 110.555 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.59 -151.31 0.31 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.822 -0.911 . . . . 1.0 110.822 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -70.14 148.36 48.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.871 -0.332 . . . . 1.0 110.87 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -136.0 149.48 48.86 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.37 0.605 . . . . 1.0 110.374 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.4 t80 -143.95 142.45 30.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.255 -0.884 . . . . 1.0 110.014 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 70.5 tt0 -110.83 121.43 45.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.264 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -108.71 126.79 53.38 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.739 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.505 ' C ' ' HG ' ' A' ' 21' ' ' SER . 50.0 m -117.61 12.08 13.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.751 -0.659 . . . . 1.0 110.56 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.505 ' HG ' ' C ' ' A' ' 20' ' ' SER . 40.5 m -157.48 168.46 27.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.177 0.513 . . . . 1.0 110.447 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -58.51 140.7 53.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.054 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.71 148.99 49.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.966 -0.561 . . . . 1.0 110.338 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.6 p -118.79 -13.54 9.54 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.748 -0.66 . . . . 1.0 112.047 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -150.28 111.99 4.51 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.314 0.578 . . . . 1.0 109.773 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.3 mt -116.02 -0.55 12.73 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.402 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -53.16 -42.28 90.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.3 -179.775 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 34.3 Cg_exo -58.23 -34.91 99.04 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.03 1.82 . . . . 1.0 111.548 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -95.98 -52.82 3.89 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 121.037 -0.265 . . . . 1.0 111.072 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -118.57 127.41 53.59 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.976 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -95.06 -7.52 39.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.794 -0.639 . . . . 1.0 111.955 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -146.75 -60.46 0.29 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.418 0.525 . . . . 1.0 112.418 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 50.3 t 64.99 75.38 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 122.499 0.319 . . . . 1.0 110.158 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -92.01 4.33 53.29 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.305 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -156.9 157.58 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.969 0.414 . . . . 1.0 110.19 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.81 154.46 32.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.813 -0.631 . . . . 1.0 111.336 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -132.1 121.0 23.1 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.83 -0.804 . . . . 1.0 108.83 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -107.21 114.82 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.63 0.582 . . . . 1.0 110.424 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.37 -44.37 45.34 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.101 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.1 p -160.91 159.07 29.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 109.38 -0.6 . . . . 1.0 109.38 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.14 175.79 50.8 Favored Glycine 0 C--N 1.315 -0.586 0 N-CA-C 111.026 -0.83 . . . . 1.0 111.026 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 85.6 m -113.46 136.99 52.19 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.0 -0.741 . . . . 1.0 109.0 178.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.453 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 58.2 m95 -124.66 142.42 51.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.247 0.546 . . . . 1.0 111.415 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.459 ' SD ' ' C ' ' A' ' 56' ' ' TYR . 10.4 tpp -115.91 129.01 56.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.331 -0.85 . . . . 1.0 109.164 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.97 130.17 55.07 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.498 ' HH ' HH11 ' A' ' 80' ' ' ARG . 51.7 m-85 -104.81 131.87 51.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.674 0.75 . . . . 1.0 111.17 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.423 ' C ' ' OE1' ' A' ' 47' ' ' GLU . 0.4 OUTLIER -60.33 -33.82 72.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 1.0 110.808 -178.159 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.87 ' NE2' ' H ' ' A' ' 52' ' ' SER . 3.1 pp0? -108.54 154.64 41.46 Favored Pre-proline 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 1.0 108.861 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.463 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 20.9 Cg_endo -56.38 148.76 60.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 121.372 1.381 . . . . 1.0 111.621 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.823 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.3 OUTLIER 74.83 -123.92 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.812 -0.81 . . . . 1.0 108.812 -178.685 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -150.83 74.65 1.17 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.198 0.523 . . . . 1.0 110.695 179.061 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.87 ' H ' ' NE2' ' A' ' 48' ' ' GLN . 1.4 t -142.72 20.59 2.0 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.764 -0.653 . . . . 1.0 111.893 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -139.2 -159.53 8.03 Favored Glycine 0 N--CA 1.46 0.282 0 N-CA-C 111.181 -0.768 . . . . 1.0 111.181 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.413 ' H ' ' HG2' ' A' ' 47' ' ' GLU . 46.5 tp -64.77 146.47 54.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.818 -0.353 . . . . 1.0 110.499 -178.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -122.73 150.5 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 1.0 110.971 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.459 ' C ' ' SD ' ' A' ' 44' ' ' MET . 63.7 m-85 -125.61 123.66 39.5 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.569 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.629 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 46.1 t80 -83.94 121.73 27.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.237 0.541 . . . . 1.0 110.201 -178.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.5 mp -117.22 143.46 45.85 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.586 -0.734 . . . . 1.0 109.972 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.436 ' O ' ' C ' ' A' ' 60' ' ' ARG . 28.6 mtt85 -129.67 153.67 47.9 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.58 -0.736 . . . . 1.0 109.398 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 59' ' ' ARG . 17.0 ptm180 -32.69 127.58 0.27 Allowed 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.294 0.371 . . . . 1.0 111.431 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 151.4 -175.47 30.26 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.814 -0.914 . . . . 1.0 110.814 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.8 p-10 -116.2 134.2 55.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.085 0.469 . . . . 1.0 110.696 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -127.57 114.56 17.56 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.937 -0.574 . . . . 1.0 109.792 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.414 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.58 -3.78 52.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.152 -0.477 . . . . 1.0 111.605 -179.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -147.64 142.74 27.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.979 -0.749 . . . . 1.0 108.979 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.566 ' H ' ' HD1' ' A' ' 66' ' ' HIS . 11.6 p-80 -62.11 -46.06 90.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.119 0.485 . . . . 1.0 111.116 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -49.22 -8.97 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.945 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.537 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.4 mm-40 -82.84 -35.32 26.43 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.488 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -91.49 19.73 5.94 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 118.956 -0.545 . . . . 1.0 111.571 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.488 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 61.6 mtp 87.38 8.33 0.19 Allowed 'General case' 0 N--CA 1.461 0.111 0 O-C-N 124.22 0.95 . . . . 1.0 109.368 -178.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.813 0 N-CA-C 110.238 -1.145 . . . . 1.0 110.238 178.405 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 t . . . . . 0 CA--C 1.519 -0.236 0 N-CA-C 108.836 -0.802 . . . . 1.0 108.836 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -120.32 1.95 10.78 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.796 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 6.1 p -161.44 160.69 29.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.404 0.621 . . . . 1.0 110.808 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.0 p -154.32 146.33 23.6 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.177 -0.919 . . . . 1.0 110.034 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.498 HH11 ' HH ' ' A' ' 46' ' ' TYR . 0.7 OUTLIER -127.86 146.05 50.74 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.889 -0.411 . . . . 1.0 109.889 179.653 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 31.1 tp -96.96 134.79 39.86 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.815 -0.809 . . . . 1.0 108.815 177.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.3 mt -96.24 111.26 55.99 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.485 -0.561 . . . . 1.0 109.485 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.501 1.948 0 C-N-CA 121.872 1.715 . . . . 1.0 113.285 -179.283 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 0 CA--C 1.522 -0.128 0 N-CA-C 109.667 -0.494 . . . . 1.0 109.667 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -130.28 104.73 7.45 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 121.124 -0.23 . . . . 1.0 110.999 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -137.06 141.15 42.41 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.804 -0.359 . . . . 1.0 110.951 179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.9 tt -150.63 144.25 17.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.157 -0.474 . . . . 1.0 111.272 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -120.11 97.85 5.79 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.948 -0.569 . . . . 1.0 111.626 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 28.6 mt -78.54 142.67 37.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.966 -0.561 . . . . 1.0 109.936 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -121.18 138.93 53.98 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.339 0.59 . . . . 1.0 111.801 -178.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.524 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 8.9 tp10 -63.1 -37.72 88.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.649 -0.705 . . . . 1.0 110.829 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -128.2 169.27 14.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.364 0.602 . . . . 1.0 111.075 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 114.928 -1.033 . . . . 1.0 110.717 179.723 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.954 0 N-CA-C 111.189 -0.764 . . . . 1.0 111.189 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 67.9 tp60 -68.16 142.91 55.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 1.0 110.878 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.9 ptm -133.27 155.25 49.73 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.612 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.475 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 11.8 tt -147.97 142.0 19.25 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 N-CA-C 109.817 -0.438 . . . . 1.0 109.817 178.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -112.8 142.39 45.5 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.809 0.814 . . . . 1.0 110.811 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.12 157.05 40.73 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.441 -1.254 . . . . 1.0 110.506 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.6 p -142.27 19.11 2.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.3 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -164.13 -167.18 1.27 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.938 0.399 . . . . 1.0 110.87 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 51.2 p30 -78.9 148.4 32.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.262 0.553 . . . . 1.0 111.021 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.434 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.8 t -135.65 93.98 3.02 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.592 -0.731 . . . . 1.0 109.759 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -65.31 -27.68 68.78 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.618 -0.433 . . . . 1.0 111.274 -179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' A' ' 111' ' ' CYS . 28.2 p -139.28 95.67 2.97 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.415 0.626 . . . . 1.0 110.849 -179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 114' ' ' ASP . 19.3 tp -62.47 -41.22 98.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.285 -0.87 . . . . 1.0 110.121 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.54 HE21 HD21 ' A' ' 119' ' ' ASN . 27.8 mp0 -45.23 -11.96 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.327 -0.397 . . . . 1.0 111.435 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.525 ' N ' ' O ' ' A' ' 112' ' ' LEU . 21.8 m-20 -95.07 -25.11 16.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.095 0.474 . . . . 1.0 110.73 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.511 ' HE ' ' C ' ' A' ' 114' ' ' ASP . 6.4 mmp_? -107.87 -41.73 4.9 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.785 -0.643 . . . . 1.0 111.937 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.475 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 2.3 t80 -123.54 122.24 37.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.217 0.532 . . . . 1.0 109.68 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.2 mtt-85 -61.64 -46.16 90.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.514 -0.766 . . . . 1.0 111.059 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.524 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 97.3 m-85 -58.05 139.67 54.12 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.691 -0.686 . . . . 1.0 109.616 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . 0.54 HD21 HE21 ' A' ' 113' ' ' GLN . 19.3 t-20 -100.89 4.14 42.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.886 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -135.11 141.41 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.193 0.52 . . . . 1.0 110.913 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.5 mm -122.94 117.25 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.658 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 123' ' ' SER . 27.2 m-70 -105.9 27.56 8.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.188 -0.46 . . . . 1.0 112.03 -178.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 151' ' ' TYR . 10.3 t 163.39 152.65 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 123.495 0.497 . . . . 1.0 109.818 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -163.58 158.09 20.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.476 -178.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.74 116.98 24.67 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 109.411 -0.588 . . . . 1.0 109.411 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 39.1 t -101.63 105.58 18.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 116.143 -0.481 . . . . 1.0 109.791 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.518 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.78 -45.1 21.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.725 179.633 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -156.99 149.94 23.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.745 -0.382 . . . . 1.0 111.043 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 70.07 79.57 0.32 Allowed Glycine 0 C--N 1.329 0.163 0 CA-C-N 116.198 -0.456 . . . . 1.0 112.384 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.431 ' C ' ' O ' ' A' ' 129' ' ' GLY . 45.7 p -32.17 149.44 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 121.219 0.533 . . . . 1.0 111.202 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.512 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 44.1 m95 -123.38 164.99 17.77 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.466 -0.788 . . . . 1.0 111.521 -178.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 29.0 t -131.88 133.99 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 178.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.47 142.22 39.17 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -120.54 136.82 54.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.084 0.24 . . . . 1.0 110.917 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -48.94 -44.93 41.09 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.474 -0.49 . . . . 1.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.406 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.7 178.01 5.67 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.321 0.582 . . . . 1.0 110.684 -178.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.2 m -82.52 171.71 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.523 -0.762 . . . . 1.0 111.022 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 62.78 20.43 12.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 1.0 110.18 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.442 ' CE2' ' OG ' ' A' ' 166' ' ' SER . 1.0 OUTLIER 35.59 78.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.067 -0.515 . . . . 1.0 111.644 179.056 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -148.3 38.58 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.02 0.438 . . . . 1.0 110.408 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.6 -137.67 2.52 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.13 -0.788 . . . . 1.0 111.13 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? -72.42 164.38 26.46 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.658 0.266 . . . . 1.0 110.439 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.629 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 5.7 pt20 -149.31 139.2 21.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.886 -0.597 . . . . 1.0 110.839 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -131.09 135.94 47.95 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.698 -0.852 . . . . 1.0 108.698 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.13 129.45 37.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.382 0.61 . . . . 1.0 109.649 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.611 HD23 ' N ' ' A' ' 146' ' ' LEU . 1.6 mm? -114.43 102.92 10.54 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.212 -1.033 . . . . 1.0 108.212 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -80.53 165.95 42.76 Favored Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 109.72 -0.474 . . . . 1.0 109.72 -179.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -60.53 122.99 12.15 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.624 1.55 . . . . 1.0 111.406 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.31 -154.14 23.78 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 -179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -126.46 133.4 51.22 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.893 0.378 . . . . 1.0 110.327 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.1 m-85 -122.94 128.25 50.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.549 -0.537 . . . . 1.0 109.549 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -114.08 -5.13 13.09 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 110.341 -0.244 . . . . 1.0 110.341 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -154.96 163.22 40.62 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.494 0.664 . . . . 1.0 110.513 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.551 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -75.02 -22.01 58.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.175 -0.92 . . . . 1.0 111.807 -178.582 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.23 -22.39 66.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.134 -0.485 . . . . 1.0 111.361 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . 0.498 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.2 t0 -47.59 -50.03 25.16 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.333 -178.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.463 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.3 p90 -99.59 19.32 16.0 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.029 0.442 . . . . 1.0 110.131 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.93 72.72 0.47 Allowed Glycine 0 CA--C 1.522 0.481 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.43 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.463 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.25 -171.66 2.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.689 0.757 . . . . 1.0 110.84 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.13 -35.69 3.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.696 -1.138 . . . . 1.0 112.089 -178.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.533 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 0.2 OUTLIER -146.58 -25.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.006 -0.278 . . . . 1.0 111.64 -178.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.533 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 97.96 -19.87 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 124.301 1.001 . . . . 1.0 110.255 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -42.15 116.29 0.8 Allowed 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 115.145 -0.934 . . . . 1.0 111.345 -178.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 60.8 t -123.3 124.41 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.393 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.409 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -103.42 -24.76 7.7 Favored Glycine 0 N--CA 1.462 0.407 0 N-CA-C 111.055 -0.818 . . . . 1.0 111.055 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.442 ' OG ' ' CE2' ' A' ' 139' ' ' TYR . 5.7 t -160.14 171.34 19.43 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.644 -0.422 . . . . 1.0 110.311 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 166' ' ' SER . 0.9 OUTLIER -157.92 144.29 17.58 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.524 . . . . 1.0 111.699 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -133.42 162.35 32.1 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.604 -0.517 . . . . 1.0 109.604 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.406 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.42 153.9 17.57 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.446 -0.797 . . . . 1.0 109.261 178.922 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.407 ' CG2' ' OG ' ' A' ' 130' ' ' SER . 48.1 t -89.7 82.05 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.969 -0.457 . . . . 1.0 111.788 -178.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.2 mp . . . . . 0 N--CA 1.471 0.576 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.166 179.734 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.621 0 N-CA-C 110.609 -0.997 . . . . 1.0 110.609 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -171.76 105.81 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.856 -0.338 . . . . 1.0 110.589 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.18 168.8 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-O 120.908 0.385 . . . . 1.0 110.942 -178.841 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.3 m -126.28 120.73 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.263 -1.014 . . . . 1.0 108.263 176.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -105.4 132.91 50.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.1 -0.954 . . . . 1.0 110.242 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -115.58 126.55 54.35 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.224 -0.898 . . . . 1.0 111.201 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.13 -31.66 31.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.487 -0.779 . . . . 1.0 110.464 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -116.75 160.26 21.05 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.285 0.564 . . . . 1.0 110.486 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.414 ' C ' ' N ' ' A' ' 12' ' ' PHE . 11.2 ptm180 -63.87 -173.16 0.07 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.338 -0.846 . . . . 1.0 110.702 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.43 24.66 0.4 Allowed Glycine 0 N--CA 1.459 0.224 0 N-CA-C 110.732 -0.947 . . . . 1.0 110.732 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 8.3 m-85 50.43 70.09 0.55 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.527 -0.336 . . . . 1.0 110.275 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -131.83 -155.37 0.68 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.045 0.45 . . . . 1.0 110.309 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.64 -150.06 0.16 Allowed Glycine 0 CA--C 1.526 0.764 0 N-CA-C 111.036 -0.826 . . . . 1.0 111.036 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -69.36 145.92 52.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.774 0.321 . . . . 1.0 110.682 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -135.86 149.86 49.18 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.179 0.514 . . . . 1.0 110.296 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.602 ' HH ' ' CE1' ' A' ' 23' ' ' HIS . 6.1 t80 -144.32 141.57 29.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.36 -0.837 . . . . 1.0 110.204 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 33.0 tt0 -110.53 122.63 48.21 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.304 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -109.89 126.23 53.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.638 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.9 p -117.99 9.55 12.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.934 -0.576 . . . . 1.0 110.475 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.5 p -154.91 167.1 31.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.713 -178.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -58.08 137.45 56.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.557 -0.747 . . . . 1.0 111.512 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.602 ' CE1' ' HH ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -133.37 141.47 47.91 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.685 -0.689 . . . . 1.0 110.156 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.9 p -108.92 -14.49 14.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.679 -0.691 . . . . 1.0 111.841 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -152.6 118.16 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.103 0.478 . . . . 1.0 110.602 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.0 mt -117.46 0.84 12.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.582 -0.736 . . . . 1.0 110.266 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.575 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 55.5 mt-30 -48.8 -51.4 54.44 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.124 -0.489 . . . . 1.0 110.759 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.575 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.8 Cg_endo -55.93 -32.94 87.46 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 121.544 1.496 . . . . 1.0 112.33 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -94.27 -52.02 4.54 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.296 -0.562 . . . . 1.0 110.644 -178.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -117.28 127.73 54.37 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.0 110.551 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.1 t -95.51 -10.23 30.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.527 -0.761 . . . . 1.0 111.631 -179.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -147.12 -55.32 0.24 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.392 -0.367 . . . . 1.0 111.824 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 t 59.96 75.48 0.4 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -92.88 4.12 54.46 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.339 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.543 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -154.69 155.44 34.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.906 0.384 . . . . 1.0 110.036 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.2 154.53 35.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.153 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -134.46 122.41 22.45 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 108.554 -0.906 . . . . 1.0 108.554 178.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.9 t -107.61 117.39 53.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.276 0.56 . . . . 1.0 109.869 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -79.81 -43.33 22.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.395 -0.821 . . . . 1.0 110.76 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 t -161.64 155.91 22.43 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.48 173.87 50.0 Favored Glycine 0 C--N 1.317 -0.523 0 N-CA-C 110.97 -0.852 . . . . 1.0 110.97 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.2 m -110.28 140.77 44.1 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.456 -0.572 . . . . 1.0 109.456 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.418 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 56.1 m95 -128.3 155.76 44.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.322 0.582 . . . . 1.0 111.063 -179.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.511 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 15.7 ttm -131.17 131.28 43.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.827 -0.805 . . . . 1.0 108.827 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -108.62 131.1 55.22 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 108.948 -0.76 . . . . 1.0 108.948 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -107.37 131.54 54.14 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.725 0.774 . . . . 1.0 110.667 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.601 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.1 pt-20 -58.35 -36.35 73.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.917 -1.038 . . . . 1.0 110.974 -178.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.6 mt-30 -109.88 152.81 43.19 Favored Pre-proline 0 C--O 1.232 0.153 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.47 -178.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 157.28 54.02 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.378 2.052 . . . . 1.0 112.591 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.669 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 64.86 36.57 7.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.871 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 50.83 75.1 0.2 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.051 -0.977 . . . . 1.0 111.038 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.4 m -142.61 154.27 44.25 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.884 0.373 . . . . 1.0 110.139 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.2 -148.13 22.06 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.854 -0.688 . . . . 1.0 111.728 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.601 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.8 tp -77.9 146.81 35.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.466 -0.367 . . . . 1.0 110.597 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.511 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 18.0 pt20 -122.86 153.72 39.24 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.065 -0.346 . . . . 1.0 110.065 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.457 ' CE1' ' O ' ' A' ' 70' ' ' MET . 20.6 m-85 -129.38 129.67 45.05 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.923 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -82.53 121.22 26.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.389 0.614 . . . . 1.0 109.814 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -109.94 136.75 48.73 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.56 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 60' ' ' ARG . 23.0 mtm-85 -129.05 154.89 46.22 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.485 -0.779 . . . . 1.0 109.934 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 78.8 ttt-85 -38.29 125.9 1.33 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.668 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.0 -177.84 32.85 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.625 -0.99 . . . . 1.0 110.625 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.1 p-10 -116.16 125.38 52.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.151 0.501 . . . . 1.0 110.517 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -119.23 112.49 19.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 1.0 109.35 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.428 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.46 -2.43 56.27 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.923 -0.58 . . . . 1.0 111.762 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -149.48 131.86 15.63 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.201 -0.666 . . . . 1.0 109.201 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.66 ' CE1' HE21 ' A' ' 67' ' ' GLN . 5.4 p80 -53.67 -37.68 63.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.974 0.416 . . . . 1.0 110.963 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.66 HE21 ' CE1' ' A' ' 66' ' ' HIS . 98.1 mm-40 -56.4 -7.89 0.45 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.948 -0.569 . . . . 1.0 110.537 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.6 mm-40 -82.31 -32.91 29.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 120.546 -0.461 . . . . 1.0 111.107 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.2 p90 -96.21 13.47 27.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.868 -0.333 . . . . 1.0 110.586 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.457 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 58.3 mtt 74.77 31.61 0.91 Allowed 'General case' 0 C--O 1.225 -0.211 0 O-C-N 124.481 1.113 . . . . 1.0 110.306 -179.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.333 0.404 0 C-N-CA 120.448 -0.882 . . . . 1.0 111.877 -179.176 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.7 t . . . . . 0 CA--C 1.517 -0.31 0 N-CA-C 109.585 -0.524 . . . . 1.0 109.585 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -128.38 4.58 5.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.241 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.4 p -163.38 162.66 25.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.051 0.453 . . . . 1.0 110.851 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 19.2 p -153.66 144.85 22.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.752 -0.658 . . . . 1.0 109.744 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -127.37 150.08 49.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 17.2 tp -95.37 125.84 40.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.461 -1.311 . . . . 1.0 107.461 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 22.9 mt -78.43 114.75 45.64 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 120.539 -0.464 . . . . 1.0 110.812 -178.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo . . . . . 0 N--CA 1.49 1.274 0 C-N-CA 122.017 1.811 . . . . 1.0 111.755 179.804 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 m . . . . . 0 CA--C 1.515 -0.373 0 N-CA-C 109.967 -0.383 . . . . 1.0 109.967 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -124.31 99.51 6.25 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.898 -0.321 . . . . 1.0 111.736 -179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -135.4 137.67 42.52 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 120.558 -0.457 . . . . 1.0 110.359 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.8 tt -149.18 145.48 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.604 -0.271 . . . . 1.0 111.026 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.571 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.4 mtp180 -124.39 98.83 5.92 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.051 -0.522 . . . . 1.0 111.633 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 20.5 mt -79.01 137.79 37.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.873 -0.603 . . . . 1.0 110.878 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 44.6 m-85 -116.5 135.29 53.95 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.638 -0.71 . . . . 1.0 110.711 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.527 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 1.0 OUTLIER -53.97 -67.01 0.3 Allowed 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.516 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 123' ' ' SER . 77.0 mtp85 -96.03 169.45 9.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.465 -179.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 . . . . . 0 C--N 1.332 -0.168 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.495 179.528 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.636 0 N-CA-C 111.013 -0.835 . . . . 1.0 111.013 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.55 147.95 13.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.356 . . . . 1.0 110.348 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.589 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 8.1 ttp -130.88 151.17 51.6 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.352 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.447 ' N ' ' HG2' ' A' ' 102' ' ' MET . 10.7 tt -146.42 141.06 20.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 177.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.41 143.96 42.66 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.677 0.751 . . . . 1.0 110.506 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -130.52 156.49 44.72 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 114.742 -1.117 . . . . 1.0 110.678 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.2 p -143.93 32.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.731 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -171.14 -166.71 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.557 178.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 51.8 t0 -81.78 148.11 29.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.503 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.494 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.7 t -136.96 98.61 3.8 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.165 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.77 -23.84 64.36 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.878 0.371 . . . . 1.0 111.554 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.441 ' SG ' ' OD2' ' A' ' 114' ' ' ASP . 6.2 p -144.48 88.86 1.95 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.388 -179.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.591 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.9 tp -60.65 -40.91 93.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.368 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.547 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 17.4 mp0 -43.85 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.999 -0.546 . . . . 1.0 112.072 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.591 ' H ' ' C ' ' A' ' 112' ' ' LEU . 95.9 m-20 -94.78 -22.08 18.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.191 0.519 . . . . 1.0 110.42 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.5 mmt180 -107.93 -36.28 6.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.346 -0.843 . . . . 1.0 112.448 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.677 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.55 136.52 54.95 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 122.47 1.129 . . . . 1.0 110.812 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 15.0 mmp_? -73.43 -71.16 0.33 Allowed 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.609 -1.307 . . . . 1.0 110.669 -178.292 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.633 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.9 m-85 -34.2 147.88 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.295 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -106.98 8.19 30.31 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.758 0.313 . . . . 1.0 110.949 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -138.0 139.1 39.48 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.307 0.575 . . . . 1.0 111.118 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.402 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 40.7 mm -120.96 119.64 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 115.438 -0.801 . . . . 1.0 109.029 177.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -110.02 20.86 17.49 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.433 -178.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.2 p 170.94 150.76 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.089 0.471 . . . . 1.0 109.859 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.11 157.26 23.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.659 -0.7 . . . . 1.0 110.313 -178.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.57 112.95 18.62 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.349 -0.612 . . . . 1.0 109.349 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.34 105.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.048 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.524 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.6 OUTLIER -78.36 -43.04 28.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.981 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 26.0 tp10 -160.54 158.82 29.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.913 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.521 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 68.23 76.25 0.44 Allowed Glycine 0 CA--C 1.509 -0.324 0 CA-C-N 115.796 -0.638 . . . . 1.0 112.359 178.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 129' ' ' GLY . 30.8 t -31.71 149.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.074 0.464 . . . . 1.0 111.021 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.521 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 33.0 m95 -124.42 169.14 12.14 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.72 -0.673 . . . . 1.0 110.835 -178.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 25.1 t -138.2 103.52 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.364 -0.38 . . . . 1.0 109.995 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.7 mt -77.38 141.77 39.65 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.787 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -120.54 133.82 55.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.618 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.55 ' CD ' HH21 ' A' ' 142' ' ' ARG . 48.0 tp10 -44.91 -49.95 10.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.453 -0.34 . . . . 1.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.77 171.06 10.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.411 0.624 . . . . 1.0 110.186 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.6 m -75.76 179.47 5.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.086 -0.961 . . . . 1.0 111.12 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 139' ' ' TYR . 10.3 m120 58.16 21.99 8.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.42 -1.264 . . . . 1.0 109.555 -179.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.445 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.4 m-85 33.82 77.67 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.21 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -148.75 44.1 1.0 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.245 0.545 . . . . 1.0 109.859 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.44 -135.15 2.1 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 111.423 -0.671 . . . . 1.0 111.423 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . 0.606 HH12 ' CG2' ' A' ' 160' ' ' THR . 84.0 mtm180 -84.19 166.59 17.44 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.936 -0.394 . . . . 1.0 109.936 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.75 137.4 26.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.912 -0.586 . . . . 1.0 110.841 -179.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -128.69 145.01 51.28 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.109 -0.7 . . . . 1.0 109.109 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.449 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 39.5 tp -94.28 122.56 36.95 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.479 0.487 . . . . 1.0 111.937 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . 0.594 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.1 mm? -112.87 100.29 8.54 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.52 -0.764 . . . . 1.0 109.483 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 163.42 62.44 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 114.914 -1.039 . . . . 1.0 109.904 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.67 107.23 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.301 2.001 . . . . 1.0 111.532 179.104 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -175.73 -153.04 9.95 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.598 -1.001 . . . . 1.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.453 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.0 p-10 -124.8 125.82 44.63 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.054 0.454 . . . . 1.0 110.61 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.4 m-85 -117.84 129.59 55.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.953 -0.567 . . . . 1.0 109.83 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -115.66 -4.24 12.22 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.809 0.338 . . . . 1.0 110.134 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -155.54 161.62 40.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.618 0.723 . . . . 1.0 110.148 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.423 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.8 p90 -75.02 -19.2 60.17 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.654 -1.157 . . . . 1.0 112.227 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -70.05 -19.36 63.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.279 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -50.62 -49.14 57.44 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.048 -179.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.423 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 19.4 p90 -96.81 22.45 8.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.483 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.77 75.92 0.2 Allowed Glycine 0 CA--C 1.521 0.457 0 N-CA-C 111.326 -0.71 . . . . 1.0 111.326 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -122.0 145.52 48.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.06 0.457 . . . . 1.0 110.327 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 160' ' ' THR . . . . . 0.606 ' CG2' HH12 ' A' ' 142' ' ' ARG . 14.7 t -74.15 -15.06 61.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.144 -0.934 . . . . 1.0 110.028 177.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.553 ' N ' HD21 ' A' ' 161' ' ' ASN . 0.0 OUTLIER -166.44 -167.4 1.01 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.132 0.492 . . . . 1.0 110.308 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 121' ' ' ILE . . . -109.37 -15.9 14.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.869 -0.605 . . . . 1.0 110.264 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -37.74 121.97 0.94 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.023 0.439 . . . . 1.0 111.889 -178.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 24.7 t -125.39 158.68 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.438 178.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -136.23 -36.77 0.19 Allowed Glycine 0 C--N 1.334 0.431 0 N-CA-C 111.461 -0.656 . . . . 1.0 111.461 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.4 m -156.77 -170.47 3.32 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.046 -0.353 . . . . 1.0 110.046 -179.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 pp -174.74 138.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.492 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -132.33 162.67 30.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.76 146.24 23.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.076 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 42.2 t -79.22 84.62 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.186 -0.461 . . . . 1.0 111.506 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.9 mp . . . . . 0 N--CA 1.464 0.256 0 CA-C-O 121.076 0.465 . . . . 1.0 109.972 178.953 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.772 0 N-CA-C 110.371 -1.092 . . . . 1.0 110.371 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -175.86 109.03 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.636 -0.426 . . . . 1.0 110.366 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.06 169.21 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.952 0.406 . . . . 1.0 110.833 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 29.9 m -127.89 119.72 26.18 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.203 -1.036 . . . . 1.0 108.203 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.8 mt -105.55 133.14 50.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.68 -1.145 . . . . 1.0 109.819 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -115.1 130.09 56.84 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.623 -0.717 . . . . 1.0 111.644 -178.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.478 ' O ' ' O ' ' A' ' 32' ' ' ARG . 80.8 tt0 -54.9 -24.44 23.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.402 -0.817 . . . . 1.0 110.459 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -125.39 161.06 27.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.284 0.564 . . . . 1.0 110.004 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -65.28 -175.33 0.22 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.311 -0.859 . . . . 1.0 110.929 -177.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.36 29.31 1.69 Allowed Glycine 0 C--N 1.335 0.482 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 48.36 68.03 0.75 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.489 -0.355 . . . . 1.0 110.288 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -129.78 -158.5 0.89 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.966 0.412 . . . . 1.0 110.454 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.48 -148.66 0.77 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.861 -0.895 . . . . 1.0 110.861 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.11 148.51 45.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.767 0.318 . . . . 1.0 110.463 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.7 146.84 48.16 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.381 0.61 . . . . 1.0 110.256 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.672 ' HH ' ' CE1' ' A' ' 23' ' ' HIS . 5.8 t80 -142.26 142.41 32.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.107 -0.951 . . . . 1.0 109.76 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.521 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 75.1 tt0 -111.7 123.48 50.33 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.229 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.6 126.54 54.57 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.306 -0.406 . . . . 1.0 110.67 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.3 p -118.17 11.06 13.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.861 -0.609 . . . . 1.0 110.425 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.6 p -156.45 169.36 24.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.579 -178.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -58.94 136.09 57.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.786 -0.643 . . . . 1.0 111.104 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.672 ' CE1' ' HH ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -132.39 146.53 52.03 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.676 -0.693 . . . . 1.0 110.423 179.832 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -117.52 -19.98 9.22 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.478 -0.783 . . . . 1.0 112.774 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -141.29 106.28 4.96 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.461 0.648 . . . . 1.0 109.652 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 mt -109.62 -3.38 16.9 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.171 -0.922 . . . . 1.0 110.058 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 1.4 mt-30 -52.23 -51.11 75.09 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.921 -0.581 . . . . 1.0 110.735 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.0 Cg_endo -56.04 -35.08 94.21 Favored 'Trans proline' 0 N--CA 1.487 1.127 0 C-N-CA 121.22 1.28 . . . . 1.0 112.759 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -90.79 -40.97 11.49 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.314 -0.555 . . . . 1.0 111.027 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.4 mt -126.14 127.76 46.25 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.423 -0.808 . . . . 1.0 111.284 -178.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 t -90.36 -14.15 33.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.191 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' GLU . 44.3 ttm180 -175.64 120.62 0.18 Allowed 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 108.89 -0.781 . . . . 1.0 108.89 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.5 t -100.22 106.36 18.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 1.0 110.258 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -101.59 -5.17 25.45 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.521 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.449 ' OG ' ' C ' ' A' ' 64' ' ' ALA . 71.9 m -155.74 156.99 35.83 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.977 0.417 . . . . 1.0 110.54 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.56 155.48 37.48 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.949 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -133.99 123.81 25.22 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.71 -0.848 . . . . 1.0 108.71 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.8 t -109.0 134.71 50.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.098 -0.704 . . . . 1.0 109.098 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -97.42 -42.83 7.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.505 -0.771 . . . . 1.0 110.51 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 m -161.45 160.46 29.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.426 -0.583 . . . . 1.0 109.426 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.51 176.26 48.73 Favored Glycine 0 C--N 1.316 -0.538 0 N-CA-C 111.085 -0.806 . . . . 1.0 111.085 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.8 m -112.4 140.96 46.69 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.884 -0.784 . . . . 1.0 108.884 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.451 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 48.2 m95 -127.42 150.44 49.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.63 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -124.37 130.05 51.8 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.179 -0.674 . . . . 1.0 109.179 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.78 131.71 54.81 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.673 -0.862 . . . . 1.0 108.673 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -106.19 131.45 53.43 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.374 0.607 . . . . 1.0 111.279 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.634 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -56.04 -34.8 66.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.398 -0.819 . . . . 1.0 110.367 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -104.82 153.64 39.17 Favored Pre-proline 0 C--N 1.327 -0.41 0 O-C-N 121.945 -0.472 . . . . 1.0 109.918 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -55.68 150.84 42.23 Favored 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 121.363 1.375 . . . . 1.0 110.873 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.804 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.4 OUTLIER 79.68 -122.95 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.735 0.814 . . . . 1.0 109.115 -178.82 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.525 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 15.3 m-85 -138.73 78.42 1.68 Allowed 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.017 -0.538 . . . . 1.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.0 m -152.3 163.53 39.26 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.738 -0.467 . . . . 1.0 109.738 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.04 -153.16 33.81 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 115.627 -0.715 . . . . 1.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.634 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.3 tp -77.73 144.47 37.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.343 -0.429 . . . . 1.0 109.987 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -121.41 154.17 36.87 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.691 0.282 . . . . 1.0 110.261 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.468 ' CE1' ' O ' ' A' ' 70' ' ' MET . 36.2 m-85 -127.04 129.56 48.27 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.113 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -81.64 119.42 23.79 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.689 -0.687 . . . . 1.0 109.704 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -111.36 134.42 52.96 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.9 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.4 ' O ' ' C ' ' A' ' 60' ' ' ARG . 18.3 mtm-85 -129.52 154.84 46.63 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.301 -0.863 . . . . 1.0 109.931 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.4 ' C ' ' O ' ' A' ' 59' ' ' ARG . 34.5 ptt180 -36.6 128.54 0.81 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.186 0.517 . . . . 1.0 111.696 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.18 179.92 29.88 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 111.117 -0.793 . . . . 1.0 111.117 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -115.79 124.1 49.9 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -118.92 113.5 21.12 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.131 -0.692 . . . . 1.0 109.131 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.449 ' C ' ' OG ' ' A' ' 35' ' ' SER . . . -93.99 3.42 55.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.015 0.436 . . . . 1.0 111.756 -179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 67.3 m-20 -152.14 140.68 20.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.77 -0.826 . . . . 1.0 108.77 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.582 ' H ' ' CD2' ' A' ' 66' ' ' HIS . 5.6 p80 -64.36 -40.66 96.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.974 0.416 . . . . 1.0 110.846 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.67 -8.17 0.14 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.899 -0.591 . . . . 1.0 110.248 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.5 mm-40 -80.93 -32.95 34.43 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 120.43 -0.508 . . . . 1.0 111.306 -178.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.41 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -96.1 13.33 27.56 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 121.05 -0.26 . . . . 1.0 110.69 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.468 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 54.9 mtt 76.26 30.01 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 124.278 0.986 . . . . 1.0 109.807 -179.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.762 0 C-N-CA 119.852 -1.166 . . . . 1.0 112.181 -179.052 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.467 0.379 0 CA-C-O 121.032 0.444 . . . . 1.0 110.106 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -137.39 14.25 3.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.743 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.3 p -162.04 161.13 28.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.218 0.532 . . . . 1.0 110.795 178.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.2 p -155.67 146.94 22.63 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.471 -0.786 . . . . 1.0 110.662 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.603 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.7 ptm180 -126.82 150.55 49.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.467 -0.568 . . . . 1.0 109.467 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.451 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt -102.41 124.92 48.85 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.911 -1.144 . . . . 1.0 107.911 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -84.2 116.58 65.62 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.146 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.501 1.96 0 C-N-CA 121.906 1.737 . . . . 1.0 113.229 179.676 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 CA--C 1.52 -0.203 0 N-CA-C 110.011 -0.366 . . . . 1.0 110.011 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -135.04 110.78 9.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 1.0 111.162 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.8 mtp180 -143.54 135.61 26.75 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.746 -0.381 . . . . 1.0 110.068 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.6 tt -146.59 146.59 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.622 -0.263 . . . . 1.0 110.614 -179.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -125.88 104.89 8.56 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.488 0.492 . . . . 1.0 111.424 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.4 mp -85.42 139.07 31.82 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.416 0.627 . . . . 1.0 111.87 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -116.44 136.25 53.15 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.798 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.51 ' OE1' ' CB ' ' A' ' 118' ' ' PHE . 78.2 mm-40 -55.72 -64.4 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.455 -0.793 . . . . 1.0 112.702 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -93.93 167.75 11.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.224 -177.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 . . . . . 0 CA--C 1.507 -0.697 0 CA-C-N 115.316 -0.857 . . . . 1.0 110.264 178.778 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.331 0 N-CA-C 110.175 -1.17 . . . . 1.0 110.175 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -60.83 145.99 47.94 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.607 -0.437 . . . . 1.0 109.837 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.2 ttp -131.08 145.55 52.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.324 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.1 tt -138.8 138.35 42.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -111.59 143.66 42.1 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.511 0.672 . . . . 1.0 110.66 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -129.15 153.15 47.97 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.586 -1.188 . . . . 1.0 110.537 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 58.4 p -143.73 10.67 1.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 1.0 111.01 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.978 ' O ' ' O ' ' A' ' 108' ' ' ASP . 6.3 pt-20 -161.16 83.19 0.64 Allowed 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 118.657 -0.687 . . . . 1.0 110.016 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.978 ' O ' ' O ' ' A' ' 107' ' ' GLU . 53.4 p-10 14.99 164.83 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.021 1.119 . . . . 1.0 114.021 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -149.62 109.27 4.02 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 120.144 -1.597 . . . . 1.0 110.021 178.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 m -64.07 -31.88 73.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.651 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 t -135.41 89.68 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.246 0.546 . . . . 1.0 110.1 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.602 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.8 tp -61.4 -42.47 98.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.378 -0.828 . . . . 1.0 109.829 -178.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -42.93 -8.31 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.864 -0.607 . . . . 1.0 112.028 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.602 ' H ' ' C ' ' A' ' 112' ' ' LEU . 47.0 t0 -97.2 -22.32 16.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.118 0.485 . . . . 1.0 110.66 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 112' ' ' LEU . 5.0 mmp_? -106.09 -37.21 6.68 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.183 0.809 . . . . 1.0 113.183 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.656 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.21 136.44 54.97 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.887 0.851 . . . . 1.0 110.128 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 118' ' ' PHE . 68.6 mtt85 -72.73 -69.61 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.632 -1.293 . . . . 1.0 110.371 -177.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.596 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -33.54 146.77 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.426 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -106.69 7.33 30.45 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.729 0.299 . . . . 1.0 111.326 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -138.41 139.74 39.04 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.11 0.481 . . . . 1.0 111.098 -178.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 40.0 mm -122.9 124.92 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.493 -0.776 . . . . 1.0 109.24 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.571 ' O ' ' OG ' ' A' ' 123' ' ' SER . 40.9 m-70 -116.0 21.62 13.62 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.543 -178.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.571 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 11.4 m 171.94 153.25 0.07 Allowed 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.161 0.505 . . . . 1.0 110.558 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 pp -165.72 157.7 14.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.321 -0.854 . . . . 1.0 110.788 -178.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.51 120.53 31.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.056 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 40.7 t -103.23 104.38 16.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 109.681 -0.488 . . . . 1.0 109.681 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.593 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.25 -40.68 36.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.231 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.476 ' O ' ' O ' ' A' ' 129' ' ' GLY . 36.9 mm-40 -133.81 162.01 33.16 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.835 0.826 . . . . 1.0 110.933 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 38.11 -165.51 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 CA-C-N 113.474 -1.694 . . . . 1.0 110.91 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.478 ' OG ' ' CG2' ' A' ' 170' ' ' VAL . 32.1 p -119.73 162.41 19.09 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -134.49 160.9 36.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.069 -0.514 . . . . 1.0 109.995 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 167' ' ' LEU . 46.6 t -132.09 139.39 50.36 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 N-CA-C 109.296 -0.631 . . . . 1.0 109.296 178.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 38.5 mt -111.11 141.73 44.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 110.184 -0.302 . . . . 1.0 110.184 179.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -117.41 132.84 56.5 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.26 0.35 . . . . 1.0 110.812 179.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -45.3 -36.85 4.33 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.371 -0.377 . . . . 1.0 110.725 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.418 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -137.01 175.46 9.59 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.289 0.566 . . . . 1.0 110.767 -179.34 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.1 p -81.75 172.48 13.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.496 -0.775 . . . . 1.0 110.678 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 64.5 19.19 11.72 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.833 -1.076 . . . . 1.0 109.839 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.511 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 13.2 m-85 35.8 79.36 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.919 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -148.97 38.89 0.83 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.393 0.616 . . . . 1.0 109.989 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.72 -140.8 3.21 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 -178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -74.64 165.44 25.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.918 -0.401 . . . . 1.0 109.918 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.52 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 1.3 pt20 -146.83 135.3 21.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.955 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . 0.432 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 7.2 m-85 -128.01 131.62 49.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 41.6 tp -87.72 126.37 34.94 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.29 0.567 . . . . 1.0 110.8 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 28.6 mt -115.17 108.51 16.7 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.039 -0.982 . . . . 1.0 109.694 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.603 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 3.3 mtm -88.43 163.23 37.11 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.699 -0.4 . . . . 1.0 110.247 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -52.84 124.32 15.15 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 121.608 1.538 . . . . 1.0 111.393 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 165.64 -155.27 26.49 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 110.565 -1.014 . . . . 1.0 110.565 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 68.3 t0 -127.38 130.42 49.36 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.803 0.335 . . . . 1.0 110.299 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.2 m-85 -121.36 129.26 52.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 1.0 109.952 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . 0.5 ' C ' ' OG ' ' A' ' 123' ' ' SER . 13.5 ptm180 -118.95 5.99 11.37 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.838 0.351 . . . . 1.0 110.199 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.666 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.4 ptm180 -163.76 160.02 22.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.463 0.649 . . . . 1.0 110.319 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.466 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.4 p90 -75.99 -19.63 58.54 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.697 -1.138 . . . . 1.0 112.613 -177.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.666 ' NE2' HH21 ' A' ' 153' ' ' ARG . 40.3 mt-30 -70.52 -17.81 62.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.843 0.354 . . . . 1.0 111.228 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -54.68 -46.81 74.12 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.388 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.466 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 14.3 p90 -97.45 20.47 11.62 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.266 -0.425 . . . . 1.0 110.738 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.82 75.32 0.23 Allowed Glycine 0 CA--C 1.521 0.439 0 N-CA-C 111.21 -0.756 . . . . 1.0 111.21 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.416 ' CB ' ' HE1' ' A' ' 157' ' ' TRP . . . -119.32 147.9 43.78 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 121.088 0.47 . . . . 1.0 110.336 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 160' ' ' THR . . . . . 0.411 ' O ' ' CG ' ' A' ' 161' ' ' ASN . 15.1 t -76.02 -20.46 57.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.894 -1.048 . . . . 1.0 110.106 177.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.411 ' CG ' ' O ' ' A' ' 160' ' ' THR . 13.1 m120 -163.56 -170.65 2.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.437 . . . . 1.0 110.503 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -108.27 -22.33 12.39 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.993 -0.548 . . . . 1.0 110.557 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -36.98 120.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.252 0.549 . . . . 1.0 111.651 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 21.3 t -124.23 162.12 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.714 -0.675 . . . . 1.0 109.794 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -141.94 -33.67 0.11 Allowed Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 14.5 p -159.67 169.35 23.91 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.656 -0.417 . . . . 1.0 110.853 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . 0.494 ' N ' ' CD2' ' A' ' 167' ' ' LEU . 1.3 pt? -153.67 146.82 24.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.849 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.511 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 11.3 ptp180 -135.81 147.99 48.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.403 0.62 . . . . 1.0 110.01 178.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.404 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -83.12 150.69 26.12 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.144 -0.934 . . . . 1.0 108.902 178.204 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . 0.478 ' CG2' ' OG ' ' A' ' 130' ' ' SER . 35.6 t -83.71 85.25 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 111.837 0.31 . . . . 1.0 111.837 -177.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp . . . . . 0 N--CA 1.468 0.426 0 N-CA-C 109.491 -0.559 . . . . 1.0 109.491 179.384 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.712 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -168.22 140.93 3.03 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.25 -0.278 . . . . 1.0 110.25 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -148.46 167.43 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-N 116.448 -0.342 . . . . 1.0 110.912 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 29.2 m -127.09 121.09 30.51 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 108.278 -1.008 . . . . 1.0 108.278 176.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.3 mt -105.77 133.09 51.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.871 -1.059 . . . . 1.0 110.097 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -115.92 126.52 54.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.361 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -53.75 -29.31 39.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.561 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -118.19 153.29 34.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.206 0.527 . . . . 1.0 110.365 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -58.38 -174.51 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.348 -0.842 . . . . 1.0 110.348 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.13 26.45 0.53 Allowed Glycine 0 N--CA 1.461 0.32 0 N-CA-C 110.798 -0.921 . . . . 1.0 110.798 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 50.29 68.98 0.67 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.395 -0.403 . . . . 1.0 110.304 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -129.35 -156.48 0.76 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.958 0.409 . . . . 1.0 110.485 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.41 -151.68 0.1 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.088 -0.805 . . . . 1.0 111.088 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.1 147.16 51.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.319 . . . . 1.0 110.689 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.8 p-80 -135.84 150.57 49.45 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.363 0.601 . . . . 1.0 110.25 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.573 ' HH ' ' CE1' ' A' ' 23' ' ' HIS . 6.1 t80 -145.22 142.13 29.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.22 -0.9 . . . . 1.0 110.203 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.54 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 31.0 tt0 -110.62 122.53 48.0 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.174 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . 0.453 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -110.41 127.05 54.91 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.535 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' SER . . . . . 0.404 ' O ' ' OG ' ' A' ' 20' ' ' SER . 9.0 t -119.41 13.6 12.71 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.392 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.8 m -158.29 172.31 18.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 1.0 110.692 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 50.0 p-10 -62.49 137.33 58.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.505 -0.771 . . . . 1.0 112.051 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.573 ' CE1' ' HH ' ' A' ' 17' ' ' TYR . 0.2 OUTLIER -133.08 143.49 49.36 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.463 -0.789 . . . . 1.0 110.404 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.4 p -112.36 -16.11 13.0 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.527 -0.76 . . . . 1.0 111.724 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -149.88 115.19 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 1.0 110.32 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.7 mt -117.89 0.51 11.93 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.334 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -52.92 -42.16 88.79 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.043 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 39.1 Cg_exo -59.26 -33.66 97.98 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.078 1.852 . . . . 1.0 111.556 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.94 -53.13 3.78 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.828 0.347 . . . . 1.0 111.012 -179.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -117.3 126.27 52.45 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.463 -178.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.6 t -93.93 -7.68 42.31 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.61 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.403 ' CG ' HD22 ' A' ' 34' ' ' ASN . 15.5 tpp180 -146.97 -60.65 0.29 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.436 -0.347 . . . . 1.0 111.923 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.3 t 64.98 75.81 0.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 O-C-N 123.269 0.356 . . . . 1.0 110.128 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . 0.403 HD22 ' CG ' ' A' ' 32' ' ' ARG . 15.6 m120 -93.1 3.34 55.89 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 116.33 -0.396 . . . . 1.0 111.32 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.9 p -155.41 157.35 36.91 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.959 -0.386 . . . . 1.0 109.959 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.75 155.32 34.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.006 -0.543 . . . . 1.0 111.059 -178.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.478 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 24.3 mtp85 -133.81 122.02 22.65 Favored 'General case' 0 C--O 1.21 -0.98 0 N-CA-C 108.371 -0.974 . . . . 1.0 108.371 178.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.94 114.63 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-O 121.259 0.552 . . . . 1.0 110.05 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -74.22 -44.89 51.38 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.002 -0.999 . . . . 1.0 110.695 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.1 t -162.68 155.13 19.01 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.643 -0.503 . . . . 1.0 109.643 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.89 175.97 50.06 Favored Glycine 0 C--N 1.317 -0.513 0 N-CA-C 110.566 -1.014 . . . . 1.0 110.566 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.1 m -111.94 138.1 49.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 54.9 m95 -126.04 146.29 49.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.619 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.462 ' SD ' ' C ' ' A' ' 56' ' ' TYR . 18.5 tpp -121.4 130.78 53.79 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 108.684 -0.858 . . . . 1.0 108.684 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mt -110.1 132.08 54.48 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.026 -0.731 . . . . 1.0 109.026 -179.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . 0.421 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 64.2 m-85 -108.12 130.96 55.08 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.634 0.731 . . . . 1.0 110.306 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.597 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.7 -34.61 71.5 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.006 -0.997 . . . . 1.0 110.596 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.411 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.0 mt-30 -109.5 153.04 43.04 Favored Pre-proline 0 C--N 1.333 -0.119 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.339 -178.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.29 160.24 35.93 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.308 2.005 . . . . 1.0 112.497 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.626 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.13 38.21 13.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.364 -0.835 . . . . 1.0 111.106 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.421 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.9 m-85 48.99 75.24 0.15 Allowed 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.899 -1.046 . . . . 1.0 111.02 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.6 m -143.91 154.2 43.09 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.021 0.439 . . . . 1.0 110.276 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.65 -150.02 22.15 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.978 -0.63 . . . . 1.0 111.947 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.597 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.8 tp -74.92 144.5 43.25 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.043 -0.579 . . . . 1.0 110.265 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -122.42 151.52 41.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.671 0.272 . . . . 1.0 110.433 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 8.4 m-85 -128.23 126.19 40.44 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.742 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -83.43 123.81 30.06 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.019 0.437 . . . . 1.0 109.886 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.8 mp -117.3 145.61 43.88 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.079 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtm-85 -131.98 157.11 44.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.401 -0.818 . . . . 1.0 109.767 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 59' ' ' ARG . 71.8 ttt180 -36.32 126.52 0.79 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.69 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.94 -177.89 32.78 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.348 -1.101 . . . . 1.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.478 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 68.6 m-20 -115.99 129.56 56.43 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.86 0.362 . . . . 1.0 110.209 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -123.27 112.86 18.14 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.439 -0.578 . . . . 1.0 109.439 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.6 -4.23 55.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.882 -0.599 . . . . 1.0 111.456 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 76.7 m-20 -147.72 139.33 23.87 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.18 -0.674 . . . . 1.0 109.18 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.499 ' C ' ' H ' ' A' ' 68' ' ' GLN . 15.2 p-80 -59.98 -41.14 91.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.093 0.473 . . . . 1.0 110.971 -179.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . 0.493 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 97.3 mm-40 -53.84 -7.6 0.13 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.67 179.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.499 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.0 mm-40 -83.96 -35.29 24.08 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.58 -0.448 . . . . 1.0 111.506 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.81 15.45 12.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 119.286 -0.388 . . . . 1.0 110.938 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.585 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 77.0 mtp 83.77 16.35 0.26 Allowed 'General case' 0 N--CA 1.463 0.215 0 O-C-N 123.922 0.764 . . . . 1.0 109.932 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . . . . . . 0 C--N 1.344 1.007 0 C-N-CA 120.068 -1.063 . . . . 1.0 110.68 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.518 -0.251 0 N-CA-C 109.317 -0.623 . . . . 1.0 109.317 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -124.41 3.14 8.42 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.192 -0.458 . . . . 1.0 111.393 -178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 p -163.47 162.54 24.73 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.062 0.458 . . . . 1.0 110.647 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.4 p -155.49 147.09 23.01 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.748 . . . . 1.0 110.105 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.45 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 2.9 ptm180 -128.02 152.44 47.93 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.456 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.1 tt -104.65 128.54 52.73 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.957 -1.127 . . . . 1.0 107.957 178.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.438 ' N ' HD21 ' A' ' 81' ' ' LEU . 2.3 mt -90.56 115.71 64.76 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.295 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo . . . . . 0 N--CA 1.502 2.013 0 C-N-CA 122.468 2.112 . . . . 1.0 112.97 179.03 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.231 0.111 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -132.2 120.22 21.92 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.624 -0.262 . . . . 1.0 111.179 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -146.92 134.7 21.19 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.957 -0.386 . . . . 1.0 109.957 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.0 tt -147.81 138.61 17.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.71 -0.223 . . . . 1.0 110.83 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -118.03 102.2 8.86 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.457 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.78 147.32 27.66 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.315 -0.402 . . . . 1.0 111.288 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -118.28 133.66 55.7 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 115.554 -0.748 . . . . 1.0 111.508 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.648 ' OE1' ' O ' ' A' ' 101' ' ' GLN . 0.5 OUTLIER -55.21 -36.49 66.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.965 -1.016 . . . . 1.0 111.291 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.613 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 36.8 mtp85 -130.98 170.05 14.99 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.419 -0.355 . . . . 1.0 110.131 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . 0.465 ' C ' ' HG ' ' A' ' 123' ' ' SER . 96.8 mt-10 . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 115.837 -0.62 . . . . 1.0 110.723 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.173 0 N-CA-C 111.413 -0.675 . . . . 1.0 111.413 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.648 ' O ' ' OE1' ' A' ' 94' ' ' GLU . 67.4 tp60 -63.81 134.46 55.29 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 120.992 0.425 . . . . 1.0 111.728 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.402 ' SD ' ' C ' ' A' ' 102' ' ' MET . 0.5 OUTLIER -122.41 138.6 54.48 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.8 tt -139.99 138.57 37.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.246 -0.65 . . . . 1.0 109.246 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -112.95 147.25 37.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.203 0.525 . . . . 1.0 110.359 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -130.56 154.45 47.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.684 -1.144 . . . . 1.0 110.285 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 18.2 p -143.28 9.3 1.64 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.547 -0.751 . . . . 1.0 111.17 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.956 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.1 pt-20 -158.51 81.08 0.82 Allowed 'General case' 0 C--O 1.216 -0.664 0 CA-C-O 118.488 -0.768 . . . . 1.0 109.884 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.956 ' O ' ' O ' ' A' ' 107' ' ' GLU . 14.0 p-10 18.46 164.99 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.514 1.149 . . . . 1.0 113.482 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 108' ' ' ASP . 98.3 m -148.43 107.58 3.89 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 120.133 -1.604 . . . . 1.0 109.896 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.0 p -66.28 -19.59 65.86 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.667 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . 0.527 ' SG ' ' OG ' ' A' ' 137' ' ' SER . 4.1 m -146.61 95.09 2.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.269 0.557 . . . . 1.0 109.974 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -62.39 -42.33 99.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.54 -0.754 . . . . 1.0 110.285 -179.201 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -45.72 -14.65 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.345 -0.388 . . . . 1.0 111.47 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 112' ' ' LEU . 81.3 m-20 -93.05 7.15 45.33 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.582 0.706 . . . . 1.0 110.481 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 112' ' ' LEU . 39.4 mmt180 -136.67 -42.78 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.508 -1.224 . . . . 1.0 113.719 -177.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.625 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -125.26 143.4 50.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.646 0.736 . . . . 1.0 110.667 -178.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 87.1 mtt180 -72.63 -73.7 0.19 Allowed 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.748 -0.781 . . . . 1.0 110.616 -177.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.606 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 93.2 m-85 -30.46 142.18 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 O-C-N 123.821 0.701 . . . . 1.0 110.391 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -104.3 12.44 33.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.851 0.358 . . . . 1.0 110.905 -178.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -142.02 138.48 31.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.536 0.684 . . . . 1.0 111.012 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.9 mm -120.43 118.09 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-N 115.067 -0.97 . . . . 1.0 109.088 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -109.9 24.09 13.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.629 -0.714 . . . . 1.0 111.497 -178.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.3 p 170.17 150.0 0.04 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.046 0.451 . . . . 1.0 109.825 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.8 pp -163.48 157.97 20.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.353 -0.84 . . . . 1.0 110.232 -178.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.16 120.27 30.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.529 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 43.5 t -103.83 104.21 16.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.583 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.13 -40.32 31.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.564 -0.744 . . . . 1.0 111.22 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -139.88 148.21 41.74 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.106 0.479 . . . . 1.0 110.766 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 59.11 -176.86 2.46 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.029 -0.828 . . . . 1.0 111.029 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.0 p -117.46 151.71 36.52 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 179.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -127.56 168.21 15.27 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.53 -0.759 . . . . 1.0 110.526 -178.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.54 144.84 25.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 48.3 mt -111.48 142.83 43.24 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . 0.411 ' CE2' ' CG ' ' A' ' 143' ' ' GLN . 39.1 m-85 -117.55 131.61 56.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.801 0.334 . . . . 1.0 110.247 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -43.82 -44.74 7.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.283 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.431 HD13 ' C ' ' A' ' 140' ' ' ARG . 0.5 OUTLIER -130.77 169.25 15.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.999 0.428 . . . . 1.0 110.001 -179.345 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 137' ' ' SER . . . . . 0.527 ' OG ' ' SG ' ' A' ' 111' ' ' CYS . 3.1 t -73.64 168.81 18.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.849 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . 0.463 ' ND2' ' HE ' ' A' ' 140' ' ' ARG . 57.8 t30 69.32 14.82 8.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.142 -0.935 . . . . 1.0 109.911 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 41.42 78.43 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.241 -0.436 . . . . 1.0 111.997 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.463 ' HE ' ' ND2' ' A' ' 138' ' ' ASN . 89.0 mtt-85 -147.46 35.36 0.87 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 120.926 0.393 . . . . 1.0 110.462 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -145.81 -150.14 5.14 Favored Glycine 0 N--CA 1.464 0.516 0 N-CA-C 111.763 -0.535 . . . . 1.0 111.763 -177.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -69.51 165.35 21.16 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.904 -0.406 . . . . 1.0 109.904 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.585 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 42.3 mt-30 -142.8 135.01 27.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.552 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -126.86 124.75 40.32 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 108.807 -0.812 . . . . 1.0 108.807 178.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.2 126.63 32.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.048 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.7 mt -114.79 100.01 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.206 -0.907 . . . . 1.0 109.391 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.568 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -82.28 158.69 66.27 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.319 -179.199 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -47.36 121.76 5.8 Favored 'Trans proline' 0 N--CA 1.491 1.375 0 C-N-CA 121.632 1.555 . . . . 1.0 111.518 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.53 -154.83 24.93 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.38 -1.088 . . . . 1.0 110.38 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -129.49 129.27 44.35 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.874 0.368 . . . . 1.0 110.226 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.51 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -119.24 130.12 55.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.054 -0.521 . . . . 1.0 109.996 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -118.01 -3.8 11.1 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.843 0.354 . . . . 1.0 110.569 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -155.41 157.73 37.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.26 0.552 . . . . 1.0 109.964 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.533 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -70.3 -21.32 62.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.879 -1.055 . . . . 1.0 111.459 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.533 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.4 mt-30 -66.06 -21.3 66.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.234 0.54 . . . . 1.0 110.971 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -50.21 -47.96 54.59 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.793 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.469 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 19.1 p90 -101.9 18.45 20.57 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.16 0.505 . . . . 1.0 110.167 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.36 75.7 0.21 Allowed Glycine 0 C--N 1.331 0.269 0 N-CA-C 111.103 -0.799 . . . . 1.0 111.103 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.469 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -95.07 -171.05 2.32 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.053 0.454 . . . . 1.0 110.264 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.74 -35.94 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.342 -0.844 . . . . 1.0 111.588 -178.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.559 ' ND2' ' O ' ' A' ' 161' ' ' ASN . 0.5 OUTLIER -146.31 -18.98 0.44 Allowed 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 111.948 0.351 . . . . 1.0 111.948 -178.376 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.517 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 90.66 -21.95 0.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.658 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -42.39 122.57 2.27 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.565 -0.743 . . . . 1.0 110.72 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 26.0 t -123.21 133.24 69.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.275 -0.875 . . . . 1.0 110.106 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.33 -29.5 3.94 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.879 -0.489 . . . . 1.0 111.879 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 110' ' ' SER . 16.0 m -163.56 176.69 9.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.829 0.347 . . . . 1.0 110.188 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -160.2 142.6 13.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.841 -0.618 . . . . 1.0 110.52 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -131.84 157.28 44.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.498 -0.556 . . . . 1.0 109.498 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -88.85 153.11 21.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.832 -0.622 . . . . 1.0 109.411 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 59.0 t -88.56 88.43 2.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.588 -0.445 . . . . 1.0 111.659 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.464 0.253 0 CA-C-N 116.235 -0.439 . . . . 1.0 110.439 179.397 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 110.429 -1.068 . . . . 1.0 110.429 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -171.38 111.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 121.034 -0.266 . . . . 1.0 110.692 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.83 169.37 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 120.928 0.394 . . . . 1.0 111.049 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.3 m -127.33 120.23 28.09 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.842 -1.17 . . . . 1.0 107.842 177.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -104.72 132.7 50.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.937 -1.029 . . . . 1.0 110.057 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -115.15 125.87 53.95 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.394 -0.821 . . . . 1.0 111.022 -178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -51.63 -34.28 37.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.634 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -114.84 151.54 33.72 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.205 0.526 . . . . 1.0 110.423 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' PHE . 12.0 ptm180 -56.42 -171.96 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.588 -179.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.28 23.76 0.17 Allowed Glycine 0 C--N 1.332 0.334 0 N-CA-C 110.937 -0.865 . . . . 1.0 110.937 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.451 ' N ' ' O ' ' A' ' 10' ' ' ARG . 9.6 m-85 52.54 69.59 0.67 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.568 -0.316 . . . . 1.0 110.172 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -131.69 -161.37 1.12 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.944 0.402 . . . . 1.0 110.482 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.76 -148.68 1.86 Allowed Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.951 -0.86 . . . . 1.0 110.951 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -72.48 148.1 45.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.786 0.327 . . . . 1.0 110.735 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.4 p-80 -137.04 151.98 49.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.259 0.552 . . . . 1.0 110.409 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.5 t80 -145.23 141.61 28.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.297 -0.865 . . . . 1.0 110.148 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.519 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.5 tt0 -110.42 123.04 49.14 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.895 -0.593 . . . . 1.0 110.183 -179.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -111.69 126.95 55.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.288 -0.415 . . . . 1.0 110.994 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 72.0 p -118.78 11.24 12.62 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.809 -0.632 . . . . 1.0 110.566 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.5 p -156.02 168.81 26.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.477 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 50.2 p-10 -58.86 136.75 57.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.638 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -131.74 142.99 49.92 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.443 -0.798 . . . . 1.0 110.533 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' THR . . . . . 0.504 ' O ' ' OG ' ' A' ' 78' ' ' SER . 65.4 p -115.73 -11.96 11.57 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.401 -0.818 . . . . 1.0 111.887 -178.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -149.95 110.96 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.274 0.559 . . . . 1.0 109.777 -179.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 36.4 mt -118.01 -3.55 11.12 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.428 -179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.556 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -47.17 -52.67 33.15 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.488 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.556 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.5 Cg_endo -55.88 -32.45 85.21 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 C-N-CA 121.556 1.504 . . . . 1.0 112.295 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.1 m-85 -91.98 -49.5 6.19 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.362 -0.535 . . . . 1.0 110.38 -178.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.3 mt -121.41 126.95 50.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.44 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -94.7 -14.59 24.67 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.725 -0.671 . . . . 1.0 111.942 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -144.59 -55.84 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.381 . . . . 1.0 111.685 -178.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.0 t 60.75 79.5 0.24 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.096 -0.335 . . . . 1.0 110.096 -178.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -94.25 4.83 53.35 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.243 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.1 p -156.83 158.03 36.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.958 0.409 . . . . 1.0 110.372 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.68 154.45 32.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.624 . . . . 1.0 110.893 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.5 mtp85 -133.16 122.46 24.06 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 108.688 -0.856 . . . . 1.0 108.688 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.7 t -107.82 115.93 50.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.149 0.5 . . . . 1.0 109.873 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . 0.51 ' C ' ' HG ' ' A' ' 40' ' ' SER . 22.4 t0 -78.44 -43.6 26.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.465 -0.788 . . . . 1.0 110.914 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' SER . . . . . 0.51 ' HG ' ' C ' ' A' ' 39' ' ' ASP . 57.7 m -160.42 159.81 31.43 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.375 -0.602 . . . . 1.0 109.375 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.93 176.02 48.98 Favored Glycine 0 C--N 1.316 -0.565 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.9 m -112.49 138.02 49.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.091 -0.707 . . . . 1.0 109.091 178.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.459 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 52.4 m95 -127.94 148.82 50.52 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.288 0.566 . . . . 1.0 110.916 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.516 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 1.9 ttt -128.06 137.04 52.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.413 -0.812 . . . . 1.0 110.021 178.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.27 139.73 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.374 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -109.64 134.93 51.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.461 0.648 . . . . 1.0 111.711 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.526 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 15.4 pt-20 -57.86 -32.41 67.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.863 -1.062 . . . . 1.0 111.133 -178.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 52' ' ' SER . 10.9 pt20 -115.93 155.16 48.17 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.31 -0.626 . . . . 1.0 109.31 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.404 ' C ' HD21 ' A' ' 50' ' ' ASN . 15.9 Cg_endo -52.82 149.0 26.97 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 121.089 1.193 . . . . 1.0 111.87 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.809 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.4 OUTLIER 75.78 -123.46 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.566 -1.197 . . . . 1.0 109.403 -178.662 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.543 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -150.96 73.29 1.1 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.18 0.514 . . . . 1.0 110.218 179.034 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.51 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 3.4 m -140.08 18.19 2.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.776 -0.647 . . . . 1.0 112.037 -177.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -137.7 -164.74 10.13 Favored Glycine 0 N--CA 1.467 0.73 0 N-CA-C 111.127 -0.789 . . . . 1.0 111.127 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.526 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 38.9 tp -59.39 146.76 38.8 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.516 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 4.9 pt20 -121.97 150.09 42.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.696 0.284 . . . . 1.0 110.692 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -125.61 123.64 39.47 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.009 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -83.58 122.32 28.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.112 0.482 . . . . 1.0 110.59 -179.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.5 mp -118.36 145.25 45.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.724 -0.671 . . . . 1.0 110.144 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.635 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 64.1 mtm180 -132.11 157.71 43.51 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.468 -0.787 . . . . 1.0 110.025 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.2 ptm180 -34.32 125.23 0.49 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.035 -0.529 . . . . 1.0 110.941 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.65 -178.3 32.32 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.35 129.02 56.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.059 0.457 . . . . 1.0 110.644 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -122.22 113.2 19.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.507 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.81 -3.66 54.33 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.982 -0.554 . . . . 1.0 111.537 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.9 m-20 -147.64 137.26 22.64 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.001 -0.74 . . . . 1.0 109.001 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.5 ' H ' ' CD2' ' A' ' 66' ' ' HIS . 6.1 p80 -58.93 -37.87 77.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.059 0.457 . . . . 1.0 111.035 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.73 -7.83 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.917 -0.583 . . . . 1.0 110.494 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.7 mm-40 -83.14 -33.9 26.15 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 120.675 -0.41 . . . . 1.0 111.694 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.445 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.0 p90 -94.41 15.57 17.36 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.812 -0.355 . . . . 1.0 110.813 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 53.3 mtt 75.4 27.92 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.912 0.757 . . . . 1.0 109.942 -179.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.727 0 C-N-CA 120.135 -1.031 . . . . 1.0 111.999 -179.46 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.1 p . . . . . 0 N--CA 1.455 -0.184 0 N-CA-C 109.03 -0.73 . . . . 1.0 109.03 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -131.21 12.99 5.12 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.976 -178.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' SER . . . . . 0.504 ' OG ' ' O ' ' A' ' 24' ' ' THR . 3.5 m -160.84 159.55 29.99 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.306 0.574 . . . . 1.0 111.104 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.5 p -155.56 146.55 22.42 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.229 -0.896 . . . . 1.0 110.984 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.602 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 7.9 ptm180 -125.49 150.8 47.05 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.459 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 3.8 tt -102.6 121.84 43.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.347 -1.353 . . . . 1.0 107.347 178.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.423 HG21 HD12 ' A' ' 82' ' ' ILE . 5.3 mt -84.12 116.64 65.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 116.115 -0.493 . . . . 1.0 109.903 -178.274 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo . . . . . 0 N--CA 1.5 1.884 0 C-N-CA 121.912 1.741 . . . . 1.0 113.219 179.937 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 120.85 0.357 . . . . 1.0 110.093 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -133.48 110.11 9.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.856 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -137.99 131.69 31.14 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.839 -0.344 . . . . 1.0 110.084 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 tt -147.84 148.26 16.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.84 0.352 . . . . 1.0 111.114 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -125.73 98.07 5.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.565 -0.743 . . . . 1.0 111.699 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 17.4 mt -75.57 135.95 40.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 1.0 110.071 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -117.78 138.28 52.16 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.566 0.698 . . . . 1.0 111.481 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.526 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.8 OUTLIER -56.56 -65.04 0.68 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.348 -0.842 . . . . 1.0 111.79 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -96.68 173.25 7.42 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.352 0.596 . . . . 1.0 111.446 -178.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 114.845 -1.071 . . . . 1.0 111.697 179.767 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 N-CA-C 111.27 -0.732 . . . . 1.0 111.27 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -63.07 146.13 53.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.958 0.408 . . . . 1.0 110.798 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.497 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.1 ppp? -132.49 158.67 41.5 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.743 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.8 tt -148.85 142.07 18.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 73.4 tt0 -113.53 141.94 46.55 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.619 0.723 . . . . 1.0 110.804 -178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -129.32 151.68 49.71 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 114.669 -1.15 . . . . 1.0 110.267 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.4 p -143.63 16.95 1.82 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.082 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.97 ' O ' ' O ' ' A' ' 108' ' ' ASP . 4.9 pt-20 -166.31 86.14 0.32 Allowed 'General case' 0 C--O 1.213 -0.867 0 CA-C-O 118.328 -0.844 . . . . 1.0 111.013 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.97 ' O ' ' O ' ' A' ' 107' ' ' GLU . 7.8 t70 16.68 154.34 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 122.231 1.015 . . . . 1.0 113.16 178.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 4.1 t -140.99 104.82 4.74 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.098 -1.001 . . . . 1.0 110.531 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.3 m -64.52 -31.72 73.05 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.246 -0.434 . . . . 1.0 110.726 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.2 t -137.09 90.14 2.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.073 -0.512 . . . . 1.0 110.099 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.58 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.2 tp -62.03 -42.86 99.62 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.736 -0.666 . . . . 1.0 110.423 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.548 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 25.8 mp0 -43.08 -9.7 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.58 ' H ' ' C ' ' A' ' 112' ' ' LEU . 84.0 m-20 -95.31 -20.83 18.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.176 0.512 . . . . 1.0 110.472 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 112' ' ' LEU . 24.9 mmt85 -109.96 -35.72 6.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.405 -0.816 . . . . 1.0 113.149 -178.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.676 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.71 137.24 54.83 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.765 0.793 . . . . 1.0 110.151 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.8 mtt180 -75.27 -70.66 0.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 120.914 -1.116 . . . . 1.0 110.653 -177.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.632 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 87.4 m-85 -33.0 145.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.307 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -104.32 10.49 35.48 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.779 0.323 . . . . 1.0 111.115 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 76.7 mt-10 -141.07 141.72 34.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.087 0.47 . . . . 1.0 111.228 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 35.4 mm -122.68 116.44 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.564 -0.744 . . . . 1.0 109.116 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.463 ' O ' ' CB ' ' A' ' 123' ' ' SER . 41.7 m-70 -109.34 31.13 5.99 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.333 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.6 t 161.59 150.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.14 0.495 . . . . 1.0 110.661 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -159.63 156.05 27.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.524 -0.762 . . . . 1.0 110.529 -178.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.87 107.26 9.95 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.702 -0.481 . . . . 1.0 109.702 -179.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 1.1 p -104.57 108.18 24.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 108.666 -0.864 . . . . 1.0 108.666 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.599 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -78.4 -33.25 48.86 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.875 -1.057 . . . . 1.0 110.83 -179.04 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -148.61 164.76 33.34 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.277 0.561 . . . . 1.0 110.859 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 55.81 170.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 110.416 -1.074 . . . . 1.0 110.416 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.1 t -115.67 146.76 41.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 41.1 m95 -120.79 161.16 21.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.076 -177.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.7 t -135.84 98.56 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . 0.421 HD11 ' N ' ' A' ' 133' ' ' LEU . 5.5 mp -69.71 138.51 52.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.527 -0.306 . . . . 1.0 110.26 -179.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . 0.63 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 43.3 m-85 -118.31 133.4 55.92 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.825 -0.625 . . . . 1.0 110.802 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . 0.448 ' OE2' ' CD ' ' A' ' 163' ' ' ARG . 42.9 tp10 -39.94 -56.14 1.88 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.858 -0.61 . . . . 1.0 111.199 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.442 HD12 ' C ' ' A' ' 140' ' ' ARG . 0.5 OUTLIER -123.92 170.45 10.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.487 -178.494 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 22.0 p -74.7 169.16 18.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.372 -0.831 . . . . 1.0 110.744 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 59.6 t30 67.24 17.27 10.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.268 -0.878 . . . . 1.0 109.667 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.429 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.0 m-85 38.1 80.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.873 -0.603 . . . . 1.0 112.215 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . 0.442 ' C ' HD12 ' A' ' 136' ' ' LEU . 15.9 tpp180 -148.98 39.79 0.86 Allowed 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.815 0.34 . . . . 1.0 110.326 179.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.15 -136.28 2.47 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.197 -0.761 . . . . 1.0 111.197 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -81.22 172.34 13.75 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.209 -0.293 . . . . 1.0 110.209 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -149.35 134.85 18.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.512 . . . . 1.0 111.188 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -130.05 120.0 24.0 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.924 0.392 . . . . 1.0 110.212 179.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 53.2 tp -79.97 131.24 35.78 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.614 0.721 . . . . 1.0 110.8 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 22.9 mt -117.27 105.03 11.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.023 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.602 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.7 mtm -77.52 159.56 76.89 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 109.823 -0.436 . . . . 1.0 109.823 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.45 114.81 2.08 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.207 1.938 . . . . 1.0 111.999 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.21 -154.98 19.46 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 50.5 p-10 -121.23 136.11 55.02 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.061 0.458 . . . . 1.0 110.715 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.542 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 9.8 m-85 -127.29 126.76 43.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 32.1 ptt-85 -117.22 3.67 12.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.874 0.369 . . . . 1.0 110.305 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -162.37 160.72 26.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.532 0.682 . . . . 1.0 110.482 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.534 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -74.68 -17.96 60.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.869 -1.06 . . . . 1.0 111.93 -178.476 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.534 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.5 mt-30 -66.4 -20.55 66.1 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.115 -0.493 . . . . 1.0 111.214 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . 0.542 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 41.6 t0 -50.39 -49.47 54.39 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.067 -178.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.471 ' HE1' ' HB1' ' A' ' 159' ' ' ALA . 36.1 p90 -101.55 19.2 18.42 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.033 0.444 . . . . 1.0 110.323 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.0 75.14 0.24 Allowed Glycine 0 CA--C 1.518 0.253 0 CA-C-N 115.617 -0.719 . . . . 1.0 111.433 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.471 ' HB1' ' HE1' ' A' ' 157' ' ' TRP . . . -95.4 -171.14 2.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 1.0 110.71 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 160' ' ' THR . . . . . 0.589 ' HG1' ' N ' ' A' ' 161' ' ' ASN . 0.7 OUTLIER -121.31 -40.85 2.55 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.295 -0.866 . . . . 1.0 111.955 -178.099 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.589 ' N ' ' HG1' ' A' ' 160' ' ' THR . 0.7 OUTLIER -143.01 -16.52 0.68 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.974 -177.744 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.521 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 90.32 -21.24 0.12 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.832 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . 0.448 ' CD ' ' OE2' ' A' ' 135' ' ' GLU . 17.4 ptp180 -44.35 123.56 3.57 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.593 0.711 . . . . 1.0 110.939 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 11.8 t -119.54 156.08 22.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.159 -0.928 . . . . 1.0 110.343 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.469 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -128.11 -34.47 0.54 Allowed Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.711 -0.677 . . . . 1.0 111.512 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 4.9 p -159.17 -167.72 2.15 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.051 -0.351 . . . . 1.0 110.051 -178.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.8 pp -174.49 137.06 0.48 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.283 -0.417 . . . . 1.0 110.357 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.635 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 8.1 ptp180 -131.94 150.18 52.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 1.0 109.845 179.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -81.49 153.25 26.94 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.454 -0.793 . . . . 1.0 108.956 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 54.7 t -87.78 88.19 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.921 0.391 . . . . 1.0 111.309 -179.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.084 179.335 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.629 -0.988 . . . . 1.0 110.629 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 mttm 179.21 103.84 0.03 OUTLIER 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.676 -0.308 . . . . 1.0 110.289 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.77 170.94 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.838 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.4 m -129.53 121.24 26.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.256 -1.016 . . . . 1.0 108.256 177.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.3 mt -106.6 132.79 52.2 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 114.939 -1.028 . . . . 1.0 110.238 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . 0.401 ' CG ' ' HA ' ' A' ' 12' ' ' PHE . 50.9 m-85 -114.42 130.47 56.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.355 -0.839 . . . . 1.0 111.127 -178.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.447 ' O ' ' O ' ' A' ' 32' ' ' ARG . 83.8 tt0 -55.8 -24.15 34.31 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.464 -0.789 . . . . 1.0 110.403 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -126.91 153.48 45.71 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.173 0.511 . . . . 1.0 110.221 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.6 ptt85 -56.63 -173.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.51 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.69 30.24 0.32 Allowed Glycine 0 C--N 1.333 0.408 0 N-CA-C 110.994 -0.842 . . . . 1.0 110.994 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . 0.557 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 46.38 68.94 0.53 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.472 -0.364 . . . . 1.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -126.88 -157.49 0.81 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.15 -146.9 0.26 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.972 -0.851 . . . . 1.0 110.972 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.2 mmt180 -74.54 150.13 39.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.905 0.383 . . . . 1.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -136.98 145.38 44.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.334 0.588 . . . . 1.0 110.24 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 7.1 t80 -139.89 142.78 36.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.069 -0.969 . . . . 1.0 109.893 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.511 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.1 tt0 -111.24 122.99 49.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.293 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 t -109.51 126.58 53.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.17 -0.468 . . . . 1.0 109.947 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.0 m -117.38 7.32 12.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.308 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 89.5 p -153.84 167.9 28.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.816 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . 0.443 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 51.9 p-10 -57.72 137.46 56.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.708 -0.678 . . . . 1.0 111.493 -179.455 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.03 149.25 50.11 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.619 -0.718 . . . . 1.0 110.649 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 p -116.75 -18.9 10.14 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.799 -0.637 . . . . 1.0 112.083 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . 0.451 ' OD1' ' CG ' ' A' ' 28' ' ' PRO . 2.3 t-20 -132.1 115.64 16.01 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.246 0.546 . . . . 1.0 110.503 -178.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.8 mp -115.39 -8.14 12.26 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.027 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.621 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 12.6 mt-30 -60.13 -41.41 84.41 Favored Pre-proline 0 CA--C 1.516 -0.358 0 C-N-CA 120.454 -0.498 . . . . 1.0 110.43 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.6 Cg_exo -58.61 -41.28 65.85 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.084 1.856 . . . . 1.0 112.112 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -92.96 -47.41 7.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.164 0.507 . . . . 1.0 111.103 -178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.56 128.02 54.54 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.46 -0.791 . . . . 1.0 111.307 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 t -90.88 -16.31 28.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.133 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.447 ' O ' ' O ' ' A' ' 8' ' ' GLU . 43.9 ttm180 -174.5 119.84 0.24 Allowed 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.955 -0.757 . . . . 1.0 108.955 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.6 t -99.2 112.08 24.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.678 0.275 . . . . 1.0 110.644 179.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -106.25 -3.97 20.67 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.343 -0.39 . . . . 1.0 110.229 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' SER . . . . . 0.557 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.6 t -156.16 155.64 32.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.881 0.372 . . . . 1.0 110.309 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.74 155.5 37.32 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.092 -0.503 . . . . 1.0 110.786 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.0 mtt-85 -135.15 122.76 22.11 Favored 'General case' 0 C--O 1.212 -0.872 0 N-CA-C 108.953 -0.758 . . . . 1.0 108.953 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.3 t -107.99 130.08 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.156 0.503 . . . . 1.0 109.66 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -90.07 -43.21 10.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.276 -0.875 . . . . 1.0 110.635 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.2 p -161.8 164.45 28.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.725 -0.472 . . . . 1.0 109.725 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.49 175.87 41.29 Favored Glycine 0 C--N 1.316 -0.549 0 N-CA-C 111.278 -0.729 . . . . 1.0 111.278 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 97.7 m -111.69 129.63 56.04 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.484 -0.562 . . . . 1.0 109.484 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.47 145.81 43.02 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.751 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.448 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 17.3 tpp -122.05 130.55 53.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.282 -0.872 . . . . 1.0 109.496 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.416 ' CD1' ' N ' ' A' ' 45' ' ' LEU . 10.1 mp -108.69 131.82 54.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.544 -0.753 . . . . 1.0 109.429 -179.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -111.17 132.28 54.43 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.383 0.611 . . . . 1.0 111.814 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.593 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.7 pt-20 -57.08 -36.14 70.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.271 -0.877 . . . . 1.0 111.261 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.9 mt-30 -107.31 153.37 41.21 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.598 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.13 159.59 46.04 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.419 2.079 . . . . 1.0 112.045 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.658 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.92 34.66 14.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.545 -0.752 . . . . 1.0 111.388 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 54.1 76.45 0.23 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.267 -0.878 . . . . 1.0 111.439 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.1 m -146.04 154.15 41.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.077 0.465 . . . . 1.0 110.442 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.64 -148.41 21.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.031 -0.604 . . . . 1.0 111.805 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.593 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.7 tp -75.61 144.11 41.94 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.358 -0.421 . . . . 1.0 110.475 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 2.0 pt20 -119.31 153.57 34.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.549 0.214 . . . . 1.0 110.496 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.448 ' O ' ' SD ' ' A' ' 44' ' ' MET . 39.9 m-85 -125.93 123.63 38.99 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 120.821 0.344 . . . . 1.0 110.457 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.465 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 43.2 t80 -82.87 123.25 29.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.128 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 mp -120.27 145.06 47.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.248 -0.887 . . . . 1.0 110.5 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 44.8 mtp180 -132.13 157.52 44.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.103 -0.953 . . . . 1.0 110.433 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.1 ttp85 -37.54 126.67 1.11 Allowed 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.856 -0.611 . . . . 1.0 110.765 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 179.9 31.9 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.471 -1.051 . . . . 1.0 110.471 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.7 p-10 -114.34 127.68 55.98 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.984 0.421 . . . . 1.0 110.399 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . 0.456 ' O ' ' OG ' ' A' ' 35' ' ' SER . 41.3 m-85 -122.3 113.53 19.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.85 -0.614 . . . . 1.0 109.761 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.94 -4.04 55.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.282 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -146.79 139.21 24.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.516 ' C ' ' H ' ' A' ' 68' ' ' GLN . 16.2 p-80 -60.18 -42.17 94.43 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 120.987 0.423 . . . . 1.0 111.121 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.18 -7.47 0.09 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.498 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.516 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -82.17 -32.25 30.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.269 -178.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.1 p90 -97.09 16.85 18.47 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 120.807 -0.357 . . . . 1.0 110.743 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 78.6 mtp 73.34 29.84 1.6 Allowed 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.838 0.711 . . . . 1.0 109.857 -179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.663 0 C-N-CA 120.122 -1.037 . . . . 1.0 111.606 -179.833 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 109.021 -0.733 . . . . 1.0 109.021 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -120.76 14.38 11.69 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.353 -0.385 . . . . 1.0 110.941 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 p -164.91 163.07 21.04 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.05 0.452 . . . . 1.0 110.975 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -154.87 146.24 22.99 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.638 . . . . 1.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . 0.428 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 1.6 ptm180 -127.68 148.01 50.39 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 120.637 0.256 . . . . 1.0 110.514 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -96.0 111.37 23.4 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.846 -1.168 . . . . 1.0 107.846 177.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mt -57.2 110.47 2.47 Favored Pre-proline 0 C--N 1.322 -0.591 0 C-N-CA 120.247 -0.581 . . . . 1.0 110.629 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo . . . . . 0 N--CA 1.49 1.316 0 C-N-CA 121.989 1.792 . . . . 1.0 111.556 -179.803 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--O 1.231 0.116 0 N-CA-C 109.663 -0.495 . . . . 1.0 109.663 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 2.5 m80 -131.64 115.28 15.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.115 -0.234 . . . . 1.0 110.811 -179.361 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 46.3 mtm-85 -143.38 134.64 25.9 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 1.0 110.017 178.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 15.7 tt -146.58 143.81 20.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.719 0.295 . . . . 1.0 110.967 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -121.33 97.7 5.63 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.872 -0.604 . . . . 1.0 111.427 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.9 mt -76.56 138.29 40.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.559 . . . . 1.0 110.184 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -117.0 136.47 52.92 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 115.432 -0.803 . . . . 1.0 111.093 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.561 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -57.99 -70.28 0.14 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.135 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -96.17 174.51 6.86 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.29 0.567 . . . . 1.0 110.639 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 . . . . . 0 CA--C 1.517 -0.326 0 CA-C-N 115.188 -0.914 . . . . 1.0 110.58 -179.382 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.677 0 N-CA-C 111.025 -0.83 . . . . 1.0 111.025 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -58.01 151.22 18.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 1.0 110.332 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ptm -130.79 156.37 45.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.358 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.9 tt -150.56 142.53 16.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 N-CA-C 109.632 -0.507 . . . . 1.0 109.632 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -113.56 144.09 43.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.435 0.636 . . . . 1.0 110.81 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . 0.427 ' CZ ' ' CD2' ' A' ' 112' ' ' LEU . 78.0 m-85 -131.01 152.73 50.0 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 114.59 -1.186 . . . . 1.0 110.265 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 p -143.2 10.85 1.73 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.893 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.969 ' O ' ' O ' ' A' ' 108' ' ' ASP . 7.3 pt-20 -158.85 81.49 0.79 Allowed 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.697 -0.668 . . . . 1.0 109.788 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.969 ' O ' ' O ' ' A' ' 107' ' ' GLU . 54.6 p30 19.86 162.02 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 122.336 1.065 . . . . 1.0 113.236 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 5.9 t -144.0 106.09 4.36 Favored 'General case' 0 C--N 1.315 -0.9 0 O-C-N 120.483 -1.386 . . . . 1.0 109.712 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.471 ' O ' ' OG ' ' A' ' 166' ' ' SER . 15.6 m -68.58 -28.02 66.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.667 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 37.1 t -139.38 89.19 2.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.183 0.516 . . . . 1.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . 0.592 ' C ' ' H ' ' A' ' 114' ' ' ASP . 1.8 mt -62.29 -42.34 99.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.411 -0.813 . . . . 1.0 110.696 -179.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -45.98 -8.07 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.288 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.592 ' H ' ' C ' ' A' ' 112' ' ' LEU . 63.8 t0 -96.73 -23.9 16.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.175 0.512 . . . . 1.0 110.526 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' A' ' 112' ' ' LEU . 28.2 mmt180 -104.49 -40.47 6.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.495 -0.775 . . . . 1.0 112.966 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.692 ' CZ ' ' O ' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -123.62 138.72 54.49 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.362 0.601 . . . . 1.0 109.8 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 118' ' ' PHE . 90.6 mtt180 -71.86 -74.06 0.17 Allowed 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.594 -0.691 . . . . 1.0 111.308 -177.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.692 ' O ' ' CZ ' ' A' ' 116' ' ' PHE . 72.4 m-85 -29.56 146.23 0.01 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 O-C-N 123.975 0.797 . . . . 1.0 110.413 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -106.47 13.18 28.79 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.041 0.448 . . . . 1.0 111.155 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -141.73 140.53 33.14 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.912 -0.585 . . . . 1.0 111.113 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.7 mm -120.74 117.12 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 115.38 -0.827 . . . . 1.0 109.036 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . 0.471 ' O ' ' CB ' ' A' ' 123' ' ' SER . 38.3 m-70 -108.53 30.16 6.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.914 -0.584 . . . . 1.0 111.395 -178.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.471 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.5 p 162.06 152.49 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.034 0.445 . . . . 1.0 110.103 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 pp -163.32 157.71 20.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 1.0 110.149 -178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.75 116.21 21.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.965 0.412 . . . . 1.0 109.999 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 24.0 t -102.78 104.82 17.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 115.818 -0.628 . . . . 1.0 109.704 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.58 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.4 OUTLIER -78.33 -38.66 41.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.633 -0.712 . . . . 1.0 111.433 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -141.59 155.95 45.72 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 120.536 -0.465 . . . . 1.0 110.757 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.96 -175.03 0.14 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 110.475 -1.05 . . . . 1.0 110.475 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 130' ' ' SER . . . . . 0.526 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.9 OUTLIER -116.32 178.53 4.29 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.099 -0.704 . . . . 1.0 109.099 178.856 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.526 ' CD1' ' C ' ' A' ' 130' ' ' SER . 69.7 m95 -148.86 162.87 38.96 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.286 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 24.0 t -136.25 105.53 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.577 -0.283 . . . . 1.0 111.105 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 26.5 mt -77.06 143.0 39.59 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.947 -0.301 . . . . 1.0 110.266 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . 0.52 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 37.8 m-85 -119.29 133.24 55.84 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.68 0.276 . . . . 1.0 110.538 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -43.47 -46.86 7.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.531 -0.304 . . . . 1.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.9 165.91 21.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.062 0.458 . . . . 1.0 110.011 -178.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 137' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 4.1 t -69.71 174.78 4.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.768 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . 0.491 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.7 t30 63.39 18.78 11.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.046 -0.979 . . . . 1.0 109.752 -178.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 37.42 74.87 0.07 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.163 -0.471 . . . . 1.0 111.318 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 45.3 mmt-85 -144.2 40.38 1.35 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.872 0.368 . . . . 1.0 110.09 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.69 -146.82 4.42 Favored Glycine 0 N--CA 1.462 0.399 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -178.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -70.74 171.16 10.97 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.182 -0.303 . . . . 1.0 110.182 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.55 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 5.7 pt20 -149.29 135.48 19.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.203 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . 0.411 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 8.6 m-85 -130.15 124.03 31.71 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.757 -0.461 . . . . 1.0 109.757 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 42.7 tp -79.9 127.47 32.29 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.025 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 30.0 mt -117.47 107.86 14.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.42 -0.809 . . . . 1.0 110.5 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.428 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.3 OUTLIER -80.67 171.52 12.11 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.794 -179.589 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -67.45 115.7 3.84 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.225 1.95 . . . . 1.0 111.422 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 177.85 -152.26 11.61 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.621 -0.992 . . . . 1.0 110.621 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.459 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.3 p-10 -127.75 125.2 39.48 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.193 0.521 . . . . 1.0 110.603 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 12.2 m-85 -115.91 127.69 55.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.823 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -114.15 -3.07 13.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.827 0.346 . . . . 1.0 110.762 -179.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -157.23 164.45 37.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.732 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . 0.551 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -75.57 -20.76 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.031 -0.986 . . . . 1.0 111.978 -178.547 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -65.55 -21.82 66.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.226 -0.443 . . . . 1.0 111.041 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -48.14 -51.24 25.69 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.029 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . 0.493 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.4 p90 -99.61 19.71 15.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.938 0.399 . . . . 1.0 110.258 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.0 74.36 0.3 Allowed Glycine 0 CA--C 1.518 0.243 0 N-CA-C 111.249 -0.741 . . . . 1.0 111.249 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . 0.493 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.22 -171.13 2.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 1.0 110.233 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 12.6 t -123.15 -33.67 3.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.144 -0.935 . . . . 1.0 111.573 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.553 ' ND2' ' O ' ' A' ' 161' ' ' ASN . 0.8 OUTLIER -149.43 -15.89 0.28 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.757 0.313 . . . . 1.0 111.646 -178.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.518 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 89.49 -21.71 0.13 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.48 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -42.02 124.49 2.7 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.674 -0.694 . . . . 1.0 110.748 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 24.8 t -120.73 160.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.713 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -138.17 -35.08 0.17 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.282 -0.727 . . . . 1.0 111.282 -179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -162.06 172.06 16.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.01 0.433 . . . . 1.0 110.577 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.4 144.17 21.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.325 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.52 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 12.5 ptp180 -134.6 150.3 50.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.268 0.556 . . . . 1.0 110.27 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.417 ' HD2' ' N ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -76.88 147.69 36.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.146 -0.934 . . . . 1.0 108.698 177.143 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 27.6 m -86.33 68.44 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.934 -0.575 . . . . 1.0 112.384 -178.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.3 mp . . . . . 0 N--CA 1.467 0.424 0 CA-C-O 121.173 0.511 . . . . 1.0 109.913 179.75 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.818 0 N-CA-C 110.435 -1.066 . . . . 1.0 110.435 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.2 tttt -172.99 106.82 0.15 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.778 -0.369 . . . . 1.0 110.141 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.452 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.91 169.16 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.346 0.594 . . . . 1.0 111.647 -179.771 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.3 m -125.07 121.73 35.15 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.35 -0.982 . . . . 1.0 108.35 177.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.2 134.2 50.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.176 -0.92 . . . . 1.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -114.53 129.73 56.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.036 -178.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.451 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 80.5 tt0 -55.62 -20.78 14.91 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.571 -0.741 . . . . 1.0 109.894 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -126.93 163.2 24.19 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.399 0.618 . . . . 1.0 111.0 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -67.82 179.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.0 111.37 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.59 25.98 7.11 Favored Glycine 0 C--N 1.335 0.518 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 51.7 66.02 1.32 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -128.51 -155.06 0.68 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.945 0.402 . . . . 1.0 110.535 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.07 -153.62 0.08 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.012 -0.835 . . . . 1.0 111.012 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -68.62 148.08 50.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.688 0.28 . . . . 1.0 110.75 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -135.46 151.32 50.29 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.418 0.628 . . . . 1.0 110.683 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.3 t80 -147.29 141.64 26.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.975 -1.011 . . . . 1.0 109.682 -179.344 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.8 tt0 -110.07 121.4 45.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.517 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.5 t -107.18 126.0 51.83 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.954 0.407 . . . . 1.0 110.891 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.5 m -118.72 13.22 13.24 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.755 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 49.8 m -158.03 169.49 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.421 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -61.03 136.41 58.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.029 -0.532 . . . . 1.0 111.457 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' HIS . . . . . 0.465 ' C ' ' HH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -133.34 150.22 51.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.576 -179.87 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.7 p -117.05 -13.85 10.58 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.084 0.772 . . . . 1.0 113.084 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -152.01 109.43 3.59 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.127 -0.629 . . . . 1.0 111.618 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.3 mp -100.39 -1.76 35.18 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.052 -0.976 . . . . 1.0 110.336 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 28.5 mt-30 -51.85 -49.96 80.64 Favored Pre-proline 0 C--N 1.327 -0.409 0 C-N-CA 120.368 -0.533 . . . . 1.0 111.04 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' PRO . . . . . 0.576 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 19.6 Cg_endo -57.88 -33.55 97.18 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 121.52 1.48 . . . . 1.0 112.414 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -95.39 -51.48 4.56 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 111.131 -178.09 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LEU . . . . . 0.417 ' N ' ' O ' ' A' ' 26' ' ' LEU . 11.1 mt -121.32 129.94 53.37 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.032 -0.531 . . . . 1.0 111.327 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -93.7 -9.23 38.46 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.177 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 62.3 ttp180 -179.1 119.29 0.07 Allowed 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 108.637 -0.875 . . . . 1.0 108.637 -179.089 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.6 t -100.95 113.41 26.37 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.739 0.304 . . . . 1.0 110.289 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -105.5 -5.3 20.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.888 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.1 p -156.61 158.26 36.75 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.686 -0.406 . . . . 1.0 110.863 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.6 155.05 34.02 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.347 0.594 . . . . 1.0 112.036 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.7 mtt180 -136.47 122.45 20.15 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.207 -0.906 . . . . 1.0 108.838 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' VAL . . . . . 0.478 HG11 ' H ' ' A' ' 61' ' ' GLY . 1.2 p -110.29 123.17 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.973 0.416 . . . . 1.0 110.016 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -77.19 -45.06 27.92 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.985 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.5 p -159.8 162.87 34.88 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.74 -0.837 . . . . 1.0 108.74 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 173.1 46.01 Favored Glycine 0 C--N 1.314 -0.671 0 N-CA-C 110.253 -1.139 . . . . 1.0 110.253 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.78 142.98 43.45 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.714 -0.847 . . . . 1.0 108.714 178.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' TRP . . . . . 0.452 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 56.4 m95 -130.88 155.56 46.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.455 0.645 . . . . 1.0 111.206 -178.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' MET . . . . . 0.493 ' SD ' ' HB2' ' A' ' 145' ' ' LEU . 9.2 ttm -130.68 131.48 44.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.036 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.41 ' CD2' ' N ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -107.97 137.45 45.94 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.114 -0.699 . . . . 1.0 109.114 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -113.68 132.18 55.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.178 0.513 . . . . 1.0 110.925 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.593 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.3 pt-20 -60.9 -35.67 77.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.643 -0.708 . . . . 1.0 111.237 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.77 151.66 42.46 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.445 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PRO . . . . . 0.421 ' O ' ' OG ' ' A' ' 52' ' ' SER . 42.1 Cg_endo -64.01 158.21 48.83 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.69 2.26 . . . . 1.0 113.533 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ASN . . . . . 0.655 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.8 OUTLIER 63.82 36.24 10.56 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.091 -0.959 . . . . 1.0 111.626 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.465 ' HH ' ' C ' ' A' ' 23' ' ' HIS . 4.1 m-85 52.5 72.67 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.995 -1.002 . . . . 1.0 110.852 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 49' ' ' PRO . 5.1 p -142.41 159.64 41.83 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 116.004 -0.544 . . . . 1.0 109.679 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.6 -149.15 24.32 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.728 -0.749 . . . . 1.0 112.261 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LEU . . . . . 0.593 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.5 tp -77.8 140.95 39.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.807 -0.697 . . . . 1.0 110.244 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . 0.491 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 13.9 pt20 -120.53 149.31 42.62 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 117.803 0.274 . . . . 1.0 110.663 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -128.49 129.88 46.71 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.622 -0.263 . . . . 1.0 111.276 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' PHE . . . . . 0.427 ' H ' ' NE2' ' A' ' 143' ' ' GLN . 67.6 t80 -82.66 123.52 29.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.506 0.67 . . . . 1.0 110.597 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -110.08 134.5 52.09 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.809 -1.087 . . . . 1.0 108.5 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 60' ' ' ARG . 37.8 ttp180 -130.03 151.68 50.31 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 59' ' ' ARG . 78.0 ttt-85 -34.66 125.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.167 -0.47 . . . . 1.0 111.769 -178.113 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLY . . . . . 0.478 ' H ' HG11 ' A' ' 38' ' ' VAL . . . 152.48 -175.29 31.16 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.221 -1.152 . . . . 1.0 110.221 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 49.5 p-10 -117.32 131.29 56.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.182 0.515 . . . . 1.0 111.106 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -125.27 115.14 19.91 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.102 -0.703 . . . . 1.0 109.102 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . 0.439 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -95.51 -5.06 43.72 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.764 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 90.6 m-20 -145.76 136.04 23.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.674 -0.861 . . . . 1.0 108.674 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' HIS . . . . . 0.475 ' C ' ' H ' ' A' ' 68' ' ' GLN . 6.0 p80 -56.06 -42.64 76.95 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.074 -0.65 . . . . 1.0 110.918 -178.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -50.17 -8.89 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.566 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLN . . . . . 0.475 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -85.05 -34.06 22.36 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.336 -0.546 . . . . 1.0 110.983 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' TRP . . . . . 0.4 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -91.91 20.5 5.66 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.32 -0.552 . . . . 1.0 110.873 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' MET . . . . . 0.4 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 43.0 mtt 81.22 12.25 0.76 Allowed 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 123.772 0.67 . . . . 1.0 109.665 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.703 0 N-CA-C 110.962 -0.855 . . . . 1.0 110.962 179.174 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 61.8 t . . . . . 0 C--O 1.232 0.143 0 N-CA-C 109.435 -0.58 . . . . 1.0 109.435 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 85.3 mtm-85 -114.73 6.68 15.67 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.685 0.254 . . . . 1.0 111.685 -179.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -164.44 163.42 22.24 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.153 -0.619 . . . . 1.0 111.127 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 28.1 p -158.4 149.11 20.39 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.709 -0.678 . . . . 1.0 111.037 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -128.2 150.52 49.98 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.742 0.306 . . . . 1.0 110.208 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LEU . . . . . 0.443 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt -101.2 124.76 47.41 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.339 -0.986 . . . . 1.0 108.339 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ILE . . . . . 0.427 HG22 HD12 ' A' ' 82' ' ' ILE . 3.2 mt -86.03 114.33 56.56 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 116.1 -0.5 . . . . 1.0 110.577 -178.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 N--CA 1.498 1.772 0 C-N-CA 121.844 1.696 . . . . 1.0 112.274 179.687 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 C--O 1.232 0.159 0 N-CA-C 109.379 -0.601 . . . . 1.0 109.379 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.572 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 1.9 m170 -129.69 107.69 9.62 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.068 0.395 . . . . 1.0 112.068 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 57.3 ttp180 -138.21 127.61 24.69 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.468 -0.567 . . . . 1.0 109.468 177.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.3 tt -145.85 145.11 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-O 120.758 0.313 . . . . 1.0 111.286 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' ARG . . . . . 0.627 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.2 mtp180 -122.69 98.69 6.03 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.773 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.27 139.06 36.83 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.522 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' TYR . . . . . 0.408 ' CE1' ' HG3' ' A' ' 102' ' ' MET . 78.7 m-85 -115.0 134.05 55.52 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.121 -0.491 . . . . 1.0 111.141 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' GLU . . . . . 0.558 ' OE1' ' CZ ' ' A' ' 118' ' ' PHE . 20.1 pt-20 -54.33 -41.3 68.88 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.496 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' ARG . . . . . 0.49 ' O ' ' OG ' ' A' ' 123' ' ' SER . 9.9 mtt-85 -121.88 168.24 12.1 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.011 -0.541 . . . . 1.0 110.846 -178.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 121.448 0.642 . . . . 1.0 111.034 179.294 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.808 0 N-CA-C 111.403 -0.679 . . . . 1.0 111.403 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' GLN . . . . . 0.545 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 67.4 tp60 -65.01 146.78 54.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.071 0.463 . . . . 1.0 110.987 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' MET . . . . . 0.627 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 10.8 ttp -129.92 152.53 49.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.49 -0.777 . . . . 1.0 110.439 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' ILE . . . . . 0.45 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.7 tt -145.01 137.54 21.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 108.459 -0.941 . . . . 1.0 108.459 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 78.0 tt0 -111.78 141.75 45.0 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.449 0.642 . . . . 1.0 110.737 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -127.44 148.88 50.3 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 114.868 -1.06 . . . . 1.0 110.533 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.6 p -139.81 16.67 2.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.704 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 107' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.0 OUTLIER -149.41 -174.95 4.81 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.526 -0.47 . . . . 1.0 110.293 178.961 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 108' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 52.0 p-10 -74.33 141.49 45.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.335 -0.393 . . . . 1.0 111.165 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 109' ' ' CYS . . . . . 0.452 ' O ' ' OH ' ' A' ' 139' ' ' TYR . 0.8 OUTLIER -133.07 116.52 16.44 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.324 179.625 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 110' ' ' SER . . . . . 0.429 ' O ' ' OG ' ' A' ' 166' ' ' SER . 83.5 p -90.97 -21.64 21.21 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.921 0.391 . . . . 1.0 110.911 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 38.5 m -146.4 94.54 2.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.406 0.622 . . . . 1.0 109.867 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.59 -39.54 88.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.821 -1.081 . . . . 1.0 110.673 -178.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 113' ' ' GLN . . . . . 0.542 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 11.4 mp0 -49.09 -12.75 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.736 0.643 . . . . 1.0 112.736 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 114' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' A' ' 114' ' ' ASP . 61.6 t0 -88.87 -10.42 48.03 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.909 -0.774 . . . . 1.0 108.909 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -118.85 -39.52 2.95 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 114.22 1.193 . . . . 1.0 114.22 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 116' ' ' PHE . . . . . 0.623 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.08 135.2 53.4 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 122.523 1.154 . . . . 1.0 112.467 -178.898 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.13 -68.27 0.37 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.111 -0.949 . . . . 1.0 111.022 -177.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 118' ' ' PHE . . . . . 0.59 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 65.9 m-85 -42.91 141.62 1.07 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.406 -0.816 . . . . 1.0 109.61 -179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -101.15 5.7 42.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.928 0.394 . . . . 1.0 110.269 -179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -134.46 139.13 45.29 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.461 0.648 . . . . 1.0 111.344 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 121' ' ' ILE . . . . . 0.4 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 45.9 mm -119.5 123.39 71.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.853 -1.067 . . . . 1.0 108.895 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -115.08 15.72 17.11 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 111.9 0.333 . . . . 1.0 111.9 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 123' ' ' SER . . . . . 0.49 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 5.7 p 176.93 149.97 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.212 -0.662 . . . . 1.0 109.212 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 pp -159.97 156.54 27.3 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.569 -0.742 . . . . 1.0 109.856 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.21 109.31 13.25 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.194 -179.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.1 t -96.4 103.95 15.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 109.171 -0.677 . . . . 1.0 109.171 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 127' ' ' LEU . . . . . 0.44 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -74.03 -36.87 64.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.562 179.578 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 128' ' ' GLU . . . . . 0.409 ' O ' ' O ' ' A' ' 129' ' ' GLY . 21.4 pt-20 -151.55 168.58 24.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.734 -0.666 . . . . 1.0 111.007 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 129' ' ' GLY . . . . . 0.409 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 54.41 167.79 0.03 OUTLIER Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.746 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 70.5 m -113.99 145.06 42.08 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.15 -0.685 . . . . 1.0 109.15 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 131' ' ' TRP . . . . . 0.469 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 30.3 m95 -120.52 162.24 19.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.474 -0.785 . . . . 1.0 110.64 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 16.3 t -137.03 93.04 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.749 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 26.5 mt -66.09 146.15 55.0 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.21 -178.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 134' ' ' TYR . . . . . 0.583 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 60.1 m-85 -121.54 136.43 54.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.793 0.33 . . . . 1.0 111.071 178.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -48.39 -40.69 26.59 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.33 -0.395 . . . . 1.0 111.037 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 136' ' ' LEU . . . . . 0.417 ' C ' ' CD1' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -133.13 176.57 8.39 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.273 0.559 . . . . 1.0 111.069 -179.46 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.8 p -80.62 169.7 17.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.488 -0.778 . . . . 1.0 111.628 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 42.9 t30 64.98 15.51 10.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.888 -1.051 . . . . 1.0 110.614 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 139' ' ' TYR . . . . . 0.452 ' OH ' ' O ' ' A' ' 109' ' ' CYS . 7.3 m-85 42.26 79.32 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 1.0 112.536 179.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -147.39 35.45 0.88 Allowed 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.768 0.318 . . . . 1.0 110.934 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -147.11 -142.52 3.71 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.559 -0.616 . . . . 1.0 111.559 -178.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -77.1 167.1 22.37 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 110.119 -0.326 . . . . 1.0 110.119 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 143' ' ' GLN . . . . . 0.427 ' NE2' ' H ' ' A' ' 57' ' ' PHE . 1.8 pt20 -143.31 138.1 29.28 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.126 -178.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -128.99 123.05 31.39 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.065 0.393 . . . . 1.0 110.304 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 145' ' ' LEU . . . . . 0.493 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 0.7 OUTLIER -78.74 126.97 31.44 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.435 -0.802 . . . . 1.0 112.345 -178.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 40.0 mt -116.69 102.45 9.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.418 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 147' ' ' MET . . . . . 0.624 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -79.36 160.69 69.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 109.121 -0.696 . . . . 1.0 109.121 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -56.97 113.83 1.65 Allowed 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.888 1.726 . . . . 1.0 111.209 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.92 -153.91 15.95 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 110.539 -1.024 . . . . 1.0 110.539 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 150' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 53.6 p-10 -123.42 141.72 51.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.999 0.428 . . . . 1.0 110.614 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 151' ' ' TYR . . . . . 0.531 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.5 m-85 -133.17 129.32 37.65 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.952 -0.567 . . . . 1.0 109.837 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -118.27 -0.58 11.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.649 0.262 . . . . 1.0 110.331 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 153' ' ' ARG . . . . . 0.686 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.3 ptm180 -157.42 158.58 36.12 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.279 0.561 . . . . 1.0 110.36 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -74.16 -22.48 59.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 1.0 112.651 -177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 155' ' ' GLN . . . . . 0.686 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.7 mt-30 -68.32 -18.84 64.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.48 -179.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 156' ' ' ASP . . . . . 0.531 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 58.6 t0 -54.17 -47.82 71.58 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.976 -0.289 . . . . 1.0 110.691 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 157' ' ' TRP . . . . . . . . . . . . . 24.3 p90 -92.44 21.17 5.51 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 178.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.1 74.32 0.31 Allowed Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.931 -0.868 . . . . 1.0 110.931 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -118.45 153.66 33.74 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.922 0.868 . . . . 1.0 111.677 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -81.8 -17.24 48.25 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.749 -1.569 . . . . 1.0 110.141 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 161' ' ' ASN . . . . . 0.484 ' ND2' ' H ' ' A' ' 162' ' ' ALA . 2.9 t30 -168.51 -171.38 1.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.821 -0.352 . . . . 1.0 110.351 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 162' ' ' ALA . . . . . 0.484 ' H ' ' ND2' ' A' ' 161' ' ' ASN . . . -108.58 -4.95 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 1.0 110.896 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -50.93 116.15 1.85 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 120.631 0.253 . . . . 1.0 111.317 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 77.6 t -128.35 133.69 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.495 -0.557 . . . . 1.0 109.495 178.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 165' ' ' GLY . . . . . 0.408 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -110.38 -28.41 4.07 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.017 -0.433 . . . . 1.0 112.017 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 166' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 110' ' ' SER . 32.0 m -158.67 -168.56 2.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.731 0.3 . . . . 1.0 110.367 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.33 139.58 0.61 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.464 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 168' ' ' ARG . . . . . 0.583 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 8.8 ptp180 -129.68 154.2 47.38 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.675 -0.491 . . . . 1.0 109.675 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 169' ' ' ARG . . . . . 0.572 ' NH1' ' ND1' ' A' ' 88' ' ' HIS . 0.0 OUTLIER -88.46 145.08 25.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.933 -0.766 . . . . 1.0 108.933 178.742 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 57.3 t -77.26 84.74 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.069 0.462 . . . . 1.0 110.862 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.3 mp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.739 -0.664 . . . . 1.0 109.577 179.493 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.35 -0.611 . . . . 1.0 109.35 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -90.37 170.76 35.95 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.507 -1.037 . . . . 1.0 110.507 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -167.66 107.63 0.57 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.008 -0.277 . . . . 1.0 110.604 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.456 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.23 168.83 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.229 0.538 . . . . 1.0 111.206 -179.128 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 33.0 m -126.24 121.18 31.97 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 107.806 -1.183 . . . . 1.0 107.806 177.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.1 mt -106.59 134.72 49.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.008 -0.996 . . . . 1.0 110.117 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -117.18 128.25 54.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.631 -0.713 . . . . 1.0 111.461 -178.252 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -53.05 -31.87 43.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.701 -0.681 . . . . 1.0 110.301 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -115.97 160.41 20.3 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.246 0.546 . . . . 1.0 110.774 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -63.76 -173.78 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 1.0 111.047 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.89 26.69 0.48 Allowed Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.765 -0.934 . . . . 1.0 110.765 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 50.29 70.41 0.51 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.147 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -133.69 -159.63 0.98 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.915 0.388 . . . . 1.0 110.378 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.16 -150.77 0.97 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.754 -0.938 . . . . 1.0 110.754 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -68.44 145.56 53.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.738 0.304 . . . . 1.0 110.822 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -135.59 151.84 50.67 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 121.288 0.566 . . . . 1.0 110.457 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -146.24 141.38 27.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.252 -0.886 . . . . 1.0 109.995 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 73.4 tt0 -110.22 121.24 44.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.317 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.57 127.05 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.973 0.416 . . . . 1.0 111.043 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 p -117.15 10.08 13.75 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.731 -0.668 . . . . 1.0 110.589 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.0 t -155.38 166.21 34.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.969 -0.56 . . . . 1.0 110.488 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -57.74 140.18 52.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.659 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.51 146.86 48.54 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.743 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.1 p -114.87 -14.98 11.89 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.787 -0.642 . . . . 1.0 112.17 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -150.87 111.08 4.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.216 0.532 . . . . 1.0 110.352 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 24.7 mt -111.43 0.96 16.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.304 -0.862 . . . . 1.0 110.278 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.566 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 20.4 mt-30 -51.65 -48.22 87.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.009 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.566 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 24.5 Cg_endo -57.22 -33.08 95.34 Favored 'Trans proline' 0 N--CA 1.491 1.37 0 C-N-CA 121.322 1.348 . . . . 1.0 112.239 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.17 -50.61 5.2 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.427 -0.509 . . . . 1.0 110.952 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.25 128.81 54.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.872 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.7 t -95.55 -8.2 35.77 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.842 -0.617 . . . . 1.0 111.631 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.669 ' O ' ' O ' ' A' ' 75' ' ' SER . 88.6 mtm180 -145.0 -70.82 0.27 Allowed 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 112.427 0.528 . . . . 1.0 112.427 -177.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.5 t 76.69 71.68 0.07 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 122.757 0.423 . . . . 1.0 110.325 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -92.76 3.0 56.44 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.609 -0.269 . . . . 1.0 111.378 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.2 p -156.64 158.78 37.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.937 0.399 . . . . 1.0 110.181 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -156.25 153.84 29.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 1.0 111.495 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.5 mtp180 -131.94 122.45 25.63 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 108.771 -0.825 . . . . 1.0 108.771 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.69 110.83 33.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.254 0.55 . . . . 1.0 109.96 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -73.77 -43.5 58.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.296 -0.865 . . . . 1.0 110.851 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 95.7 p -160.83 160.34 30.99 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.761 -0.829 . . . . 1.0 108.761 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.05 168.29 42.8 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 111.158 -0.777 . . . . 1.0 111.158 179.255 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 171' ' ' ILE . 64.7 m -110.28 124.55 51.85 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.919 -0.771 . . . . 1.0 108.919 178.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 57.0 m95 -115.28 152.42 32.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.613 0.721 . . . . 1.0 111.616 -178.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.422 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 2.1 ttt -127.72 133.92 49.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.713 -1.131 . . . . 1.0 109.021 177.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.9 mp -109.96 134.83 51.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.882 -1.054 . . . . 1.0 110.092 -179.203 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -111.49 133.45 53.77 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.343 0.592 . . . . 1.0 111.378 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.517 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.3 pt-20 -60.4 -37.11 79.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.306 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -105.37 153.8 39.44 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.123 -0.944 . . . . 1.0 111.256 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.93 152.51 80.25 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.776 2.318 . . . . 1.0 112.818 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.448 ' C ' ' CD1' ' A' ' 51' ' ' TYR . 3.3 m-80 60.71 32.54 20.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.237 -0.892 . . . . 1.0 110.955 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.448 ' CD1' ' C ' ' A' ' 50' ' ' ASN . 0.1 OUTLIER 46.6 65.07 1.29 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.171 -0.922 . . . . 1.0 109.65 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.7 m -123.2 17.44 9.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.435 -0.802 . . . . 1.0 111.798 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -142.05 -154.28 6.13 Favored Glycine 0 N--CA 1.46 0.289 0 C-N-CA 120.687 -0.768 . . . . 1.0 111.572 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.517 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.0 tp -63.48 152.44 38.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.338 -0.431 . . . . 1.0 109.88 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.422 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 9.7 pt20 -123.72 149.28 45.73 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.646 0.26 . . . . 1.0 111.298 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -125.99 122.9 37.22 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.16 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 76.8 t80 -82.9 122.38 28.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.084 0.469 . . . . 1.0 110.139 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.6 mp -118.21 147.46 43.36 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.712 -0.676 . . . . 1.0 109.521 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' ' C ' ' A' ' 60' ' ' ARG . 5.3 ptm180 -136.39 161.82 34.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.723 -0.671 . . . . 1.0 109.897 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.404 ' C ' ' O ' ' A' ' 59' ' ' ARG . 62.3 ttp180 -38.49 124.73 1.32 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.766 0.317 . . . . 1.0 110.75 -178.068 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.6 -178.65 32.08 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.702 -0.959 . . . . 1.0 110.702 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -115.84 131.52 56.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.888 0.375 . . . . 1.0 110.491 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -125.09 113.4 17.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.419 -0.585 . . . . 1.0 109.419 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.48 -1.87 55.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.275 -0.421 . . . . 1.0 111.914 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -148.11 146.76 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.189 -1.041 . . . . 1.0 108.189 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.676 ' H ' ' HD1' ' A' ' 66' ' ' HIS . 8.7 p-80 -66.13 -45.61 80.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.047 0.451 . . . . 1.0 111.296 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 98.9 mm-40 -49.5 -9.86 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.741 -0.663 . . . . 1.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.506 ' H ' ' C ' ' A' ' 66' ' ' HIS . 14.7 mm-40 -81.46 -37.38 28.09 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 120.481 -0.487 . . . . 1.0 111.007 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.431 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -87.89 18.82 3.88 Favored 'General case' 0 CA--C 1.509 -0.62 0 C-N-CA 120.323 -0.551 . . . . 1.0 111.244 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.55 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 63.8 mtp 80.52 19.16 0.54 Allowed 'General case' 0 CA--C 1.521 -0.138 0 O-C-N 123.929 0.768 . . . . 1.0 109.833 -178.505 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.519 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . -59.24 94.32 0.06 OUTLIER Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.431 -1.067 . . . . 1.0 110.431 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.2 mt -69.4 -33.43 73.01 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.642 -0.503 . . . . 1.0 109.642 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.41 ' O ' ' O ' ' A' ' 74' ' ' ASP . 22.8 t -135.59 126.13 26.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.304 -0.407 . . . . 1.0 110.492 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.525 ' O ' ' CB ' ' A' ' 75' ' ' SER . 52.9 p-10 -55.57 -172.48 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.872 -0.788 . . . . 1.0 108.872 178.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.669 ' O ' ' O ' ' A' ' 32' ' ' ARG . 4.5 t 99.25 -122.91 0.0 OUTLIER 'General case' 0 C--O 1.21 -1.014 0 CA-C-O 118.834 -0.603 . . . . 1.0 109.546 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.524 ' CB ' ' O ' ' A' ' 75' ' ' SER . 4.6 t 89.65 102.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 108.491 -0.929 . . . . 1.0 108.491 -178.275 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -117.76 7.89 12.59 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 121.015 -0.274 . . . . 1.0 110.978 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.6 p -162.49 162.82 27.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 1.0 110.543 178.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 14.2 p -156.27 147.57 22.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.486 -0.779 . . . . 1.0 110.426 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -126.93 151.44 48.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.912 0.386 . . . . 1.0 110.241 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 17.8 tp -97.45 126.86 42.97 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 177.725 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.418 HG23 HD13 ' A' ' 82' ' ' ILE . 28.7 mt -83.34 113.8 48.87 Favored Pre-proline 0 CA--C 1.538 0.5 0 C-N-CA 120.807 -0.357 . . . . 1.0 111.337 -177.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.449 ' C ' ' CG ' ' A' ' 84' ' ' HIS . 35.7 Cg_endo -79.14 175.41 10.9 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 121.811 1.674 . . . . 1.0 111.581 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.449 ' CG ' ' C ' ' A' ' 83' ' ' PRO . 30.5 m-70 80.92 131.14 0.05 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 114.415 1.265 . . . . 1.0 114.415 176.416 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 97.0 p -160.65 -1.51 0.06 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.993 -0.549 . . . . 1.0 111.527 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.476 ' O ' ' CE1' ' A' ' 88' ' ' HIS . . . -65.38 -115.38 0.01 OUTLIER Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.49 -1.044 . . . . 1.0 110.49 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m -77.58 156.12 31.07 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.923 -0.399 . . . . 1.0 109.923 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.476 ' CE1' ' O ' ' A' ' 86' ' ' GLY . 12.6 m80 -128.19 97.15 4.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 121.104 -0.238 . . . . 1.0 111.258 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -131.59 136.41 47.76 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 120.631 -0.428 . . . . 1.0 110.647 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.4 tt -148.21 141.53 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-O 120.895 0.379 . . . . 1.0 111.486 -179.752 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -119.28 98.06 5.97 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.838 -0.619 . . . . 1.0 111.511 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.9 139.82 40.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.203 0.525 . . . . 1.0 110.171 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.587 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 55.1 m-85 -119.84 137.44 53.99 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.984 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.527 ' OE2' ' CD1' ' A' ' 118' ' ' PHE . 1.8 tm-20 -56.32 -66.52 0.42 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.722 -0.672 . . . . 1.0 111.446 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.441 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.2 mtp85 -97.25 167.83 10.79 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.272 0.558 . . . . 1.0 111.715 -177.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -59.52 166.55 2.35 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.229 -0.896 . . . . 1.0 111.558 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.553 ' O ' ' CG ' ' A' ' 98' ' ' TYR . 97.1 m-20 51.29 43.99 29.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.676 -1.147 . . . . 1.0 111.243 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.553 ' CG ' ' O ' ' A' ' 97' ' ' ASP . 12.5 p90 45.08 42.57 6.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.189 -0.914 . . . . 1.0 110.837 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.2 tpt85 -106.69 155.39 19.73 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.956 -0.566 . . . . 1.0 110.381 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 86.52 -165.34 36.96 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.891 -0.883 . . . . 1.0 110.891 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -62.97 144.12 57.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 1.0 110.81 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.587 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 6.3 ttp -131.67 148.08 52.56 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 116.345 -0.389 . . . . 1.0 111.013 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.497 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 11.4 tt -141.14 140.93 31.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.484 0 N-CA-C 109.464 -0.569 . . . . 1.0 109.464 177.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.68 137.73 50.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.639 0.733 . . . . 1.0 110.895 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.55 155.68 37.15 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.422 -1.263 . . . . 1.0 110.222 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 16.7 p -143.07 25.98 1.71 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.018 -0.537 . . . . 1.0 110.344 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -166.5 -166.86 0.91 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.842 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -76.09 141.99 41.85 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.111 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.9 m -130.6 92.56 3.27 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.079 -0.51 . . . . 1.0 109.998 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.51 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.3 m -68.48 -32.12 71.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.7 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -133.55 93.32 3.12 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.325 0.583 . . . . 1.0 110.479 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.512 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.7 tp -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.232 -0.895 . . . . 1.0 110.363 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -47.73 -9.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.697 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.512 ' H ' ' C ' ' A' ' 112' ' ' LEU . 92.5 m-20 -96.4 -25.31 15.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.035 0.445 . . . . 1.0 110.407 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.416 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.9 mmt180 -108.28 -39.96 5.31 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.662 -0.699 . . . . 1.0 111.704 -178.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.497 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 3.6 t80 -124.81 122.07 36.39 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.629 -0.508 . . . . 1.0 109.629 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 78.2 mtt-85 -60.69 -56.07 25.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.641 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.527 ' CD1' ' OE2' ' A' ' 94' ' ' GLU . 95.2 m-85 -46.73 140.04 4.85 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.945 -0.571 . . . . 1.0 109.668 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -101.5 15.02 30.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.028 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 120' ' ' GLU . 3.4 pm0 -151.51 148.66 28.31 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.833 -179.067 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 36.1 mm -123.71 125.58 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 109.547 -0.538 . . . . 1.0 109.547 178.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.557 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 16.3 m-70 -108.89 20.81 18.03 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.078 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.4 p 167.44 150.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.515 -0.55 . . . . 1.0 109.515 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 pp -161.27 156.79 24.57 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.709 -0.678 . . . . 1.0 110.285 -178.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.1 112.03 17.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.499 -0.556 . . . . 1.0 109.499 178.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 23.9 t -98.58 105.81 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.207 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.47 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.73 -45.0 22.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.957 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 29.5 tp10 -156.67 157.52 35.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.61 -0.436 . . . . 1.0 111.477 -178.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.432 ' O ' ' O ' ' A' ' 130' ' ' SER . . . 64.2 78.72 0.19 Allowed Glycine 0 C--N 1.333 0.378 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.365 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.432 ' O ' ' O ' ' A' ' 129' ' ' GLY . 4.2 m -32.28 151.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.915 0.388 . . . . 1.0 111.599 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.445 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 46.9 m95 -122.03 168.21 12.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.387 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.36 99.5 2.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.526 -0.306 . . . . 1.0 110.428 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.9 mt -74.77 141.35 44.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.612 -179.163 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -120.45 134.66 55.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.366 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -48.81 -45.03 39.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.289 -0.414 . . . . 1.0 110.79 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -126.96 169.04 13.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.261 0.553 . . . . 1.0 110.478 -178.475 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 18.4 m -75.48 176.32 7.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.303 -0.862 . . . . 1.0 111.303 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 58.21 21.37 8.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.507 -1.224 . . . . 1.0 109.801 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 35.48 78.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.606 -0.724 . . . . 1.0 111.735 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 63.2 ttt180 -149.01 45.6 1.0 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.0 0.429 . . . . 1.0 110.298 179.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -157.42 -137.51 2.31 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.764 -0.935 . . . . 1.0 110.764 -179.378 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.436 HH12 ' CG2' ' A' ' 160' ' ' THR . 82.1 mtp180 -78.85 163.26 25.46 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.958 -0.297 . . . . 1.0 110.224 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.55 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.36 136.17 29.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.987 -0.551 . . . . 1.0 110.877 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -128.23 140.4 51.92 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.134 -0.691 . . . . 1.0 109.134 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 39.0 tp -96.01 126.38 41.21 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.725 0.774 . . . . 1.0 111.425 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.578 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.1 mm? -112.68 99.5 7.98 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 114.39 -1.277 . . . . 1.0 109.733 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.481 ' N ' ' HH ' ' A' ' 151' ' ' TYR . 2.0 mpp? -73.94 167.68 33.17 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -62.91 116.43 3.55 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 121.56 1.506 . . . . 1.0 111.163 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 178.08 -158.01 22.58 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 111.021 -0.832 . . . . 1.0 111.021 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -124.78 115.69 21.11 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.081 0.467 . . . . 1.0 110.537 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.481 ' HH ' ' N ' ' A' ' 147' ' ' MET . 37.1 m-85 -107.1 129.47 54.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 1.0 109.878 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -113.15 -4.53 13.78 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.709 0.29 . . . . 1.0 110.604 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -156.38 166.35 33.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.365 0.603 . . . . 1.0 110.337 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -78.09 -20.1 52.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.016 -0.993 . . . . 1.0 112.249 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -69.6 -20.02 63.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.786 0.327 . . . . 1.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -50.42 -47.73 56.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.993 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . . . . . . . . . 24.5 p90 -97.65 22.22 9.32 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.091 0.472 . . . . 1.0 110.35 179.376 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.19 74.32 0.31 Allowed Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -121.28 149.1 43.41 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.292 0.568 . . . . 1.0 110.593 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' THR . . . . . 0.436 ' CG2' HH12 ' A' ' 142' ' ' ARG . 11.6 t -77.37 -10.73 59.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.75 -1.114 . . . . 1.0 110.198 178.023 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -172.0 -165.49 0.36 Allowed 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.131 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.557 ' CB ' ' CD2' ' A' ' 122' ' ' HIS . . . -111.7 -19.71 12.37 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.894 -0.593 . . . . 1.0 110.924 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.6 mtt180 -31.9 116.77 0.19 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.299 0.374 . . . . 1.0 111.881 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 62.4 t -126.28 137.15 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-N 116.13 -0.486 . . . . 1.0 110.575 178.9 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -116.47 -34.57 1.29 Allowed Glycine 0 N--CA 1.465 0.581 0 N-CA-C 111.597 -0.601 . . . . 1.0 111.597 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.51 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -159.47 172.22 18.28 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 120.534 -0.466 . . . . 1.0 110.88 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -157.32 142.48 17.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.539 -179.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -130.66 166.36 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.351 -0.981 . . . . 1.0 108.351 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -104.01 139.45 39.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.448 -0.796 . . . . 1.0 109.607 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 19.0 t -81.48 121.22 34.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.849 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . 0.498 ' O ' ' SG ' ' A' ' 42' ' ' CYS . 1.6 mp -122.27 129.62 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.189 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -96.46 -17.65 20.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.798 -0.637 . . . . 1.0 110.797 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -61.84 -46.05 91.15 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.862 0.363 . . . . 1.0 110.737 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.219 -0.514 0 CA-C-O 117.997 -1.002 . . . . 1.0 110.558 -179.789 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' A' ' 1' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.182 -0.673 . . . . 1.0 109.182 . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.34 178.04 47.55 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.459 -1.057 . . . . 1.0 110.459 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -172.81 103.31 0.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.124 -0.324 . . . . 1.0 110.124 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.414 HG21 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.38 166.78 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.089 0.471 . . . . 1.0 111.175 -178.418 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.5 m -124.62 121.19 34.03 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.86 -1.163 . . . . 1.0 107.86 177.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -106.19 133.72 50.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.874 -1.057 . . . . 1.0 110.244 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -115.97 125.94 53.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.351 -0.84 . . . . 1.0 111.219 -178.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -53.75 -29.7 41.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.507 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -117.84 153.85 32.81 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.292 0.567 . . . . 1.0 110.675 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.422 ' C ' ' N ' ' A' ' 12' ' ' PHE . 16.3 ptt-85 -59.58 -176.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.827 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 46.1 22.53 0.9 Allowed Glycine 0 C--N 1.33 0.211 0 N-CA-C 110.552 -1.019 . . . . 1.0 110.552 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.537 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 10.6 m-85 54.14 67.85 0.94 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -129.92 -155.66 0.71 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.029 0.443 . . . . 1.0 110.468 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.14 -152.46 0.11 Allowed Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.984 -0.846 . . . . 1.0 110.984 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -68.98 146.53 52.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.787 0.327 . . . . 1.0 110.69 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -135.55 145.19 46.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.265 0.555 . . . . 1.0 110.444 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.4 t80 -140.26 142.26 35.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.31 -0.859 . . . . 1.0 110.213 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.545 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 41.1 tt0 -110.63 122.08 46.89 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.101 -0.499 . . . . 1.0 110.154 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.435 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -109.75 126.24 53.53 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.998 0.428 . . . . 1.0 110.67 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -117.32 13.96 14.65 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.624 -0.716 . . . . 1.0 110.357 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.9 m -157.91 167.87 28.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.582 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -58.67 140.13 55.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.577 -0.738 . . . . 1.0 111.549 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.435 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.16 145.31 45.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.868 -0.605 . . . . 1.0 110.821 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.2 p -112.64 -11.92 13.48 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.976 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -149.73 117.92 6.4 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.514 0.673 . . . . 1.0 110.172 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.503 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.8 mp -113.13 -2.44 14.15 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.096 -0.956 . . . . 1.0 110.246 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.629 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.4 OUTLIER -58.15 -41.77 91.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.301 -178.867 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.9 Cg_exo -58.79 -37.7 92.53 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.175 1.917 . . . . 1.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -97.22 -51.21 4.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.919 0.39 . . . . 1.0 111.327 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.503 ' N ' ' O ' ' A' ' 26' ' ' LEU . 6.9 mt -118.55 127.95 54.1 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.735 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -94.75 -8.39 37.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.937 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -147.5 -58.04 0.25 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.955 0.354 . . . . 1.0 111.955 -178.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t 63.08 74.83 0.42 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.755 0.312 . . . . 1.0 110.174 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.578 ' ND2' ' HD1' ' A' ' 66' ' ' HIS . 1.3 t30 -90.56 3.89 52.77 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.197 -0.456 . . . . 1.0 111.284 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.537 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -157.25 155.9 31.58 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 1.0 110.051 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 155.11 35.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 1.0 111.431 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -132.74 121.41 23.01 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 108.602 -0.888 . . . . 1.0 108.602 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.3 t -108.53 117.77 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 O-C-N 123.629 0.581 . . . . 1.0 109.905 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -78.84 -43.81 24.35 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.995 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.1 m -161.2 159.38 28.76 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.316 -0.624 . . . . 1.0 109.316 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.21 174.45 50.39 Favored Glycine 0 C--N 1.316 -0.55 0 N-CA-C 110.96 -0.856 . . . . 1.0 110.96 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 98.3 m -112.85 131.0 55.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.949 -0.76 . . . . 1.0 108.949 178.523 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.414 ' CE2' HG21 ' A' ' 4' ' ' ILE . 54.6 m95 -119.26 143.21 47.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.29 0.567 . . . . 1.0 111.438 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.2 tpt -113.93 129.0 56.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.393 178.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.411 ' CD1' ' N ' ' A' ' 45' ' ' LEU . 9.6 mp -108.15 127.57 53.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.995 -0.743 . . . . 1.0 108.995 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -106.85 133.41 51.55 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.687 0.756 . . . . 1.0 111.215 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.524 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.4 pt-20 -62.66 -36.7 83.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.828 -1.078 . . . . 1.0 110.296 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -106.59 151.68 40.49 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.244 -0.889 . . . . 1.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.1 154.14 74.91 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.575 2.183 . . . . 1.0 112.737 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.462 ' N ' HD21 ' A' ' 50' ' ' ASN . 1.4 m-80 59.47 34.8 22.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.967 -1.015 . . . . 1.0 110.721 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 23' ' ' HIS . 1.5 m-85 42.93 66.22 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.34 -0.846 . . . . 1.0 110.26 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.4 m -123.58 17.31 9.61 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.283 -0.871 . . . . 1.0 111.298 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.29 -155.12 6.37 Favored Glycine 0 N--CA 1.462 0.375 0 C-N-CA 120.693 -0.765 . . . . 1.0 111.553 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.524 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.4 tp -65.82 151.99 45.41 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.459 -0.371 . . . . 1.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -123.15 152.03 41.54 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.742 0.306 . . . . 1.0 111.624 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -127.76 125.82 40.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.011 -0.541 . . . . 1.0 111.302 179.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -82.6 121.92 27.44 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.336 -0.393 . . . . 1.0 109.962 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.34 146.08 47.65 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.11 0.481 . . . . 1.0 110.311 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.467 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 42.5 mtp180 -134.69 160.42 38.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.494 -0.775 . . . . 1.0 110.283 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' A' ' 59' ' ' ARG . 9.7 ptm180 -34.02 127.32 0.42 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.829 -0.623 . . . . 1.0 111.272 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.63 -179.53 30.66 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.084 -0.807 . . . . 1.0 111.084 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.9 p-10 -116.36 125.19 51.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.161 0.505 . . . . 1.0 110.432 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -118.93 113.49 21.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.769 -0.651 . . . . 1.0 109.426 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.422 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.44 -3.31 53.35 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.669 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.422 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -148.36 141.63 25.13 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.628 -0.879 . . . . 1.0 108.628 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.578 ' HD1' ' ND2' ' A' ' 34' ' ' ASN . 22.8 p-80 -62.52 -41.41 98.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.174 0.512 . . . . 1.0 110.689 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -51.98 -8.94 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.46 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.503 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -81.31 -34.93 31.6 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.116 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -92.78 15.65 14.15 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 120.813 -0.355 . . . . 1.0 110.515 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.494 ' C ' ' H ' ' A' ' 72' ' ' LEU . 58.7 mtt 72.55 30.55 1.88 Allowed 'General case' 0 CA--C 1.514 -0.433 0 O-C-N 124.31 1.006 . . . . 1.0 109.633 -178.923 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.692 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -67.75 41.4 0.25 Allowed Glycine 0 CA--C 1.525 0.668 0 CA-C-O 118.786 -1.008 . . . . 1.0 112.834 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.494 ' H ' ' C ' ' A' ' 70' ' ' MET . 18.3 mt -6.53 -52.61 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.808 0.843 . . . . 1.0 111.741 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.692 ' N ' ' O ' ' A' ' 71' ' ' GLY . 37.1 m -110.78 120.98 44.18 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.356 -0.838 . . . . 1.0 108.98 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 40.9 p-10 -67.17 40.51 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.933 0.397 . . . . 1.0 111.188 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.552 ' H ' ' C ' ' A' ' 73' ' ' SER . 30.0 t -115.23 126.45 54.56 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.951 -0.568 . . . . 1.0 109.712 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -149.06 112.64 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -122.91 4.78 9.38 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.703 0.287 . . . . 1.0 110.723 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.7 t -166.12 163.42 18.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.199 0.523 . . . . 1.0 110.822 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -155.89 146.63 22.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.433 -0.803 . . . . 1.0 109.945 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.519 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 3.1 ptm180 -126.99 151.51 48.48 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 27.5 tp -100.05 135.22 41.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.457 -0.942 . . . . 1.0 108.457 178.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.5 mt -96.7 111.32 56.94 Favored Pre-proline 0 CA--C 1.543 0.711 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 -179.821 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -50.71 149.57 13.8 Favored 'Trans proline' 0 N--CA 1.5 1.9 0 C-N-CA 121.901 1.734 . . . . 1.0 113.295 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 61.4 m170 -68.91 179.55 1.79 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.144 -0.934 . . . . 1.0 110.311 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.1 m -164.73 153.54 12.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.354 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.437 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . -100.78 -69.59 0.88 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 109.725 -1.35 . . . . 1.0 109.725 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' SER . . . . . 0.405 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 3.8 m -80.62 144.34 32.43 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.744 -0.465 . . . . 1.0 109.744 178.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.437 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 4.8 m170 -128.06 104.17 7.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.835 -0.166 . . . . 1.0 111.379 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -136.29 139.64 42.8 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.191 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 tt -149.6 141.81 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.735 0.302 . . . . 1.0 111.389 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -119.05 98.39 6.15 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.922 -0.581 . . . . 1.0 112.237 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.1 mt -79.88 142.91 34.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.538 179.403 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.497 ' CG ' ' HB3' ' A' ' 98' ' ' TYR . 25.2 m-85 -125.41 137.68 54.01 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.822 -0.626 . . . . 1.0 111.923 -179.179 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.505 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 2.3 tm-20 -56.08 -58.14 9.18 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.791 -0.64 . . . . 1.0 111.584 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -107.36 172.34 6.88 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.173 0.511 . . . . 1.0 111.128 -178.657 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.502 ' O ' ' N ' ' A' ' 98' ' ' TYR . 97.4 mt-10 -60.77 164.72 4.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.432 -0.804 . . . . 1.0 110.735 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.535 ' C ' ' CD1' ' A' ' 98' ' ' TYR . 24.3 m-20 39.89 23.68 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.09 -0.505 . . . . 1.0 111.369 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.612 ' O ' ' CD2' ' A' ' 98' ' ' TYR . 37.9 p90 35.4 75.91 0.05 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.769 0.795 . . . . 1.0 111.885 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.464 ' NH1' ' CB ' ' A' ' 97' ' ' ASP . 46.8 mtt85 -111.99 11.13 20.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.584 -0.734 . . . . 1.0 111.385 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -136.54 -141.38 4.28 Favored Glycine 0 N--CA 1.467 0.709 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -69.04 141.55 54.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.006 0.431 . . . . 1.0 110.872 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.515 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 154.36 48.22 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.661 -0.7 . . . . 1.0 111.058 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.6 tt -145.77 139.42 21.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 N-CA-C 109.33 -0.619 . . . . 1.0 109.33 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -113.39 144.73 42.29 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.681 0.753 . . . . 1.0 111.141 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 85.2 m-85 -130.61 156.3 45.1 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 114.692 -1.14 . . . . 1.0 110.934 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.0 p -143.66 31.57 1.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.477 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -170.85 -169.08 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.628 -0.429 . . . . 1.0 110.796 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 55.2 p-10 -82.68 149.29 27.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.353 179.268 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.63 101.1 4.38 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.334 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.468 ' C ' ' HG ' ' A' ' 166' ' ' SER . 78.1 p -69.14 -19.47 64.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.635 -0.426 . . . . 1.0 111.072 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 33.7 t -149.83 91.07 1.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.155 0.502 . . . . 1.0 109.989 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.533 ' O ' ' N ' ' A' ' 115' ' ' ARG . 13.6 tp -58.97 -39.68 82.47 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.32 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.572 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 14.4 mp0 -42.75 -14.01 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.971 0.36 . . . . 1.0 111.971 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.519 ' N ' ' O ' ' A' ' 112' ' ' LEU . 55.3 t0 -93.1 0.45 57.26 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.582 0.706 . . . . 1.0 110.401 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 112' ' ' LEU . 36.8 mmt180 -132.16 -39.13 1.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 1.0 113.266 -177.438 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.684 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.91 134.7 55.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 122.19 0.995 . . . . 1.0 110.96 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 118' ' ' PHE . 38.1 mmt180 -71.47 -69.97 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.064 -1.022 . . . . 1.0 110.433 -177.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.625 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -37.29 146.84 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.968 -0.56 . . . . 1.0 110.347 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 p-10 -105.24 11.19 33.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.767 0.318 . . . . 1.0 110.962 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -140.49 141.38 35.37 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.267 0.556 . . . . 1.0 111.173 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.1 mm -121.09 126.91 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-N 115.251 -0.886 . . . . 1.0 109.498 178.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.555 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.0 m-70 -118.56 26.74 9.37 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.141 -0.481 . . . . 1.0 111.69 -178.417 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.555 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 3.8 m 165.21 151.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.449 . . . . 1.0 110.276 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.4 pp -163.79 158.12 19.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.681 -0.69 . . . . 1.0 110.78 -178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.14 117.97 26.59 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.505 -0.554 . . . . 1.0 109.505 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 23.2 t -101.92 105.01 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-N 116.235 -0.438 . . . . 1.0 110.109 179.646 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.517 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.83 -44.2 28.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.82 -0.627 . . . . 1.0 111.177 179.39 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.405 ' CG ' ' O ' ' A' ' 87' ' ' SER . 33.0 tp10 -157.72 150.25 22.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 120.695 -0.402 . . . . 1.0 111.277 -178.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.554 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.6 79.7 0.29 Allowed Glycine 0 C--O 1.229 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.0 112.322 177.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.438 ' OG ' ' O ' ' A' ' 146' ' ' LEU . 45.3 t -31.6 148.38 0.01 OUTLIER 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.345 0.593 . . . . 1.0 111.242 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.554 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 41.7 m95 -124.3 163.07 22.44 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.096 -0.956 . . . . 1.0 111.289 -177.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.9 t -132.46 138.34 52.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 N-CA-C 108.754 -0.832 . . . . 1.0 108.754 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 43.4 mt -110.39 141.74 43.04 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.679 -0.489 . . . . 1.0 109.679 179.338 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -117.74 135.3 54.13 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.209 0.318 . . . . 1.0 110.896 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -48.35 -42.08 30.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -131.33 167.27 19.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.208 0.528 . . . . 1.0 110.181 -178.684 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.4 m -72.94 175.22 6.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.858 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 62.0 16.69 8.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.856 -1.065 . . . . 1.0 109.796 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 39.24 77.86 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.533 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 73.5 mtp180 -146.57 41.18 1.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.723 0.297 . . . . 1.0 110.48 179.008 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.5 -142.8 3.54 Favored Glycine 0 N--CA 1.463 0.485 0 N-CA-C 111.31 -0.716 . . . . 1.0 111.31 -178.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -73.5 166.76 22.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 120.786 -0.366 . . . . 1.0 110.154 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -146.27 136.44 23.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.009 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -128.1 130.3 47.95 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 109.557 -0.535 . . . . 1.0 109.557 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 45.4 tp -85.51 126.95 34.25 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.342 0.591 . . . . 1.0 111.219 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.438 ' O ' ' OG ' ' A' ' 130' ' ' SER . 25.6 mt -114.75 106.5 14.28 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.156 -0.929 . . . . 1.0 109.819 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.59 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.7 160.81 65.97 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.291 -179.669 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.75 112.62 1.26 Allowed 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.302 2.001 . . . . 1.0 110.868 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.99 -152.55 12.35 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 110.538 -1.025 . . . . 1.0 110.538 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 49.0 p-10 -125.94 134.72 51.44 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.09 0.472 . . . . 1.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -124.83 124.62 42.48 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.924 -0.58 . . . . 1.0 109.638 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . 0.53 ' C ' ' OG ' ' A' ' 123' ' ' SER . 95.2 mtt-85 -112.97 1.8 15.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.626 0.25 . . . . 1.0 110.369 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.677 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.9 ptm180 -160.83 162.61 32.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.556 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.528 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -75.76 -24.06 56.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.138 -0.937 . . . . 1.0 112.314 -178.233 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.677 ' NE2' HH21 ' A' ' 153' ' ' ARG . 1.1 mt-30 -63.89 -20.18 65.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.282 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . 0.479 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 52.6 t0 -51.22 -49.31 61.32 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.365 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.424 ' HE1' ' CB ' ' A' ' 159' ' ' ALA . 26.1 p90 -96.58 19.05 12.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.026 0.441 . . . . 1.0 110.505 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.07 73.95 0.34 Allowed Glycine 0 CA--C 1.52 0.389 0 N-CA-C 111.227 -0.749 . . . . 1.0 111.227 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.477 ' O ' ' CE2' ' A' ' 154' ' ' TYR . . . -116.45 141.92 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 1.0 111.337 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -66.79 -38.68 87.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.5 -1.227 . . . . 1.0 110.238 177.477 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 21.9 m120 -145.21 -172.51 3.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.019 0.438 . . . . 1.0 110.265 179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.411 ' CB ' ' CD2' ' A' ' 122' ' ' HIS . . . -108.83 -2.06 18.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.822 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -53.99 118.13 3.76 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.001 0.429 . . . . 1.0 111.239 -178.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.87 131.23 72.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.463 -0.79 . . . . 1.0 109.49 178.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.31 -28.57 4.3 Favored Glycine 0 N--CA 1.465 0.605 0 N-CA-C 111.659 -0.576 . . . . 1.0 111.659 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.468 ' HG ' ' C ' ' A' ' 110' ' ' SER . 7.9 m -159.47 -172.3 3.66 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.938 -0.393 . . . . 1.0 109.938 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.3 pp -173.57 145.06 1.17 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.433 -0.507 . . . . 1.0 111.56 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.467 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 6.2 ptm180 -133.84 164.76 26.54 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.067 0.46 . . . . 1.0 110.285 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.33 147.03 25.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.581 -0.896 . . . . 1.0 108.581 178.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 61.2 t -79.55 84.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.157 -178.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.8 mp -133.87 118.03 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 N-CA-C 109.66 -0.496 . . . . 1.0 109.66 179.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -68.98 -36.19 77.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.58 -0.736 . . . . 1.0 110.473 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -59.54 -79.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.04 -0.527 . . . . 1.0 110.8 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.98 -1.01 . . . . 1.0 110.788 179.594 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.539 ' O ' ' NE2' ' A' ' 84' ' ' HIS . 69.6 tp60 . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.14 -0.689 . . . . 1.0 109.14 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.04 175.27 44.76 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.523 -1.031 . . . . 1.0 110.523 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -171.88 106.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.996 -0.282 . . . . 1.0 110.724 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.73 170.36 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 121.129 0.49 . . . . 1.0 111.059 -178.786 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.6 m -127.41 120.41 28.38 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.226 -1.027 . . . . 1.0 108.226 177.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.4 mt -105.87 133.43 50.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.938 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 58.2 m-85 -114.83 129.39 56.69 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.505 -0.771 . . . . 1.0 111.026 -178.536 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.535 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.5 tt0 -56.03 -23.16 31.45 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.308 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -123.73 155.22 38.25 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.045 0.45 . . . . 1.0 110.465 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.84 -174.48 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.558 -0.746 . . . . 1.0 110.501 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.46 28.64 0.61 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 110.964 -0.855 . . . . 1.0 110.964 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.546 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 6.1 m-85 49.71 67.24 0.93 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.921 -0.4 . . . . 1.0 109.921 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -128.15 -160.83 1.05 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.953 0.406 . . . . 1.0 110.58 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.92 -151.74 0.73 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.535 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.1 mtm180 -69.3 148.95 49.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.705 0.288 . . . . 1.0 110.782 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.5 p-80 -135.42 145.71 47.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.308 0.575 . . . . 1.0 110.284 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.9 t80 -140.89 141.95 34.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.127 -0.942 . . . . 1.0 109.809 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.558 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 66.7 tt0 -110.53 120.89 43.88 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.124 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -107.92 126.52 52.78 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.033 0.444 . . . . 1.0 110.747 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -117.58 12.23 14.01 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.55 -0.75 . . . . 1.0 110.385 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 35.5 p -156.94 167.09 31.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.191 0.52 . . . . 1.0 110.425 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 53.8 p-10 -58.1 142.56 46.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.555 -0.748 . . . . 1.0 111.684 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.75 147.17 44.48 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.904 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -115.45 -16.29 11.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.614 -0.721 . . . . 1.0 111.908 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -150.18 109.96 4.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 1.0 109.989 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 20.9 mt -108.43 2.36 22.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.388 -0.823 . . . . 1.0 110.41 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.615 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 10.3 mt-30 -56.89 -41.06 89.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.141 -0.482 . . . . 1.0 110.698 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.3 Cg_exo -59.34 -36.47 94.3 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.058 1.838 . . . . 1.0 111.999 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -94.21 -47.51 6.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.843 0.354 . . . . 1.0 111.24 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -120.09 127.79 52.86 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.338 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -91.26 -6.8 52.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.854 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.615 ' NE ' HD22 ' A' ' 34' ' ' ASN . 3.4 mmm-85 177.59 120.58 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t -102.09 111.35 23.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 1.0 110.498 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.615 HD22 ' NE ' ' A' ' 32' ' ' ARG . 19.2 m120 -106.01 -3.72 21.34 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.247 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.546 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 3.8 t -157.11 155.64 31.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.801 0.334 . . . . 1.0 110.371 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . 0.439 ' N ' ' HG ' ' A' ' 35' ' ' SER . . . -153.04 155.25 36.52 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.205 -179.177 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -132.7 122.04 24.01 Favored 'General case' 0 C--O 1.217 -0.641 0 N-CA-C 108.794 -0.817 . . . . 1.0 108.794 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.67 116.32 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.29 0.567 . . . . 1.0 109.799 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.29 -43.97 31.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.335 -0.848 . . . . 1.0 110.979 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.4 t -161.89 152.79 17.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 109.226 -0.657 . . . . 1.0 109.226 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.82 176.38 49.33 Favored Glycine 0 C--N 1.317 -0.501 0 N-CA-C 111.07 -0.812 . . . . 1.0 111.07 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.1 m -113.02 139.68 48.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 178.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.445 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 55.3 m95 -128.18 138.88 52.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.225 0.536 . . . . 1.0 111.268 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -107.43 127.19 53.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.357 -0.838 . . . . 1.0 109.282 178.501 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.4 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 10.2 mp -108.65 129.84 55.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.536 -0.756 . . . . 1.0 109.297 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -112.23 131.65 55.37 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.631 0.729 . . . . 1.0 111.094 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.599 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.9 pt-20 -58.88 -35.42 72.96 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.067 -0.97 . . . . 1.0 111.072 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -108.57 154.22 41.72 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.689 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -66.05 159.12 50.9 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.843 2.362 . . . . 1.0 112.866 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.599 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.8 OUTLIER 62.94 43.3 6.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.917 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 44.2 72.74 0.18 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.836 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.0 m -141.2 157.77 44.8 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.743 -0.466 . . . . 1.0 109.743 -178.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.36 -146.84 21.16 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.78 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.599 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.7 tp -79.72 144.02 34.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.971 -0.614 . . . . 1.0 110.282 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -120.73 150.7 40.57 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.45 0.167 . . . . 1.0 110.872 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -126.73 126.26 43.18 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-O 120.83 0.348 . . . . 1.0 111.318 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -82.94 122.74 28.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.955 -0.566 . . . . 1.0 109.495 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.6 mp -121.19 146.21 47.02 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.066 -0.516 . . . . 1.0 110.189 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.55 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 36.9 mtp180 -134.09 159.19 41.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.277 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.6 ptm180 -35.09 125.67 0.57 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.804 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 -178.64 32.92 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.683 -0.967 . . . . 1.0 110.683 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 42.2 p-10 -116.4 126.99 54.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.02 0.438 . . . . 1.0 110.608 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.453 ' O ' ' OG ' ' A' ' 35' ' ' SER . 43.8 m-85 -121.43 113.94 20.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.815 -0.63 . . . . 1.0 109.43 179.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.5 -2.83 53.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.637 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -147.95 140.77 24.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.835 -0.802 . . . . 1.0 108.835 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.495 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.8 p-80 -62.13 -42.03 98.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.06 0.457 . . . . 1.0 110.799 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -52.16 -8.63 0.08 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.606 -0.725 . . . . 1.0 110.665 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.495 ' H ' ' C ' ' A' ' 66' ' ' HIS . 16.9 mm-40 -83.58 -36.06 24.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.552 -0.459 . . . . 1.0 111.363 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.434 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -90.85 15.93 10.35 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.709 -0.396 . . . . 1.0 111.265 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.495 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 44.3 mtt 84.0 14.22 0.3 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 124.175 0.922 . . . . 1.0 109.574 -178.254 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.8 100.17 0.16 Allowed Glycine 0 C--N 1.339 0.711 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 37.4 mt -79.68 -33.41 41.13 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.659 -0.497 . . . . 1.0 109.659 177.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.7 t -135.67 121.62 19.96 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.471 -0.566 . . . . 1.0 109.471 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.515 ' OD2' ' NH1' ' A' ' 32' ' ' ARG . 56.4 p-10 -64.18 -153.07 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.85 -0.796 . . . . 1.0 108.85 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.509 ' O ' ' C ' ' A' ' 76' ' ' VAL . 1.3 t 91.65 -54.89 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 122.376 0.27 . . . . 1.0 111.034 179.381 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.509 ' C ' ' O ' ' A' ' 75' ' ' SER . 3.6 t 22.74 93.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 O-C-N 123.895 0.747 . . . . 1.0 110.785 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -104.45 4.95 33.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.648 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 p -163.17 162.56 25.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.263 0.554 . . . . 1.0 110.61 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.0 p -157.46 148.45 21.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 1.0 110.058 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.599 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 4.3 ptm180 -127.93 149.86 50.14 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.75 0.31 . . . . 1.0 110.397 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.9 tp -99.08 129.11 45.33 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.253 -1.017 . . . . 1.0 108.253 178.563 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 4.5 mt -90.89 114.17 60.52 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 109.893 -0.41 . . . . 1.0 109.893 -179.556 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.21 149.67 21.49 Favored 'Trans proline' 0 N--CA 1.5 1.911 0 C-N-CA 121.97 1.78 . . . . 1.0 113.215 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.539 ' NE2' ' O ' ' A' ' 1' ' ' GLN . 40.8 m170 -68.76 -179.76 1.53 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.306 -0.861 . . . . 1.0 110.295 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m -160.48 151.42 18.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.948 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -91.71 -79.73 1.4 Allowed Glycine 0 CA--C 1.52 0.385 0 N-CA-C 109.805 -1.318 . . . . 1.0 109.805 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m -85.65 159.06 19.92 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 109.664 -0.495 . . . . 1.0 109.664 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -129.78 119.26 23.12 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.706 -0.225 . . . . 1.0 110.96 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -147.86 133.78 19.13 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.6 tt -147.51 146.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.962 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -125.71 103.69 7.96 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 123.389 0.43 . . . . 1.0 111.511 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.21 149.1 25.33 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.157 0.503 . . . . 1.0 111.839 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.439 ' CD2' ' CD1' ' A' ' 98' ' ' TYR . 77.3 m-85 -125.44 138.92 54.02 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.823 -0.626 . . . . 1.0 112.396 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.469 ' N ' ' CD ' ' A' ' 94' ' ' GLU . 1.2 mm-40 -57.19 -55.25 37.22 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.803 -0.635 . . . . 1.0 111.2 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.424 ' O ' ' OG ' ' A' ' 123' ' ' SER . 75.7 mtp180 -109.68 173.24 6.42 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.238 -178.106 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -63.91 164.38 10.39 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.61 -0.723 . . . . 1.0 111.27 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.411 ' C ' ' CG ' ' A' ' 98' ' ' TYR . 92.0 m-20 43.43 25.21 0.07 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.614 -0.721 . . . . 1.0 111.256 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.604 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.1 OUTLIER 63.4 28.53 15.53 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.692 -0.685 . . . . 1.0 111.16 178.946 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -72.49 21.39 0.06 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.88 -0.6 . . . . 1.0 111.976 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.536 ' H ' ' C ' ' A' ' 98' ' ' TYR . . . -148.97 -173.73 19.93 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.874 -0.891 . . . . 1.0 110.874 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.471 ' NE2' ' H ' ' A' ' 102' ' ' MET . 53.9 tp60 -56.34 156.43 5.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.231 0.538 . . . . 1.0 110.617 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.471 ' H ' ' NE2' ' A' ' 101' ' ' GLN . 0.4 OUTLIER -127.4 146.06 50.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.954 -0.566 . . . . 1.0 110.651 -179.752 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.6 tt -141.8 140.49 30.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -114.31 143.6 44.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.573 0.701 . . . . 1.0 110.949 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.4 ' CE2' HD11 ' A' ' 112' ' ' LEU . 86.1 m-85 -130.37 154.38 47.75 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 114.781 -1.1 . . . . 1.0 110.739 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.61 11.23 1.65 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 1.0 111.151 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.964 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.5 pt-20 -160.79 79.11 0.62 Allowed 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 119.221 -0.419 . . . . 1.0 109.918 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.964 ' O ' ' O ' ' A' ' 107' ' ' GLU . 55.5 p30 18.77 167.96 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 122.434 1.112 . . . . 1.0 113.634 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 10.5 t -148.0 109.7 4.45 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 120.737 -1.227 . . . . 1.0 110.505 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.459 ' O ' ' OG ' ' A' ' 137' ' ' SER . 78.2 p -68.53 -18.58 64.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.309 -0.405 . . . . 1.0 110.9 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.423 ' SG ' ' O ' ' A' ' 110' ' ' SER . 85.1 m -151.84 88.7 1.42 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 1.0 109.819 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.564 ' O ' ' N ' ' A' ' 114' ' ' ASP . 11.9 tp -61.01 -41.49 96.64 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.163 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.5 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 24.3 mp0 -43.16 -10.29 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.285 -0.416 . . . . 1.0 112.113 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.564 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.7 t0 -95.13 -22.83 17.61 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 1.0 110.434 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.511 ' N ' ' O ' ' A' ' 112' ' ' LEU . 34.5 mmt180 -107.06 -38.67 5.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.136 0.791 . . . . 1.0 113.136 -178.657 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.66 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -119.11 138.58 52.8 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 122.035 0.922 . . . . 1.0 110.811 -179.828 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 118' ' ' PHE . 32.1 mmt180 -72.21 -73.67 0.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.11 -0.994 . . . . 1.0 110.447 -177.551 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.616 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 98.1 m-85 -33.23 143.22 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.485 0 O-C-N 123.588 0.555 . . . . 1.0 110.515 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -103.07 6.49 38.66 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.079 0.466 . . . . 1.0 110.853 -178.152 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -137.68 141.59 41.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.753 -0.658 . . . . 1.0 111.017 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 41.8 mm -121.19 116.94 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.258 -0.883 . . . . 1.0 109.582 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.438 ' O ' ' CB ' ' A' ' 123' ' ' SER . 37.7 m-70 -109.44 29.97 7.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.581 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.8 p 163.33 149.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.095 0.474 . . . . 1.0 110.078 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.9 pp -163.3 157.52 20.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.338 -178.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.91 119.62 29.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.792 0.33 . . . . 1.0 110.161 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 44.3 t -103.17 104.01 15.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 179.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.588 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.4 OUTLIER -77.91 -40.76 38.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.658 -0.701 . . . . 1.0 111.331 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -137.21 146.37 44.77 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.102 0.477 . . . . 1.0 111.26 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.55 -171.39 2.36 Favored Glycine 0 CA--C 1.519 0.327 0 N-CA-C 111.177 -0.769 . . . . 1.0 111.177 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.3 m -119.37 157.12 28.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.318 0.58 . . . . 1.0 109.877 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -129.98 162.27 29.05 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.452 -0.795 . . . . 1.0 110.753 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 47.0 t -132.32 138.34 52.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 N-CA-C 109.181 -0.674 . . . . 1.0 109.181 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 39.3 mt -110.75 143.18 41.66 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.793 -0.447 . . . . 1.0 109.793 179.101 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -117.97 133.35 56.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.756 0.312 . . . . 1.0 110.904 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 -47.41 -30.38 3.28 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.943 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.41 ' C ' ' CD1' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -140.27 177.13 8.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 1.0 110.493 -179.677 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.464 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -83.37 172.29 12.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.637 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . 0.464 ' N ' ' OG ' ' A' ' 137' ' ' SER . 6.2 m120 64.24 19.21 11.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.17 -0.923 . . . . 1.0 110.078 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 35.59 78.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.706 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 65.2 ttt180 -147.38 36.79 0.91 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.185 0.516 . . . . 1.0 110.388 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -149.25 -141.77 3.49 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 111.163 -0.775 . . . . 1.0 111.163 -178.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.25 164.89 25.98 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.058 -0.349 . . . . 1.0 110.058 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.495 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.99 137.59 29.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.791 -179.681 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -127.56 124.2 37.61 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.558 -0.534 . . . . 1.0 109.558 178.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.7 tp -81.0 127.22 32.33 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.806 -0.634 . . . . 1.0 111.048 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.1 mt -115.32 105.09 12.46 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.643 179.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.599 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.8 mtm -80.76 159.84 68.07 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.383 -0.372 . . . . 1.0 110.105 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -56.06 115.99 2.86 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.27 1.98 . . . . 1.0 110.966 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 174.75 -151.29 12.22 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 110.513 -1.035 . . . . 1.0 110.513 -179.112 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.44 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 42.2 p-10 -128.55 131.92 48.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.977 0.417 . . . . 1.0 110.954 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 14.6 m-85 -122.14 127.97 50.72 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.019 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -115.52 -1.1 12.86 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.719 0.295 . . . . 1.0 110.692 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -156.96 163.1 39.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.305 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.539 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -75.96 -22.34 56.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.055 -0.975 . . . . 1.0 111.827 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.539 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.42 -21.47 66.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.249 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -49.75 -47.32 50.87 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.909 -178.447 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.486 ' HE1' ' HB1' ' A' ' 159' ' ' ALA . 30.5 p90 -102.48 17.57 23.3 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.175 0.512 . . . . 1.0 109.95 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.57 74.17 0.32 Allowed Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.467 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.486 ' HB1' ' HE1' ' A' ' 157' ' ' TRP . . . -92.58 -171.24 2.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.35 0.595 . . . . 1.0 110.907 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.58 -35.58 3.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.985 -1.007 . . . . 1.0 112.277 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.53 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 0.3 OUTLIER -145.67 -27.4 0.45 Allowed 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 111.696 0.258 . . . . 1.0 111.696 -178.433 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.53 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 96.92 0.38 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 124.36 1.038 . . . . 1.0 110.736 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -66.55 116.07 7.12 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.139 -178.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 60.5 t -118.8 128.79 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.198 -0.91 . . . . 1.0 110.415 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.443 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -104.65 -26.02 6.65 Favored Glycine 0 N--CA 1.464 0.53 0 N-CA-C 111.393 -0.683 . . . . 1.0 111.393 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.445 ' HG ' ' C ' ' A' ' 110' ' ' SER . 4.6 m -159.44 -173.69 4.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.787 -0.365 . . . . 1.0 110.03 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 2.5 pp -171.51 144.32 1.9 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.521 -179.569 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.55 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 4.9 ptm180 -135.8 164.04 28.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.4 0.619 . . . . 1.0 109.908 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.847 HH11 ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.48 150.02 21.08 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.008 -0.997 . . . . 1.0 109.171 178.329 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 44.6 t -82.95 83.59 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.189 -178.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 2.0 mp -133.65 124.43 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-N 116.104 -0.498 . . . . 1.0 109.978 179.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.534 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 44.4 p-10 -73.86 -36.22 64.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.719 -0.673 . . . . 1.0 110.368 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.534 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 94.2 m-85 -56.67 -77.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.623 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 10.9 t . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 118.044 -0.979 . . . . 1.0 110.616 179.856 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.051 -0.722 . . . . 1.0 109.051 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -93.73 172.82 33.05 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.599 -1.0 . . . . 1.0 110.599 179.814 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -172.02 112.7 0.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 121.145 -0.222 . . . . 1.0 110.79 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.417 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -120.07 173.91 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.31 0 O-C-N 123.174 0.296 . . . . 1.0 111.057 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 29.4 m -131.36 120.62 23.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.299 -1.0 . . . . 1.0 108.299 177.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -105.12 132.64 51.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.898 -1.046 . . . . 1.0 110.027 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -114.89 129.4 56.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.241 -0.89 . . . . 1.0 111.354 -178.333 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.534 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 80.9 tt0 -55.45 -26.73 43.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.197 -0.911 . . . . 1.0 110.389 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -122.86 154.71 37.92 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.027 0.441 . . . . 1.0 110.209 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 6.5 ptp85 -58.32 -173.92 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.541 -0.754 . . . . 1.0 110.257 -179.177 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.53 27.24 0.48 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.555 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.8 m-85 49.91 67.45 0.9 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.074 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -127.19 -160.16 0.98 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.991 0.424 . . . . 1.0 110.485 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.61 -149.08 0.75 Allowed Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.882 -0.887 . . . . 1.0 110.882 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.534 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 89.8 mtm-85 -72.49 149.8 43.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.682 0.277 . . . . 1.0 110.78 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -137.48 148.8 46.34 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.279 0.562 . . . . 1.0 110.35 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.525 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.9 t80 -141.86 142.18 33.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.924 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.525 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 77.0 tt0 -110.8 122.56 48.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.121 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.33 126.59 54.38 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.707 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.6 p -118.85 11.47 12.62 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.501 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.2 p -156.1 168.8 26.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.055 -0.52 . . . . 1.0 110.536 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -59.51 138.52 57.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.68 -0.691 . . . . 1.0 111.392 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.08 143.64 48.15 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.224 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 27.6 p -111.35 -18.59 12.87 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.793 -179.118 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -148.14 110.07 4.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 1.0 110.405 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -108.11 1.0 21.98 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.179 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.538 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 47.1 mt-30 -53.34 -48.21 93.38 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.632 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.538 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 21.0 Cg_endo -56.86 -35.24 98.19 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.255 1.303 . . . . 1.0 112.881 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -91.36 -46.9 7.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.244 0.545 . . . . 1.0 110.945 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 mt -119.84 128.18 53.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.329 -0.851 . . . . 1.0 111.469 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -91.0 -15.54 29.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.351 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.456 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 59.7 ttm-85 -176.13 120.08 0.16 Allowed 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.706 -0.85 . . . . 1.0 108.706 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.7 t -99.53 109.91 22.4 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.348 -0.241 . . . . 1.0 110.348 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -103.37 -3.29 25.71 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.435 -0.348 . . . . 1.0 110.228 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.555 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.1 t -157.84 156.36 31.3 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.192 -0.299 . . . . 1.0 110.192 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.13 155.36 36.59 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.224 -0.444 . . . . 1.0 110.719 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.3 mtp85 -133.89 122.02 22.56 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.791 -0.818 . . . . 1.0 108.791 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 22.3 t -107.19 117.55 53.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.27 0.557 . . . . 1.0 110.333 179.617 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -78.77 -43.45 25.49 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.064 -0.971 . . . . 1.0 110.874 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.487 ' HG ' ' N ' ' A' ' 41' ' ' GLY . 35.8 t -162.96 162.02 25.9 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.424 -0.584 . . . . 1.0 109.424 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.487 ' N ' ' HG ' ' A' ' 40' ' ' SER . . . 78.67 177.17 48.7 Favored Glycine 0 C--N 1.315 -0.637 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.7 m -114.24 132.58 56.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.645 -0.502 . . . . 1.0 109.645 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.438 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 53.4 m95 -120.27 146.49 46.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.898 -0.592 . . . . 1.0 110.661 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.462 ' SD ' ' C ' ' A' ' 56' ' ' TYR . 22.0 tpp -120.49 131.18 54.6 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.549 -0.751 . . . . 1.0 109.212 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 10.4 mp -109.58 131.27 55.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.664 -0.698 . . . . 1.0 109.838 -179.689 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 87.9 m-85 -111.69 133.09 54.16 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.579 0.704 . . . . 1.0 111.687 -179.507 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.594 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -57.65 -36.89 72.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.125 -0.943 . . . . 1.0 111.389 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.7 mt-30 -108.11 153.25 41.91 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.635 -178.771 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -63.6 159.43 40.88 Favored 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.458 2.106 . . . . 1.0 112.172 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.654 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.53 36.9 13.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.254 -0.884 . . . . 1.0 111.332 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 50.77 75.96 0.17 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.057 -0.974 . . . . 1.0 111.071 -179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.3 m -144.07 152.97 41.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.105 0.479 . . . . 1.0 110.244 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.84 -148.16 21.53 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.038 -0.601 . . . . 1.0 111.801 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.594 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.1 tp -75.49 143.58 42.49 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.038 -0.581 . . . . 1.0 110.262 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -120.84 150.79 40.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.482 0.182 . . . . 1.0 110.591 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 26.1 m-85 -124.99 124.12 41.32 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-O 120.841 0.353 . . . . 1.0 110.585 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -83.1 123.07 29.16 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.068 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.0 mp -119.37 144.07 47.08 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.415 -0.812 . . . . 1.0 110.03 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -132.4 158.91 40.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.121 -0.945 . . . . 1.0 110.141 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.7 ttp85 -37.09 125.32 0.94 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.997 -0.547 . . . . 1.0 110.763 -178.75 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.58 -179.97 32.01 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.53 -1.028 . . . . 1.0 110.53 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -114.14 136.23 53.16 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.897 0.379 . . . . 1.0 110.19 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.446 ' O ' ' OG ' ' A' ' 35' ' ' SER . 44.0 m-85 -130.37 112.9 13.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 1.0 109.616 -179.94 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.83 -3.85 55.59 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.033 -0.531 . . . . 1.0 111.411 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.428 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 78.9 m-20 -147.6 135.7 21.36 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.13 -0.693 . . . . 1.0 109.13 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.581 ' H ' ' CD2' ' A' ' 66' ' ' HIS . 5.1 p80 -56.34 -41.06 75.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.045 0.45 . . . . 1.0 111.057 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -54.52 -6.96 0.13 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.785 -0.643 . . . . 1.0 110.617 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.496 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -82.89 -34.43 26.67 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.152 -0.619 . . . . 1.0 111.606 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . . . . . . . . . 2.3 p90 -94.51 15.68 17.3 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.743 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.475 ' C ' ' H ' ' A' ' 72' ' ' LEU . 70.2 mtp 76.18 27.89 0.85 Allowed 'General case' 0 C--O 1.224 -0.252 0 O-C-N 124.341 1.025 . . . . 1.0 109.679 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.592 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.2 39.61 0.84 Allowed Glycine 0 C--N 1.341 0.851 0 C-N-CA 119.974 -1.108 . . . . 1.0 112.073 -179.125 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.483 ' C ' ' O ' ' A' ' 71' ' ' GLY . 11.0 mt -17.12 -47.56 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.573 0.749 . . . . 1.0 110.889 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 71' ' ' GLY . 6.7 t -104.33 116.86 32.9 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.342 -0.845 . . . . 1.0 109.003 177.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -67.49 37.51 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.228 -0.442 . . . . 1.0 110.876 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.545 ' H ' ' C ' ' A' ' 73' ' ' SER . 23.9 t -116.95 126.57 53.14 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 109.557 -0.534 . . . . 1.0 109.557 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p -164.7 113.61 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 123.85 0.719 . . . . 1.0 109.212 -179.143 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -122.2 13.42 10.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.247 -0.433 . . . . 1.0 110.829 -178.668 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.4 p -163.63 162.8 24.43 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.171 0.51 . . . . 1.0 110.644 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -157.55 148.9 21.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.604 -0.726 . . . . 1.0 110.327 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.611 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 2.1 ptm180 -128.23 150.38 50.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.761 -0.459 . . . . 1.0 109.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.438 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt -101.43 124.14 46.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.088 -1.079 . . . . 1.0 108.088 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.418 ' N ' HD22 ' A' ' 81' ' ' LEU . 3.0 mt -85.65 115.75 62.83 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 109.796 -0.446 . . . . 1.0 109.796 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -53.31 152.61 19.33 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 122.34 2.027 . . . . 1.0 113.021 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.83 -179.44 2.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.479 -0.782 . . . . 1.0 110.464 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.2 t -165.09 140.6 5.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.342 -0.39 . . . . 1.0 110.972 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -85.66 -70.77 1.32 Allowed Glycine 0 CA--C 1.522 0.476 0 N-CA-C 110.146 -1.181 . . . . 1.0 110.146 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 m -89.3 153.45 20.88 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 15.5 m80 -132.3 120.12 21.68 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.486 -0.325 . . . . 1.0 110.914 -179.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -145.45 135.3 23.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.838 -0.345 . . . . 1.0 110.178 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.0 tt -148.27 144.86 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.047 -0.261 . . . . 1.0 110.582 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -124.42 99.92 6.43 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.563 0.54 . . . . 1.0 111.471 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.15 152.36 27.8 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.638 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -129.57 137.84 50.96 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.448 -0.796 . . . . 1.0 111.79 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.601 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -54.8 -56.85 14.87 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.362 -0.835 . . . . 1.0 110.978 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.601 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 78.0 mtp180 -105.57 173.87 6.12 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 110.107 -0.331 . . . . 1.0 110.107 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.617 ' O ' ' O ' ' A' ' 97' ' ' ASP . 96.1 mt-10 -58.27 159.14 6.34 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 115.829 -0.623 . . . . 1.0 110.163 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.788 ' O ' ' N ' ' A' ' 99' ' ' ARG . 6.6 m-20 53.05 127.18 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.722 0 O-C-N 124.512 1.133 . . . . 1.0 108.484 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 1.6 p90 -43.22 70.14 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.477 0.486 . . . . 1.0 111.473 -177.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.788 ' N ' ' O ' ' A' ' 97' ' ' ASP . 5.6 tpt180 -121.32 -156.14 0.67 Allowed 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.99 -0.374 . . . . 1.0 109.99 -178.277 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 99' ' ' ARG . . . 33.27 -152.54 0.01 OUTLIER Glycine 0 CA--C 1.521 0.445 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.501 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 56.5 tp60 -68.62 145.48 53.89 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.461 0.648 . . . . 1.0 111.26 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.491 ' SD ' ' O ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 151.0 51.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 1.0 111.187 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.409 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 9.4 tt -145.15 139.16 22.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -112.38 143.72 43.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.381 0.61 . . . . 1.0 110.578 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.49 ' CD1' ' SG ' ' A' ' 109' ' ' CYS . 88.6 m-85 -129.18 154.81 46.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.514 -1.221 . . . . 1.0 110.522 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.0 p -143.79 9.61 1.55 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.329 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.934 ' O ' ' O ' ' A' ' 108' ' ' ASP . 8.1 pt-20 -160.25 78.33 0.65 Allowed 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 118.851 -0.595 . . . . 1.0 109.424 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.934 ' O ' ' O ' ' A' ' 107' ' ' GLU . 12.9 p-10 22.44 167.7 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 122.491 1.139 . . . . 1.0 113.278 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.49 ' SG ' ' CD1' ' A' ' 105' ' ' PHE . 9.8 m -146.95 106.42 3.92 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 120.342 -1.474 . . . . 1.0 109.548 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.427 ' O ' ' OG ' ' A' ' 166' ' ' SER . 80.9 p -67.46 -22.53 65.49 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.395 -0.522 . . . . 1.0 110.675 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 72.0 m -143.96 95.57 2.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.246 0.546 . . . . 1.0 110.554 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.532 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.1 tp -63.62 -44.54 93.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.416 -0.811 . . . . 1.0 110.373 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.434 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 98.0 mm-40 -47.2 -9.15 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.245 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.532 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.1 m-20 -96.8 -24.99 15.65 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.988 0.423 . . . . 1.0 110.381 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.0 mmt-85 -109.41 -36.69 5.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.849 -0.614 . . . . 1.0 111.682 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.409 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 3.7 t80 -125.53 120.67 31.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.146 0.498 . . . . 1.0 109.902 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -60.36 -60.06 4.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.488 -0.778 . . . . 1.0 110.942 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -40.39 137.84 1.01 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.803 -0.443 . . . . 1.0 109.803 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.434 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 62.9 m-20 -101.94 2.38 37.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.097 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -135.13 137.88 43.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.227 0.537 . . . . 1.0 110.555 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.0 mm -120.99 122.2 67.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.025 178.139 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -112.31 21.85 15.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.413 -0.812 . . . . 1.0 111.046 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.499 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.8 p 169.29 153.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.064 0.459 . . . . 1.0 109.937 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.7 pp -165.33 158.31 16.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.523 -0.762 . . . . 1.0 110.079 -178.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . 0.406 ' ND2' HD11 ' A' ' 127' ' ' LEU . 0.1 OUTLIER -125.09 119.08 27.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.361 -179.726 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 29.6 t -102.95 104.92 17.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 115.925 -0.58 . . . . 1.0 109.785 179.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.57 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.82 -41.14 30.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.516 -0.766 . . . . 1.0 111.315 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -140.59 147.11 38.91 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.511 -0.476 . . . . 1.0 110.745 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 60.51 -175.46 4.56 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.079 -0.809 . . . . 1.0 111.079 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.1 m -117.91 153.15 34.06 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.406 -0.59 . . . . 1.0 109.406 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -126.42 159.39 33.43 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.562 -0.744 . . . . 1.0 110.73 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.4 t -130.67 136.44 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.28 -0.637 . . . . 1.0 109.28 178.885 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 37.3 mt -107.82 141.42 39.42 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 110.219 -0.289 . . . . 1.0 110.219 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -117.58 134.35 54.97 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.268 0.355 . . . . 1.0 110.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -45.74 -50.75 13.52 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.57 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.72 166.06 16.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.288 0.566 . . . . 1.0 110.279 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.1 m -68.6 177.04 2.62 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.101 -0.954 . . . . 1.0 110.936 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 12.2 m120 58.76 22.16 9.75 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.356 -1.293 . . . . 1.0 110.057 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 36.36 76.94 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.435 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -146.41 41.2 1.14 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.252 0.548 . . . . 1.0 110.166 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.52 -146.64 4.38 Favored Glycine 0 N--CA 1.462 0.386 0 N-CA-C 111.618 -0.593 . . . . 1.0 111.618 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 85.1 mtt85 -69.94 168.39 15.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.86 135.16 21.76 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 123.851 0.719 . . . . 1.0 110.89 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 7.1 m-85 -127.25 137.92 52.98 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 178.398 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -91.5 126.23 36.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.937 0.399 . . . . 1.0 110.565 -178.888 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 24.0 mt -114.93 102.73 10.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.522 179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.611 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -81.62 161.92 59.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 116.374 -0.375 . . . . 1.0 110.708 -178.937 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.61 119.15 5.95 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 121.41 1.406 . . . . 1.0 111.522 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.73 -152.42 19.45 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.344 -1.102 . . . . 1.0 110.344 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -127.15 136.4 52.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.77 0.319 . . . . 1.0 110.352 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.513 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 27.6 m-85 -126.6 129.01 47.71 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.172 -0.467 . . . . 1.0 109.766 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -116.33 -3.1 11.97 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.882 0.373 . . . . 1.0 110.291 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.663 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -156.19 159.16 38.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.518 0.675 . . . . 1.0 110.191 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.468 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.8 p90 -74.68 -20.87 59.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.562 -1.199 . . . . 1.0 112.286 -177.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.663 ' NE2' HH21 ' A' ' 153' ' ' ARG . 50.1 mt-30 -68.44 -19.48 64.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.252 -0.431 . . . . 1.0 111.09 -179.435 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . 0.513 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 54.4 t0 -51.5 -50.13 60.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.101 -0.5 . . . . 1.0 110.914 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.468 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 14.4 p90 -94.43 21.5 7.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.041 0.448 . . . . 1.0 110.443 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.68 75.18 0.23 Allowed Glycine 0 CA--C 1.519 0.343 0 N-CA-C 111.148 -0.781 . . . . 1.0 111.148 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.429 ' CB ' ' HE1' ' A' ' 157' ' ' TRP . . . -117.82 147.91 42.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.124 0.488 . . . . 1.0 110.03 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 160' ' ' THR . . . . . 0.488 ' O ' ' ND2' ' A' ' 161' ' ' ASN . 15.1 t -76.49 -20.51 56.89 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.003 -0.998 . . . . 1.0 109.91 177.904 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 160' ' ' THR . 12.1 m120 -162.3 -171.04 2.66 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.5 -0.48 . . . . 1.0 110.497 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -108.82 -10.81 15.1 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.569 179.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -47.28 117.03 1.59 Allowed 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 120.614 0.245 . . . . 1.0 111.266 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 55.8 t -131.14 124.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.76 177.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -100.05 -24.62 9.58 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 111.464 -0.654 . . . . 1.0 111.464 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 110' ' ' SER . 6.0 m -159.82 -171.0 3.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.006 -0.368 . . . . 1.0 110.006 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 pp -172.54 142.17 1.22 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.945 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -132.93 162.66 31.04 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.861 -0.422 . . . . 1.0 109.861 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.437 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -95.49 154.3 17.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.542 -0.754 . . . . 1.0 109.63 178.522 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 49.4 t -88.25 88.62 2.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 O-C-N 122.105 -0.372 . . . . 1.0 111.944 -178.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.8 mp -137.04 123.15 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 121.137 0.494 . . . . 1.0 109.88 179.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.524 ' OD1' ' CD2' ' A' ' 173' ' ' PHE . 43.7 p-10 -70.19 -35.04 73.66 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.685 -0.689 . . . . 1.0 110.167 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.524 ' CD2' ' OD1' ' A' ' 172' ' ' ASP . 96.7 m-85 -64.54 173.41 2.15 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.602 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 118.046 -0.978 . . . . 1.0 110.512 -179.979 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.48 ' O ' ' O ' ' A' ' 2' ' ' GLY . 87.9 mt-30 . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.514 -0.55 . . . . 1.0 109.514 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.48 ' O ' ' O ' ' A' ' 1' ' ' GLN . . . 51.59 167.71 0.01 OUTLIER Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.818 -0.913 . . . . 1.0 110.818 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -173.78 98.92 0.11 Allowed 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.829 -0.348 . . . . 1.0 110.571 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.02 164.48 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-O 120.781 0.324 . . . . 1.0 110.487 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 32.9 m -124.17 119.94 30.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.919 -1.141 . . . . 1.0 107.919 177.066 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.0 mt -104.17 133.88 48.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.799 -1.091 . . . . 1.0 109.776 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.4 m-85 -116.12 126.5 53.8 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.383 -0.826 . . . . 1.0 111.067 -178.731 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.532 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 79.2 tt0 -52.74 -33.63 49.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.657 -0.701 . . . . 1.0 110.289 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -113.35 161.29 17.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.245 0.545 . . . . 1.0 110.655 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 14.6 ptt-85 -65.22 -175.94 0.26 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.271 -0.877 . . . . 1.0 110.673 -179.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.61 26.29 1.04 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 110.662 -0.975 . . . . 1.0 110.662 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 50.53 70.05 0.56 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.346 -0.427 . . . . 1.0 110.102 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -133.43 -159.78 0.99 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.914 0.388 . . . . 1.0 110.319 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.28 -152.1 0.82 Allowed Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.731 -0.947 . . . . 1.0 110.731 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 91.1 mtm-85 -68.83 146.01 53.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.673 0.273 . . . . 1.0 110.998 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -136.64 153.79 50.82 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 121.223 0.535 . . . . 1.0 110.688 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 8.2 t80 -147.4 141.78 26.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.253 -0.885 . . . . 1.0 110.086 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.453 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.2 tt0 -110.21 124.72 52.1 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.571 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -114.42 126.53 55.08 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.337 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t -117.28 9.89 13.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.877 -0.601 . . . . 1.0 110.189 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.3 m -154.4 166.37 33.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.892 -0.594 . . . . 1.0 110.563 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -59.25 138.67 57.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.5 -0.773 . . . . 1.0 111.576 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.28 142.21 48.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.412 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.515 ' O ' ' OG ' ' A' ' 78' ' ' SER . 21.0 p -109.82 -10.07 14.78 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.66 -0.7 . . . . 1.0 112.274 -178.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -156.88 114.4 3.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.291 0.567 . . . . 1.0 110.09 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -116.93 1.26 12.63 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.512 -0.767 . . . . 1.0 110.75 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.6 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 4.4 mt-30 -52.93 -43.24 93.7 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.31 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.6 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 37.6 Cg_exo -58.62 -33.51 98.23 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.063 1.842 . . . . 1.0 111.616 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -95.5 -53.1 3.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 120.734 -0.386 . . . . 1.0 110.754 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 mt -116.81 127.61 54.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 1.0 110.804 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 t -94.74 -7.12 41.47 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.862 -0.608 . . . . 1.0 112.148 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.401 ' CD ' HD22 ' A' ' 34' ' ' ASN . 35.8 ttm180 -151.83 -55.29 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.229 0.455 . . . . 1.0 112.229 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.9 t 62.34 80.03 0.24 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 1.0 110.975 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.401 HD22 ' CD ' ' A' ' 32' ' ' ARG . 94.7 m-20 -94.64 3.44 55.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.733 -0.212 . . . . 1.0 111.551 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 p -157.33 159.09 37.14 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.839 -0.345 . . . . 1.0 110.419 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.15 155.24 33.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 1.0 111.512 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.452 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 26.4 mtp85 -134.89 124.48 25.08 Favored 'General case' 0 C--O 1.211 -0.96 0 N-CA-C 108.801 -0.815 . . . . 1.0 108.801 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.1 t -108.92 134.48 50.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.06 -0.719 . . . . 1.0 109.06 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.25 -43.39 8.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 1.0 110.241 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 p -159.58 156.52 28.16 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.735 -0.839 . . . . 1.0 108.735 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.46 174.18 50.21 Favored Glycine 0 C--N 1.316 -0.547 0 N-CA-C 110.959 -0.856 . . . . 1.0 110.959 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.6 m -111.74 142.55 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.415 -0.587 . . . . 1.0 109.415 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 54.6 m95 -131.06 150.47 52.13 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.45 0.643 . . . . 1.0 111.254 -179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.498 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 37.6 ttm -128.47 133.26 48.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.964 -1.016 . . . . 1.0 108.908 178.018 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.92 137.6 47.47 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 -179.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 40.9 m-85 -110.95 132.01 54.57 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.628 0.728 . . . . 1.0 110.277 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.585 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -59.36 -35.09 73.25 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.184 -0.916 . . . . 1.0 110.962 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.405 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.7 mt-30 -110.44 152.43 43.31 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.602 -178.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -63.05 157.09 50.91 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.592 2.195 . . . . 1.0 113.133 178.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.628 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.8 OUTLIER 64.33 35.95 9.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.3 -0.864 . . . . 1.0 111.268 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 51.89 76.28 0.18 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.01 -0.996 . . . . 1.0 111.119 -179.91 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.5 m -144.98 154.87 43.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.015 0.436 . . . . 1.0 109.976 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.88 -149.79 22.56 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.97 -0.633 . . . . 1.0 112.143 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.585 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.3 tp -75.24 142.74 43.34 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.023 -0.589 . . . . 1.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 2.9 pt20 -121.1 151.92 39.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -128.77 125.89 38.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.294 -0.412 . . . . 1.0 110.881 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -84.52 122.69 29.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.986 0.422 . . . . 1.0 110.471 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.6 mp -117.25 146.1 43.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.329 0.585 . . . . 1.0 110.06 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' C ' ' A' ' 60' ' ' ARG . 40.1 mtp180 -131.76 160.82 34.43 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.374 -0.83 . . . . 1.0 109.896 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.5 ttt180 -37.25 125.51 0.99 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.769 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.7 -178.42 33.14 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.508 -1.037 . . . . 1.0 110.508 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.452 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 70.9 m-20 -117.77 124.63 48.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.902 0.382 . . . . 1.0 110.533 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -117.26 113.27 21.93 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.196 -0.668 . . . . 1.0 109.196 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.413 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.91 -2.89 55.43 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.707 -179.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.413 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.4 m-20 -147.98 139.23 23.48 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.576 -0.898 . . . . 1.0 108.576 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.556 ' H ' ' HD1' ' A' ' 66' ' ' HIS . 12.2 p-80 -59.24 -43.52 92.39 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.599 -0.44 . . . . 1.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 98.7 mm-40 -50.77 -9.46 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.86 -0.609 . . . . 1.0 111.12 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.478 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.1 mm-40 -82.36 -35.57 27.66 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.265 -0.574 . . . . 1.0 111.15 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.431 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.53 17.79 7.02 Favored 'General case' 0 CA--C 1.507 -0.673 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.534 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 37.6 mtt 80.37 16.47 0.69 Allowed 'General case' 0 CA--C 1.521 -0.152 0 O-C-N 124.013 0.82 . . . . 1.0 109.94 -178.568 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.472 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . -61.0 100.88 0.26 Allowed Glycine 0 C--N 1.337 0.624 0 N-CA-C 110.576 -1.009 . . . . 1.0 110.576 178.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 47.5 mt -78.7 -29.36 45.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.69 -0.485 . . . . 1.0 109.69 177.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.541 ' C ' ' H ' ' A' ' 75' ' ' SER . 96.1 p -131.83 121.68 24.5 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 109.964 -0.384 . . . . 1.0 109.964 178.595 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 53.2 p-10 -72.04 35.84 0.06 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.867 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.541 ' H ' ' C ' ' A' ' 73' ' ' SER . 7.2 p -111.67 72.67 0.79 Allowed 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 116.14 -0.482 . . . . 1.0 110.304 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.0 t -99.77 117.93 45.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 N-CA-C 109.301 -0.629 . . . . 1.0 109.301 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.404 ' O ' ' OG ' ' A' ' 78' ' ' SER . 85.7 mtm-85 -124.34 5.09 8.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.372 -0.376 . . . . 1.0 111.628 -178.798 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.515 ' OG ' ' O ' ' A' ' 24' ' ' THR . 30.7 m -165.06 162.23 20.21 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.238 0.542 . . . . 1.0 111.202 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.1 p -154.42 146.72 23.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.285 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.439 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 4.5 ptm180 -128.42 150.58 50.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.415 -0.357 . . . . 1.0 110.192 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 20.7 tp -99.58 134.57 42.28 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.046 -1.094 . . . . 1.0 108.046 177.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 6.4 mt -94.82 131.33 30.7 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.737 -0.468 . . . . 1.0 109.737 -179.299 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.63 146.74 68.22 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 122.159 1.906 . . . . 1.0 113.158 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 p80 -74.61 -179.66 4.22 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.37 -0.832 . . . . 1.0 110.487 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 40.5 t -172.11 152.63 2.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.299 -0.409 . . . . 1.0 111.489 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -90.46 -68.22 1.2 Allowed Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.512 -1.035 . . . . 1.0 110.512 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m -89.73 153.61 20.57 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.869 -0.419 . . . . 1.0 109.869 179.087 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.591 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 8.2 m80 -134.09 119.79 19.36 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.52 -0.309 . . . . 1.0 111.013 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -142.24 134.01 27.0 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.617 -0.433 . . . . 1.0 110.398 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.5 tt -145.52 140.5 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.83 0.347 . . . . 1.0 110.769 -179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.546 ' NH2' ' SD ' ' A' ' 102' ' ' MET . 77.0 mtp85 -120.14 98.03 5.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.164 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -79.17 140.89 37.63 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.126 0.489 . . . . 1.0 110.998 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -118.21 134.9 54.61 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-N 115.359 -0.837 . . . . 1.0 111.141 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -55.18 -59.18 5.13 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.688 179.378 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.48 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.3 mtt85 -98.68 162.93 12.86 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.44 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -44.4 156.07 0.08 Allowed 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.677 0.751 . . . . 1.0 111.017 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.577 ' O ' ' CD1' ' A' ' 98' ' ' TYR . 16.5 m-20 61.11 -108.24 0.33 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.525 -1.216 . . . . 1.0 110.371 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.577 ' CD1' ' O ' ' A' ' 97' ' ' ASP . 1.2 m-85 -149.51 40.33 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.599 -0.44 . . . . 1.0 110.392 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -102.5 153.31 20.18 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 109.309 -0.626 . . . . 1.0 109.309 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.55 -168.53 44.06 Favored Glycine 0 CA--C 1.521 0.413 0 N-CA-C 110.835 -0.906 . . . . 1.0 110.835 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.417 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 9.4 tp-100 -65.7 143.85 57.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 1.0 110.926 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.546 ' SD ' ' NH2' ' A' ' 91' ' ' ARG . 2.1 ptm -129.82 152.06 49.72 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.673 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.9 tt -144.38 140.81 24.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.504 -0.554 . . . . 1.0 109.504 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . 0.503 ' OE1' ' NH1' ' A' ' 91' ' ' ARG . 80.6 tt0 -115.04 146.81 40.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.637 0.732 . . . . 1.0 111.398 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -132.17 155.58 47.94 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 114.647 -1.16 . . . . 1.0 110.737 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.8 p -144.04 15.84 1.72 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.526 -0.761 . . . . 1.0 110.314 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.2 pm0 -151.54 -172.97 4.37 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.602 -0.439 . . . . 1.0 110.286 178.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 66.4 t0 -74.76 140.17 43.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.771 0.319 . . . . 1.0 110.865 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.518 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.9 m -133.71 91.38 2.83 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.56 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -64.68 -27.28 68.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.37 -0.377 . . . . 1.0 111.082 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.4 t -137.79 95.66 3.09 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.285 0.564 . . . . 1.0 110.429 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.47 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -60.62 -41.24 94.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.156 -0.929 . . . . 1.0 110.423 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.532 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 10.8 mp0 -47.83 -13.37 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.895 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.445 ' H ' ' C ' ' A' ' 112' ' ' LEU . 82.3 m-20 -91.46 1.41 57.15 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.767 0.794 . . . . 1.0 109.714 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.47 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.1 mmt-85 -131.02 -40.11 1.18 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.09 -1.413 . . . . 1.0 113.613 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.654 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.61 137.29 54.39 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 122.29 1.043 . . . . 1.0 111.471 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 118' ' ' PHE . 29.4 mmt180 -69.83 -69.19 0.36 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 121.47 -0.768 . . . . 1.0 111.137 -177.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.601 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 81.3 m-85 -37.86 145.73 0.07 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.313 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 2.6 p30 -104.21 9.18 36.22 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.77 0.319 . . . . 1.0 111.028 -178.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -138.49 140.22 39.11 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.147 0.498 . . . . 1.0 111.204 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.402 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 36.8 mm -120.96 124.04 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 115.33 -0.85 . . . . 1.0 109.25 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -112.8 21.26 15.7 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.733 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.5 p 169.77 153.7 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.067 0.461 . . . . 1.0 109.959 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.5 pp -164.2 158.21 18.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.568 -178.29 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.25 115.11 19.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.659 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.5 t -98.72 104.84 16.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 109.458 -0.571 . . . . 1.0 109.458 178.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.513 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.86 -39.59 42.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 1.0 111.262 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -146.65 148.83 32.46 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.848 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 66.47 175.13 6.35 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.772 -0.931 . . . . 1.0 110.772 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 m -116.83 150.54 38.21 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.058 -0.719 . . . . 1.0 109.058 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.416 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 43.8 m95 -124.09 167.38 14.3 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.638 -178.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 39.9 t -138.42 105.63 3.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.558 -0.292 . . . . 1.0 110.331 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 13.3 mt -78.62 142.78 36.97 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.068 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -121.55 136.69 54.93 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.711 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -47.88 -46.8 31.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.519 -0.309 . . . . 1.0 110.412 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -127.8 165.27 20.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.421 0.629 . . . . 1.0 110.343 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 55.6 m -69.92 -179.11 1.74 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.96 -1.018 . . . . 1.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . 0.433 ' CB ' HH21 ' A' ' 140' ' ' ARG . 15.4 m120 55.92 19.6 3.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.555 -1.202 . . . . 1.0 109.466 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.569 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 17.4 m-85 37.67 77.22 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.593 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.433 HH21 ' CB ' ' A' ' 138' ' ' ASN . 76.9 mtm180 -145.22 41.98 1.28 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.029 0.442 . . . . 1.0 110.637 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -154.5 -145.78 4.25 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 111.397 -0.681 . . . . 1.0 111.397 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.28 164.31 25.95 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.835 -0.432 . . . . 1.0 109.835 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.534 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.43 137.47 30.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.395 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -129.9 139.74 51.08 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.086 -0.709 . . . . 1.0 109.086 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 tp -93.18 125.76 37.94 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.494 0.664 . . . . 1.0 111.959 -179.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.563 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.4 mm? -112.42 98.39 7.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.751 -1.113 . . . . 1.0 108.758 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.516 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -75.8 164.18 62.19 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 109.9 -0.407 . . . . 1.0 109.9 -179.203 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -58.68 118.62 5.53 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 C-N-CA 120.665 0.91 . . . . 1.0 110.445 178.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 171.7 -155.58 24.28 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.59 -1.004 . . . . 1.0 110.59 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -125.56 135.07 51.84 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.805 0.336 . . . . 1.0 110.766 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.487 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.8 m-85 -125.26 130.56 52.3 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.161 -0.472 . . . . 1.0 109.849 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -115.81 -2.74 12.31 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.828 0.347 . . . . 1.0 110.087 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -156.78 159.91 38.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.579 0.704 . . . . 1.0 110.088 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.4 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 7.7 p90 -73.68 -19.85 60.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.639 -1.164 . . . . 1.0 112.201 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.32 -19.6 63.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.368 -0.378 . . . . 1.0 111.402 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -51.33 -47.82 62.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.944 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.4 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 27.2 p90 -95.82 22.67 7.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.954 0.406 . . . . 1.0 110.654 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.56 74.4 0.29 Allowed Glycine 0 CA--C 1.52 0.384 0 N-CA-C 111.248 -0.741 . . . . 1.0 111.248 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -119.06 148.31 43.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.525 0.678 . . . . 1.0 111.018 -179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 160' ' ' THR . . . . . 0.496 ' O ' ' ND2' ' A' ' 161' ' ' ASN . 0.0 OUTLIER -75.77 -25.67 56.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.277 -1.329 . . . . 1.0 109.874 177.7 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.496 ' ND2' ' O ' ' A' ' 160' ' ' THR . 13.8 m120 -158.15 -171.19 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.042 0.449 . . . . 1.0 110.508 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 121' ' ' ILE . . . -107.59 -18.17 13.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.693 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -37.71 118.88 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.85 0.357 . . . . 1.0 111.866 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 18.9 t -122.36 159.38 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 115.858 -0.61 . . . . 1.0 109.65 178.232 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.406 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -136.72 -34.88 0.21 Allowed Glycine 0 N--CA 1.462 0.4 0 N-CA-C 111.207 -0.757 . . . . 1.0 111.207 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.4 p -158.11 -174.06 4.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.847 0.356 . . . . 1.0 110.109 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -169.53 137.56 1.81 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.143 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.569 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 12.4 ptp180 -133.17 154.45 50.61 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.591 ' NH1' ' ND1' ' A' ' 88' ' ' HIS . 0.0 OUTLIER -84.84 152.35 23.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.962 -0.563 . . . . 1.0 109.653 178.428 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 47.3 t -88.01 83.13 2.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.262 -0.426 . . . . 1.0 111.559 -179.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.0 mp -138.62 120.79 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.336 179.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -67.35 -39.58 85.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.684 -0.689 . . . . 1.0 110.48 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -70.05 -91.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.655 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 118.067 -0.968 . . . . 1.0 110.465 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.37 -0.604 . . . . 1.0 109.37 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -173.64 179.2 45.17 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.602 -0.999 . . . . 1.0 110.602 -179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -169.67 138.63 1.89 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.29 -0.263 . . . . 1.0 110.29 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.437 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -147.03 168.77 4.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.337 -0.392 . . . . 1.0 110.786 179.474 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.1 m -128.39 120.67 27.41 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.325 -0.991 . . . . 1.0 108.325 175.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.25 132.77 50.15 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.318 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 60.7 m-85 -115.35 125.9 53.77 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.331 -0.849 . . . . 1.0 110.883 -178.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -53.96 -27.37 30.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.613 -0.721 . . . . 1.0 110.633 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -119.48 154.57 33.58 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.119 0.485 . . . . 1.0 110.142 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 12' ' ' PHE . 32.4 ptt85 -59.39 -172.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.515 -0.766 . . . . 1.0 110.266 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.65 25.49 0.2 Allowed Glycine 0 N--CA 1.461 0.304 0 N-CA-C 111.008 -0.837 . . . . 1.0 111.008 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 7.8 m-85 51.69 69.01 0.71 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.062 -0.348 . . . . 1.0 110.062 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -131.17 -158.83 0.92 Allowed 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.008 0.432 . . . . 1.0 110.635 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.57 -151.96 0.43 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.875 -0.89 . . . . 1.0 110.875 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -68.97 146.81 52.43 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.961 -0.296 . . . . 1.0 110.621 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -136.48 150.29 48.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.221 0.534 . . . . 1.0 110.196 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -143.78 142.09 30.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.396 -0.82 . . . . 1.0 110.089 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.7 tt0 -110.48 122.18 47.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.958 -0.564 . . . . 1.0 110.313 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.22 127.91 55.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.456 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 79.4 p -118.66 12.99 13.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.407 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 54.9 m -158.63 172.71 17.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.543 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 46.8 p-10 -62.3 137.49 58.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.572 -0.74 . . . . 1.0 111.279 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.82 149.17 52.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.783 -0.644 . . . . 1.0 110.093 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 p -119.46 -18.4 8.51 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.26 -0.882 . . . . 1.0 112.196 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -143.54 109.52 5.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.994 0.426 . . . . 1.0 110.074 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.406 ' O ' ' N ' ' A' ' 30' ' ' LEU . 19.8 mt -116.17 -5.57 11.88 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.735 -0.666 . . . . 1.0 110.421 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.59 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -45.33 -52.45 21.69 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.889 -0.596 . . . . 1.0 109.92 178.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.59 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.3 Cg_endo -54.19 -30.29 60.54 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 C-N-CA 121.97 1.78 . . . . 1.0 111.767 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.529 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -96.27 -55.14 3.04 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.843 0.354 . . . . 1.0 110.273 -178.832 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.4 mt -117.4 125.28 50.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.867 -0.606 . . . . 1.0 110.274 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -93.59 -9.77 36.97 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.825 -0.625 . . . . 1.0 111.752 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.446 ' CD ' HD22 ' A' ' 34' ' ' ASN . 43.5 ttm180 -147.32 -63.71 0.28 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.737 -178.228 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 51.8 t 71.01 83.61 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.31 0.381 . . . . 1.0 110.06 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.446 HD22 ' CD ' ' A' ' 32' ' ' ARG . 92.1 m-20 -97.29 5.74 49.47 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.945 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.553 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 2.0 t -160.32 158.05 29.07 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.67 -0.412 . . . . 1.0 109.978 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.99 155.37 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.048 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.437 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.6 mtp85 -133.54 121.66 22.44 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 108.506 -0.924 . . . . 1.0 108.506 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -107.51 117.78 53.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.397 0.618 . . . . 1.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -77.24 -43.64 32.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.91 -1.041 . . . . 1.0 110.508 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.4 t -163.38 162.89 25.16 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.31 176.33 48.58 Favored Glycine 0 C--N 1.317 -0.508 0 N-CA-C 110.982 -0.847 . . . . 1.0 110.982 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.4 m -112.09 126.29 55.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.571 -0.529 . . . . 1.0 109.571 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.452 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 50.8 m95 -115.31 149.28 38.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.856 -0.611 . . . . 1.0 111.091 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 2.1 ttt -128.46 133.27 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.408 -0.814 . . . . 1.0 109.592 178.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.417 ' CD2' ' N ' ' A' ' 45' ' ' LEU . 0.2 OUTLIER -110.84 140.33 45.38 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.761 -178.804 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.713 ' HH ' HH11 ' A' ' 80' ' ' ARG . 27.5 m-85 -113.48 132.38 55.68 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.269 0.556 . . . . 1.0 110.898 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.516 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.2 pt-20 -60.34 -36.19 77.41 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.539 -0.755 . . . . 1.0 110.263 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -100.87 151.53 37.63 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.286 -0.87 . . . . 1.0 110.038 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.485 ' C ' HD21 ' A' ' 50' ' ' ASN . 18.6 Cg_endo -55.32 149.77 44.44 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 121.792 1.662 . . . . 1.0 110.689 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.737 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.5 OUTLIER 71.24 -116.88 0.08 Allowed 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.572 -0.899 . . . . 1.0 108.572 -177.874 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -151.74 70.92 0.96 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.778 -0.646 . . . . 1.0 109.884 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -138.08 15.4 2.84 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.82 0.343 . . . . 1.0 110.903 -178.271 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.8 -176.66 14.5 Favored Glycine 0 C--N 1.321 -0.285 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.516 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.5 tp -51.75 150.0 4.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -123.87 153.39 41.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.911 0.386 . . . . 1.0 110.877 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -132.46 125.9 31.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.159 178.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -83.9 124.02 30.55 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.255 -0.429 . . . . 1.0 110.414 -179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 mp -121.15 146.86 46.32 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.351 0.596 . . . . 1.0 110.383 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.402 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtp180 -132.67 160.41 36.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.108 -0.951 . . . . 1.0 110.562 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 59' ' ' ARG . 79.6 ttt-85 -38.47 125.04 1.34 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.617 -0.719 . . . . 1.0 110.441 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.59 -179.73 32.2 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.382 -1.087 . . . . 1.0 110.382 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -114.63 131.8 56.59 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.866 0.365 . . . . 1.0 110.297 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.426 ' O ' ' OG ' ' A' ' 35' ' ' SER . 41.3 m-85 -125.11 113.34 17.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.049 -0.523 . . . . 1.0 109.851 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.32 -4.18 56.09 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.416 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 72.1 m-20 -147.43 141.99 26.53 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.534 ' CD2' ' OD1' ' A' ' 74' ' ' ASP . 15.5 p-80 -62.12 -41.75 98.55 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.466 . . . . 1.0 111.215 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -53.73 -6.51 0.08 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.702 -0.681 . . . . 1.0 110.363 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.529 ' H ' ' C ' ' A' ' 66' ' ' HIS . 19.4 mm-40 -83.66 -34.86 24.92 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.613 -0.435 . . . . 1.0 111.354 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.489 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -94.13 18.21 11.19 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.668 -0.413 . . . . 1.0 110.901 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.626 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 4.2 mtt 80.03 17.23 0.72 Allowed 'General case' 0 C--N 1.338 0.096 0 O-C-N 123.593 0.558 . . . . 1.0 110.774 -178.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.48 99.17 0.14 Allowed Glycine 0 C--N 1.341 0.855 0 N-CA-C 110.097 -1.201 . . . . 1.0 110.097 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 27.4 mt -67.41 -34.27 76.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.764 -0.458 . . . . 1.0 109.764 177.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.565 ' C ' ' H ' ' A' ' 75' ' ' SER . 30.9 t -130.86 129.34 42.18 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.927 -0.398 . . . . 1.0 109.927 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.534 ' OD1' ' CD2' ' A' ' 66' ' ' HIS . 1.8 m-20 -66.84 39.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.363 -0.381 . . . . 1.0 110.817 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.565 ' H ' ' C ' ' A' ' 73' ' ' SER . 40.9 t -115.22 123.8 49.78 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.499 -0.556 . . . . 1.0 109.499 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -149.83 103.12 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -115.65 4.2 14.06 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 120.667 0.27 . . . . 1.0 111.514 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.7 p -162.84 160.93 25.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.058 0.456 . . . . 1.0 110.584 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.77 148.29 22.43 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.577 -0.738 . . . . 1.0 110.605 -178.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.713 HH11 ' HH ' ' A' ' 46' ' ' TYR . 5.5 ptm180 -128.18 150.03 50.18 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 110.027 -0.361 . . . . 1.0 110.027 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.452 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.6 tt -101.8 124.27 47.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.887 -0.783 . . . . 1.0 108.887 178.51 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.445 HG23 HD12 ' A' ' 82' ' ' ILE . 6.4 mt -85.34 116.09 64.07 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 115.99 -0.55 . . . . 1.0 109.974 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -52.59 148.52 27.09 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.364 2.043 . . . . 1.0 113.107 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -71.64 -179.46 2.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.402 -0.817 . . . . 1.0 110.471 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.9 t -167.06 143.0 4.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.797 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -83.92 -69.41 1.38 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 110.086 -1.206 . . . . 1.0 110.086 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.3 m -89.61 157.13 18.16 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.712 -0.477 . . . . 1.0 109.712 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -134.91 120.01 18.74 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 121.116 -0.233 . . . . 1.0 110.932 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -146.55 133.57 20.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.3 tt -147.2 150.53 14.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.605 -0.271 . . . . 1.0 110.494 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -126.5 98.11 5.29 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.947 -0.57 . . . . 1.0 111.697 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.11 129.81 38.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.537 . . . . 1.0 110.136 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.571 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 46.1 m-85 -107.68 136.53 47.28 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.363 -0.835 . . . . 1.0 110.944 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.528 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.91 -69.45 0.16 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.832 -0.622 . . . . 1.0 111.761 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 33.2 mtt-85 -96.85 176.44 5.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.744 -0.662 . . . . 1.0 110.892 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.673 ' O ' ' O ' ' A' ' 97' ' ' ASP . 59.1 mp0 -61.73 158.52 15.42 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.391 -0.822 . . . . 1.0 109.445 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.78 ' O ' ' N ' ' A' ' 99' ' ' ARG . 77.8 m-20 49.15 124.35 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.705 0 O-C-N 124.269 0.981 . . . . 1.0 108.382 -178.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.506 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.4 OUTLIER -44.53 72.8 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.781 -0.645 . . . . 1.0 110.954 -177.056 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.78 ' N ' ' O ' ' A' ' 97' ' ' ASP . 7.4 tpt85 -121.62 -64.59 1.2 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.171 0.51 . . . . 1.0 110.838 -178.157 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.443 ' O ' ' O ' ' A' ' 99' ' ' ARG . . . -51.96 -171.08 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 -179.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -58.42 148.58 27.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.037 -0.357 . . . . 1.0 110.037 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.571 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 7.9 ttp -131.63 152.42 50.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.995 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.458 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.1 tt -146.92 141.67 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.171 -0.678 . . . . 1.0 109.171 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -111.29 141.55 44.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.406 0.622 . . . . 1.0 110.466 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -129.42 153.53 47.84 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 114.714 -1.13 . . . . 1.0 110.42 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -141.66 29.9 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.641 -0.708 . . . . 1.0 110.738 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -170.94 -167.81 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.461 -0.495 . . . . 1.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.438 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 55.3 p-10 -76.83 144.83 38.82 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.69 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 6.2 m -135.02 89.43 2.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.997 -0.547 . . . . 1.0 109.779 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.1 m -64.46 -36.35 83.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.834 0.349 . . . . 1.0 111.454 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.0 m -131.65 84.96 2.21 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.426 0.631 . . . . 1.0 110.323 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.597 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.4 tp -59.27 -38.95 81.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.097 -0.956 . . . . 1.0 110.019 -178.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.561 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 22.1 mp0 -43.45 -9.64 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.281 -0.418 . . . . 1.0 111.511 178.652 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.597 ' H ' ' C ' ' A' ' 112' ' ' LEU . 87.2 m-20 -93.89 -21.94 18.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.982 0.42 . . . . 1.0 110.86 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.53 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.4 mmt180 -110.11 -38.65 5.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.974 -0.557 . . . . 1.0 112.383 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.729 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -118.95 137.28 53.6 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.756 1.265 . . . . 1.0 111.142 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 118' ' ' PHE . 84.5 mmt-85 -73.78 -74.32 0.19 Allowed 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.275 -1.516 . . . . 1.0 110.364 -178.531 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.686 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 91.5 m-85 -31.53 143.65 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 123.499 0.499 . . . . 1.0 110.598 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -104.73 11.69 33.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 1.0 110.726 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -140.0 139.38 36.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.237 0.541 . . . . 1.0 110.902 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.4 mm -120.41 123.46 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.369 -0.832 . . . . 1.0 109.51 178.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.447 ' O ' ' CB ' ' A' ' 123' ' ' SER . 20.4 m-70 -110.8 22.25 15.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.516 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.447 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 0.5 OUTLIER 165.2 157.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.921 -0.312 . . . . 1.0 110.479 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.551 ' CD2' ' CD1' ' A' ' 151' ' ' TYR . 0.0 OUTLIER -158.91 164.01 36.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.184 179.745 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -130.46 103.4 6.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.284 -0.636 . . . . 1.0 109.284 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . 0.466 HG11 ' H ' ' A' ' 149' ' ' GLY . 0.6 OUTLIER -101.4 110.42 28.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.7 -0.852 . . . . 1.0 108.7 179.234 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.62 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -81.66 -39.22 24.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.419 -0.809 . . . . 1.0 111.249 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.484 ' O ' ' O ' ' A' ' 129' ' ' GLY . 43.6 mm-40 -121.53 160.34 24.46 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.372 0.606 . . . . 1.0 111.039 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 34.62 -159.4 0.01 OUTLIER Glycine 0 CA--C 1.53 1.016 0 CA-C-N 114.191 -1.368 . . . . 1.0 110.993 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.555 ' HG ' ' H ' ' A' ' 131' ' ' TRP . 1.7 t -120.26 -175.93 3.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.994 0.426 . . . . 1.0 109.891 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.555 ' H ' ' HG ' ' A' ' 130' ' ' SER . 75.0 m95 -150.71 168.97 22.75 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.269 -178.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 57.5 t -137.42 131.44 44.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.534 -0.543 . . . . 1.0 109.534 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.07 143.0 33.86 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 110.205 -0.295 . . . . 1.0 110.205 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . 0.526 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 14.2 m-85 -119.17 133.22 55.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.445 -0.343 . . . . 1.0 110.088 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.421 ' OE2' ' O ' ' A' ' 135' ' ' GLU . 4.3 tm-20 -50.89 -29.86 13.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.088 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.416 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -139.79 176.7 8.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.119 0.485 . . . . 1.0 110.107 -179.523 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.2 m -82.8 171.76 13.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.329 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 10.1 m120 64.78 18.33 11.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.114 -0.948 . . . . 1.0 110.247 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.455 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 3.2 m-85 37.39 79.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.663 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 50.4 ttm-85 -148.55 37.51 0.83 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.968 0.414 . . . . 1.0 110.422 179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -149.36 -144.33 3.93 Favored Glycine 0 CA--C 1.521 0.442 0 N-CA-C 111.333 -0.707 . . . . 1.0 111.333 -178.032 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -73.01 159.06 34.25 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.077 -0.342 . . . . 1.0 110.077 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.626 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 88.6 mt-30 -138.81 134.6 33.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.007 -0.542 . . . . 1.0 111.047 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -129.65 140.72 51.08 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.291 -0.633 . . . . 1.0 109.291 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 43.1 tp -95.95 128.37 42.78 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.725 0.641 . . . . 1.0 110.588 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.591 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -113.45 96.92 6.14 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.971 -1.013 . . . . 1.0 109.764 179.73 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.592 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.6 OUTLIER -68.89 154.57 94.77 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 114.89 -1.05 . . . . 1.0 110.235 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 18.5 Cg_endo -56.55 112.97 1.25 Allowed 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.233 1.955 . . . . 1.0 111.372 179.576 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . 0.466 ' H ' HG11 ' A' ' 126' ' ' VAL . . . 176.06 -150.83 10.98 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.421 -1.072 . . . . 1.0 110.421 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -128.66 125.76 38.74 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.298 -0.451 . . . . 1.0 111.175 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.551 ' CD1' ' CD2' ' A' ' 124' ' ' LEU . 3.8 m-85 -117.66 128.38 54.86 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.315 -0.624 . . . . 1.0 109.315 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -107.47 -5.22 17.76 Favored 'General case' 0 CA--C 1.518 -0.25 0 O-C-N 123.685 0.616 . . . . 1.0 110.797 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -154.13 172.22 17.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.688 -0.687 . . . . 1.0 110.545 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.45 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 26.6 p90 -85.21 -21.82 28.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.097 -0.956 . . . . 1.0 112.495 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -64.53 -23.29 67.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.006 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . 0.505 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.3 t0 -44.2 -54.33 5.74 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.946 0.403 . . . . 1.0 111.068 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.45 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 28.7 p90 -92.67 24.13 3.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.753 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 50.39 75.23 0.22 Allowed Glycine 0 CA--C 1.52 0.383 0 N-CA-C 111.217 -0.753 . . . . 1.0 111.217 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -119.65 145.67 46.26 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.884 -0.413 . . . . 1.0 109.884 179.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.7 t -76.23 -10.73 59.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.92 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.531 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 30.2 t-20 -171.95 -164.53 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.449 -0.5 . . . . 1.0 110.156 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.531 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -112.13 -16.42 13.03 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 116.37 -0.377 . . . . 1.0 110.328 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.437 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.7 mtt180 -30.12 116.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.285 0.365 . . . . 1.0 111.751 -178.407 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . 0.45 ' CG1' ' N ' ' A' ' 165' ' ' GLY . 57.6 t -126.43 162.9 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.135 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.476 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -146.07 -34.85 0.06 OUTLIER Glycine 0 CA--C 1.516 0.133 0 N-CA-C 111.604 -0.598 . . . . 1.0 111.604 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 11.6 p -160.19 173.0 16.4 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 120.932 0.396 . . . . 1.0 110.753 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -158.59 154.19 26.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 1.0 112.186 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.526 ' NE ' ' OH ' ' A' ' 134' ' ' TYR . 17.0 ptp180 -145.35 153.49 41.29 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.409 -0.517 . . . . 1.0 110.441 178.766 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.04 149.14 28.25 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.43 -0.581 . . . . 1.0 109.43 177.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 170' ' ' VAL . 25.9 m -81.73 78.12 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.373 0.606 . . . . 1.0 112.416 -178.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.9 mp -128.42 125.92 64.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 O-C-N 121.834 -0.541 . . . . 1.0 110.181 179.175 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.46 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 40.0 p-10 -70.69 -34.04 71.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.522 -0.763 . . . . 1.0 110.241 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.46 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 92.2 m-85 -68.13 -91.7 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.308 -0.406 . . . . 1.0 110.736 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 23.4 p . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.029 -0.986 . . . . 1.0 110.582 -179.99 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.331 -0.618 . . . . 1.0 109.331 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.97 171.91 37.13 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.456 -1.057 . . . . 1.0 110.456 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.569 ' NZ ' ' OE2' ' A' ' 18' ' ' GLU . 59.5 tttm -173.18 102.16 0.13 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.534 0.206 . . . . 1.0 110.66 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -119.6 169.87 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.853 -178.385 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 26.6 m -129.37 123.27 31.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.41 -0.959 . . . . 1.0 108.41 177.178 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.6 mt -107.83 133.09 52.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.941 -1.027 . . . . 1.0 110.184 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -115.36 126.22 54.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.346 -0.843 . . . . 1.0 111.111 -178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -52.9 -32.96 48.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.626 -0.715 . . . . 1.0 110.664 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -115.42 150.0 37.11 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.304 0.574 . . . . 1.0 110.481 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' C ' ' N ' ' A' ' 12' ' ' PHE . 20.1 ptt-85 -54.93 -173.32 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.613 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.32 23.22 0.26 Allowed Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.427 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.3 m-85 52.78 68.24 0.86 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.482 -0.359 . . . . 1.0 110.287 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -130.41 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.0 0.429 . . . . 1.0 110.516 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.82 -150.76 0.25 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.943 -0.863 . . . . 1.0 110.943 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -69.71 146.9 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.804 0.335 . . . . 1.0 110.622 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -136.26 144.14 44.64 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.279 0.561 . . . . 1.0 110.433 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.556 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.2 t80 -137.81 141.52 40.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.309 -0.86 . . . . 1.0 109.893 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.569 ' OE2' ' NZ ' ' A' ' 3' ' ' LYS . 17.2 tt0 -111.22 122.17 47.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.368 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.8 126.3 53.64 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.627 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -117.99 13.33 13.92 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.745 -0.662 . . . . 1.0 110.377 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.0 m -158.21 168.18 27.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.647 -178.693 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.34 140.64 53.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.534 -0.757 . . . . 1.0 111.211 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.88 153.1 49.59 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.534 -0.757 . . . . 1.0 110.601 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.7 p -120.88 -11.46 8.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.437 -0.801 . . . . 1.0 112.4 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.15 116.44 5.72 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.42 0.629 . . . . 1.0 110.897 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.426 ' O ' ' N ' ' A' ' 30' ' ' LEU . 6.5 mp -110.4 -3.11 16.29 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.483 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.559 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 35.8 mt-30 -52.95 -51.23 76.52 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.948 -0.301 . . . . 1.0 110.597 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.559 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 17.1 Cg_endo -54.76 -35.93 89.23 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 121.274 1.316 . . . . 1.0 112.292 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -94.81 -51.31 4.75 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 120.177 -0.609 . . . . 1.0 111.001 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.426 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.2 mt -118.19 127.61 53.91 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.618 -0.719 . . . . 1.0 110.824 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.3 t -94.24 -10.41 33.03 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.76 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -145.7 -58.79 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.749 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 41.0 t 62.58 80.73 0.22 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -96.57 4.78 51.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.573 -0.285 . . . . 1.0 111.245 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.6 p -155.88 157.6 36.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.864 0.364 . . . . 1.0 110.368 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.71 154.71 34.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.967 -178.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -134.79 123.32 23.4 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.732 -0.84 . . . . 1.0 108.732 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.4 t -108.75 133.5 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -96.74 -41.48 8.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.367 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.8 p -160.85 157.28 26.4 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.99 176.28 49.38 Favored Glycine 0 C--N 1.315 -0.583 0 N-CA-C 110.924 -0.87 . . . . 1.0 110.924 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.9 m -112.55 147.19 37.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 51.8 m95 -132.46 151.28 51.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 1.0 110.776 -179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.45 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 13.9 tpp -124.19 129.01 50.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.133 -1.062 . . . . 1.0 108.133 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.404 ' N ' ' CD1' ' A' ' 45' ' ' LEU . 10.4 mp -109.81 131.46 55.04 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.101 -0.499 . . . . 1.0 109.858 -179.051 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -109.19 129.52 55.49 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.899 0.38 . . . . 1.0 111.927 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.46 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 19.7 pt-20 -53.61 -32.32 50.68 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.418 -0.81 . . . . 1.0 111.097 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.68 ' CG ' ' H ' ' A' ' 53' ' ' GLY . 9.7 pt20 -113.83 156.72 43.4 Favored Pre-proline 0 CA--C 1.514 -0.404 0 N-CA-C 109.442 -0.577 . . . . 1.0 109.442 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -56.39 147.39 68.28 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 121.127 1.218 . . . . 1.0 111.968 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.806 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.3 OUTLIER 82.88 -124.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.279 -1.328 . . . . 1.0 109.588 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.3 m-85 -150.12 75.05 1.23 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.052 179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -134.78 -56.52 0.83 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 112.455 0.539 . . . . 1.0 112.455 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.68 ' H ' ' CG ' ' A' ' 48' ' ' GLN . . . -61.97 -163.05 0.26 Allowed Glycine 0 C--N 1.314 -0.677 0 C-N-CA 120.07 -1.062 . . . . 1.0 111.305 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.46 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.7 tp -59.02 147.61 33.94 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.908 -0.646 . . . . 1.0 110.143 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -121.34 149.8 42.4 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.994 0.184 . . . . 1.0 110.864 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.45 ' O ' ' SD ' ' A' ' 44' ' ' MET . 22.0 m-85 -126.51 127.1 44.81 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.151 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 55.9 t80 -81.71 121.63 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.558 0.694 . . . . 1.0 109.692 -179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -111.87 132.57 54.63 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 114.769 -1.105 . . . . 1.0 109.77 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.7 ttp180 -127.96 156.03 43.32 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.287 -0.869 . . . . 1.0 109.746 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.529 ' NH1' ' O ' ' A' ' 172' ' ' ASP . 36.9 ptt180 -37.35 126.87 1.05 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.763 -0.653 . . . . 1.0 111.454 -178.376 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.9 -178.3 30.09 Favored Glycine 0 CA--C 1.521 0.459 0 N-CA-C 111.166 -0.773 . . . . 1.0 111.166 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.0 p-10 -116.43 127.48 54.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.094 0.474 . . . . 1.0 110.335 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -121.47 113.27 19.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.272 -0.64 . . . . 1.0 109.272 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.432 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.49 -4.6 53.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.381 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 81.9 m-20 -147.89 133.53 18.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.137 -0.69 . . . . 1.0 109.137 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.519 ' C ' ' H ' ' A' ' 68' ' ' GLN . 4.5 p80 -56.17 -40.97 74.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 1.0 111.127 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -51.93 -8.36 0.07 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.537 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.519 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.2 mm-40 -84.39 -32.93 23.91 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.838 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -96.57 17.94 15.22 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 121.021 -0.272 . . . . 1.0 111.43 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.432 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 41.1 mtt 82.9 9.86 0.62 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 123.941 0.775 . . . . 1.0 109.815 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.406 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -57.85 101.43 0.18 Allowed Glycine 0 C--N 1.343 0.964 0 C-N-CA 120.306 -0.949 . . . . 1.0 111.218 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.4 mt -77.83 -40.78 39.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.429 -0.582 . . . . 1.0 109.429 176.637 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 80.4 p -114.25 113.32 24.45 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 120.902 0.382 . . . . 1.0 110.019 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 55.1 p-10 -71.64 50.65 0.18 Allowed 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.971 -0.559 . . . . 1.0 110.362 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.512 ' O ' ' C ' ' A' ' 76' ' ' VAL . 4.1 m -111.61 -44.65 3.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.511 -0.313 . . . . 1.0 111.195 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.512 ' C ' ' O ' ' A' ' 75' ' ' SER . 1.4 p 14.92 95.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 124.129 0.893 . . . . 1.0 111.044 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 26' ' ' LEU . 89.8 mtm180 -110.68 9.43 22.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.271 -0.422 . . . . 1.0 110.692 -177.867 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.4 p -160.46 159.27 30.67 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.497 0.665 . . . . 1.0 110.968 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.9 p -154.66 146.49 23.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.081 -0.963 . . . . 1.0 110.356 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -127.67 146.4 50.57 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.795 0.331 . . . . 1.0 110.108 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 21.9 tp -94.44 126.76 39.91 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.451 -0.944 . . . . 1.0 108.451 178.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.429 HD12 HG23 ' A' ' 82' ' ' ILE . 2.6 mt -91.32 114.94 63.35 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 109.222 -0.658 . . . . 1.0 109.222 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -51.23 149.4 16.43 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.087 1.858 . . . . 1.0 113.479 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -73.61 179.22 4.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.164 -0.926 . . . . 1.0 110.554 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 41.6 t -173.75 149.8 1.62 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.983 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -98.6 -50.55 1.52 Allowed Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.49 -1.044 . . . . 1.0 110.49 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 m -93.01 146.22 23.78 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.903 0.382 . . . . 1.0 110.157 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -137.26 112.2 8.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.803 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -140.18 135.02 31.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.699 0.285 . . . . 1.0 110.27 178.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.9 tt -148.93 145.76 17.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.929 -0.309 . . . . 1.0 110.813 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -126.14 97.37 5.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.73 -0.668 . . . . 1.0 111.352 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.95 142.57 39.98 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.166 0.508 . . . . 1.0 111.187 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -117.59 134.8 54.48 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.367 -0.833 . . . . 1.0 110.86 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.437 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.2 tm-20 -53.45 -61.79 2.07 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.568 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.442 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.4 mtp85 -100.33 170.48 8.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.364 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -47.46 155.89 0.32 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.713 -0.676 . . . . 1.0 110.43 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.408 ' C ' ' CD2' ' A' ' 98' ' ' TYR . 1.2 m-20 56.43 -96.12 0.06 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.424 -0.807 . . . . 1.0 110.031 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.408 ' CD2' ' C ' ' A' ' 97' ' ' ASP . 2.2 p90 -170.53 33.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.365 -0.534 . . . . 1.0 109.668 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.9 mtt85 -90.46 44.57 1.21 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.677 -0.692 . . . . 1.0 111.183 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -168.48 -169.89 32.48 Favored Glycine 0 C--N 1.313 -0.729 0 CA-C-N 115.258 -0.883 . . . . 1.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.78 145.11 53.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.815 0.34 . . . . 1.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.2 ptm -131.41 157.24 43.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.262 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.7 tt -148.98 142.85 18.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 109.989 -0.374 . . . . 1.0 109.989 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -113.62 142.41 46.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.447 0.642 . . . . 1.0 110.84 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -129.5 156.66 43.78 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 114.556 -1.202 . . . . 1.0 110.331 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.6 p -143.61 26.06 1.61 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.586 -0.734 . . . . 1.0 110.636 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -167.74 -166.82 0.78 Allowed 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.627 -0.429 . . . . 1.0 110.37 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 54.2 p-10 -77.11 143.92 38.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.792 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.2 m -133.16 92.85 3.08 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.949 -0.569 . . . . 1.0 109.793 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.473 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.0 OUTLIER -67.2 -27.69 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.469 -0.332 . . . . 1.0 111.323 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 13.6 m -136.84 96.45 3.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.25 0.548 . . . . 1.0 110.863 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.542 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.4 tp -64.58 -44.25 91.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.346 -0.843 . . . . 1.0 110.44 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -47.87 -7.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.348 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.542 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.7 m-20 -96.21 -25.45 15.81 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.061 0.458 . . . . 1.0 110.318 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.417 ' N ' ' O ' ' A' ' 112' ' ' LEU . 25.7 mmt85 -108.78 -35.41 6.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.648 -0.705 . . . . 1.0 111.463 -179.059 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -126.12 121.09 31.86 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.001 0.429 . . . . 1.0 109.898 178.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.3 mtt-85 -60.11 -65.92 0.6 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.225 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.437 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 94.0 m-85 -39.5 142.35 0.29 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -104.18 2.85 32.27 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.715 0.293 . . . . 1.0 111.345 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -131.72 137.4 48.23 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.241 0.543 . . . . 1.0 111.221 -178.073 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.5 mm -122.75 126.08 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.101 -0.954 . . . . 1.0 109.502 178.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 23.3 m-70 -113.64 18.13 17.74 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.105 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.0 p 173.84 153.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.987 0.422 . . . . 1.0 110.288 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 pp -162.75 156.71 20.68 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.443 -178.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.96 108.74 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.88 -0.6 . . . . 1.0 109.846 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -102.84 110.9 30.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.773 -0.825 . . . . 1.0 108.773 178.92 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.576 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.4 OUTLIER -80.09 -39.25 30.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.033 -0.985 . . . . 1.0 111.158 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.512 ' O ' ' O ' ' A' ' 129' ' ' GLY . 66.3 mm-40 -137.6 169.15 18.27 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-O 121.853 0.835 . . . . 1.0 110.74 -179.011 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.83 177.58 0.01 OUTLIER Glycine 0 C--N 1.311 -0.853 0 CA-C-N 113.622 -1.626 . . . . 1.0 110.828 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -118.64 148.05 43.13 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.261 -0.644 . . . . 1.0 109.261 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.473 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 27.5 m95 -120.17 166.48 13.39 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.479 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.427 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 2.0 p -141.46 98.0 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.889 179.34 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.7 mt -66.78 141.1 57.84 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.418 -0.513 . . . . 1.0 111.299 -178.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -117.75 131.65 56.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.636 . . . . 1.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -45.3 -49.76 12.47 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.432 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.411 ' CD1' ' H ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -123.82 170.48 10.51 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.206 0.527 . . . . 1.0 110.179 -178.45 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.5 p -75.43 174.79 9.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.236 -0.893 . . . . 1.0 110.898 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 60.01 16.63 6.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.467 -1.242 . . . . 1.0 110.037 -179.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 40.06 78.01 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.718 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.411 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 96.4 mtt180 -146.58 44.85 1.21 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.73 0.3 . . . . 1.0 110.551 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -158.39 -139.42 2.69 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 111.187 -0.765 . . . . 1.0 111.187 -178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -78.19 169.04 18.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.024 0.44 . . . . 1.0 109.942 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.432 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -147.83 139.21 23.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.757 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . 0.427 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.7 m-85 -129.07 139.71 51.89 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.363 -0.977 . . . . 1.0 108.363 177.992 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -94.35 126.17 39.44 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.056 0.455 . . . . 1.0 110.743 -178.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.585 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.4 mm? -112.26 101.82 10.02 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.635 -0.711 . . . . 1.0 109.237 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.584 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.98 159.37 68.59 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.645 -0.707 . . . . 1.0 109.729 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -54.29 120.76 8.52 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.276 1.984 . . . . 1.0 111.844 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 166.3 -159.09 32.3 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 110.734 -0.947 . . . . 1.0 110.734 -179.325 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.487 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 67.8 t0 -119.47 135.21 54.86 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.192 -0.504 . . . . 1.0 110.645 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.487 ' N ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 m-85 -126.55 128.45 46.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.017 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -115.4 -5.53 12.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.991 0.424 . . . . 1.0 110.332 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.669 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.4 ptm180 -154.25 161.13 42.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.843 -0.617 . . . . 1.0 110.436 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.417 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -76.18 -20.32 57.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.898 -1.047 . . . . 1.0 112.443 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.669 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.3 mt-30 -68.97 -18.69 64.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.981 0.419 . . . . 1.0 111.021 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -51.06 -49.04 61.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.973 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.417 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 16.0 p90 -97.29 21.86 9.46 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.244 -0.434 . . . . 1.0 110.568 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.05 74.83 0.26 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.009 -0.836 . . . . 1.0 111.009 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -117.94 149.24 41.23 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 121.034 0.445 . . . . 1.0 110.211 179.776 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -80.39 -10.5 59.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.014 178.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.667 HD21 ' HE ' ' A' ' 163' ' ' ARG . 58.3 t30 -172.22 -170.52 0.74 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.456 -0.498 . . . . 1.0 110.406 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.556 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -108.72 -13.31 14.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.493 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.667 ' HE ' HD21 ' A' ' 161' ' ' ASN . 19.1 ptp180 -43.35 121.31 2.18 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.51 0.671 . . . . 1.0 111.504 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 38.5 t -133.08 131.85 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.422 -0.808 . . . . 1.0 109.876 178.358 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.65 -29.29 3.93 Favored Glycine 0 N--CA 1.464 0.529 0 N-CA-C 111.477 -0.649 . . . . 1.0 111.477 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 110' ' ' SER . 21.0 m -162.98 174.42 12.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.905 0.383 . . . . 1.0 110.988 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.79 139.72 17.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 1.0 111.015 -179.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 2.0 ttm180 -129.28 144.81 51.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.59 0.71 . . . . 1.0 109.485 179.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.718 ' CD ' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -79.27 150.43 31.54 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.314 -1.312 . . . . 1.0 109.083 178.803 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 58.3 t -90.21 81.23 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.927 0.394 . . . . 1.0 111.375 -178.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.1 mp -135.95 120.15 25.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.529 ' O ' ' NH1' ' A' ' 60' ' ' ARG . 42.7 p-10 -71.52 -35.2 70.64 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.599 -0.728 . . . . 1.0 110.403 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.525 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 93.3 m-85 -58.49 -78.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.11 -0.496 . . . . 1.0 110.633 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 174' ' ' SER . . . . . 0.424 ' O ' ' NH2' ' A' ' 169' ' ' ARG . 38.8 m . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 117.977 -1.011 . . . . 1.0 110.557 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.169 -0.678 . . . . 1.0 109.169 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -174.09 172.97 45.73 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.534 -1.027 . . . . 1.0 110.534 -179.697 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -171.11 111.32 0.35 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.107 -0.237 . . . . 1.0 110.734 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.427 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 171.18 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.173 0.511 . . . . 1.0 111.493 -178.854 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.0 m -128.16 120.34 27.11 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 177.174 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.5 mt -105.25 133.33 50.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.085 -0.961 . . . . 1.0 110.305 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 73.5 m-85 -115.29 130.44 56.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.304 -178.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.453 ' O ' ' O ' ' A' ' 32' ' ' ARG . 84.0 tt0 -55.18 -24.22 25.82 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.643 -0.708 . . . . 1.0 110.244 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -124.94 161.81 25.83 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.302 0.572 . . . . 1.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 19.4 ptt180 -65.62 -173.81 0.17 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.47 -0.786 . . . . 1.0 111.048 -178.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.8 25.25 0.57 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.815 -0.914 . . . . 1.0 110.815 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 51.6 67.85 0.89 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.648 -0.276 . . . . 1.0 110.312 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -129.64 -156.8 0.78 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.961 0.41 . . . . 1.0 110.523 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.43 -149.73 0.41 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -71.71 148.26 46.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.717 0.294 . . . . 1.0 110.577 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.98 149.72 48.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.391 0.615 . . . . 1.0 110.299 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.3 t80 -144.13 141.86 30.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.196 -0.911 . . . . 1.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.557 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.1 tt0 -110.57 121.38 45.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.467 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 t -108.85 126.01 52.6 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.943 0.401 . . . . 1.0 110.734 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 84.4 p -117.75 12.58 13.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.723 -0.672 . . . . 1.0 110.529 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -156.46 172.49 18.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.654 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -62.18 138.85 58.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.574 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.468 ' C ' ' HH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -134.59 143.23 47.23 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.328 179.561 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 19.0 p -111.21 -17.41 13.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.774 -0.648 . . . . 1.0 112.067 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -150.53 112.16 4.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.145 0.498 . . . . 1.0 110.208 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.0 mt -108.84 2.39 21.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.582 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 43.7 mt-30 -52.05 -51.57 70.06 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.214 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.582 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.3 Cg_endo -55.96 -34.97 93.62 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.509 1.473 . . . . 1.0 112.789 -178.722 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -91.27 -45.91 8.35 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.183 0.516 . . . . 1.0 110.807 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.7 mt -122.66 129.06 51.42 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.509 -0.768 . . . . 1.0 111.305 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -92.4 -14.67 28.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 8' ' ' GLU . 62.2 ttp180 -176.47 119.69 0.14 Allowed 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 108.745 -0.835 . . . . 1.0 108.745 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -99.2 112.97 25.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.677 0.275 . . . . 1.0 110.598 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -105.0 -4.44 22.04 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.598 0.237 . . . . 1.0 110.473 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.6 p -157.1 157.78 35.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.91 0.386 . . . . 1.0 110.552 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 154.79 34.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.069 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -132.81 122.06 23.9 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 108.783 -0.821 . . . . 1.0 108.783 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.18 115.89 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.276 0.56 . . . . 1.0 110.028 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -77.58 -42.18 36.14 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.936 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.5 t -163.6 159.86 22.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 109.223 -0.658 . . . . 1.0 109.223 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.17 177.5 50.91 Favored Glycine 0 C--N 1.315 -0.623 0 N-CA-C 111.057 -0.817 . . . . 1.0 111.057 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.5 m -112.62 141.27 46.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.344 -0.613 . . . . 1.0 109.344 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.468 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 55.0 m95 -130.37 141.01 50.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.145 0.497 . . . . 1.0 110.903 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.425 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 12.6 tpp -114.86 130.81 56.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.55 -0.75 . . . . 1.0 109.457 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 10.4 mp -109.34 130.25 55.5 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.796 -0.638 . . . . 1.0 109.448 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 90.2 m-85 -109.71 133.42 53.15 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.429 0.633 . . . . 1.0 111.671 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.6 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.55 -35.57 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.259 -0.882 . . . . 1.0 111.402 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -109.42 152.83 42.92 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.562 -179.009 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -63.59 158.68 44.58 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.446 2.097 . . . . 1.0 112.493 178.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.606 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.8 OUTLIER 63.84 37.03 9.97 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.937 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.468 ' HH ' ' C ' ' A' ' 23' ' ' HIS . 3.2 m-85 50.06 76.12 0.15 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.306 -0.861 . . . . 1.0 111.108 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.6 m -144.04 153.12 41.87 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.009 0.433 . . . . 1.0 110.313 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 -148.63 21.77 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.053 -0.594 . . . . 1.0 111.88 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.6 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.8 tp -75.58 143.74 42.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.368 -0.416 . . . . 1.0 110.59 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.573 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.6 OUTLIER -120.18 153.25 36.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.581 0.229 . . . . 1.0 110.486 179.543 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.425 ' O ' ' SD ' ' A' ' 44' ' ' MET . 29.6 m-85 -126.45 124.63 40.58 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.932 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -83.8 122.51 28.77 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.178 0.513 . . . . 1.0 110.146 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 mp -119.85 145.36 46.73 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.636 -0.711 . . . . 1.0 109.973 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.642 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 68.4 mtm180 -132.26 158.57 41.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.541 -0.754 . . . . 1.0 109.949 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.413 ' C ' ' O ' ' A' ' 59' ' ' ARG . 61.6 ttp180 -36.1 126.48 0.75 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.032 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.61 -178.89 32.83 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.501 -1.039 . . . . 1.0 110.501 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -115.31 129.46 56.61 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.008 0.432 . . . . 1.0 110.154 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -123.53 113.04 18.2 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.996 -0.547 . . . . 1.0 109.538 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.89 -3.75 54.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.249 -0.432 . . . . 1.0 111.654 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -146.6 137.22 23.94 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.971 -0.751 . . . . 1.0 108.971 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.583 ' H ' ' CD2' ' A' ' 66' ' ' HIS . 4.7 p80 -57.98 -41.64 83.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 1.0 110.694 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.63 -8.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.807 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.477 ' H ' ' C ' ' A' ' 66' ' ' HIS . 22.8 mm-40 -81.57 -34.09 31.25 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.647 -0.421 . . . . 1.0 111.317 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . . . . . . . . . 2.5 p90 -94.75 17.41 13.58 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.871 -0.331 . . . . 1.0 110.86 179.377 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.492 ' C ' ' H ' ' A' ' 72' ' ' LEU . 58.2 mtt 72.71 28.99 2.04 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 124.209 0.943 . . . . 1.0 110.128 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.599 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -72.54 39.51 0.75 Allowed Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.667 -0.777 . . . . 1.0 111.599 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.492 ' H ' ' C ' ' A' ' 70' ' ' MET . 12.1 mt -17.87 -46.21 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 124.27 0.63 . . . . 1.0 111.116 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.599 ' N ' ' O ' ' A' ' 71' ' ' GLY . 55.8 m -106.53 116.54 32.11 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.857 -0.794 . . . . 1.0 108.857 177.675 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 55.1 p-10 -67.44 38.14 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.398 -0.365 . . . . 1.0 110.984 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.558 ' H ' ' C ' ' A' ' 73' ' ' SER . 49.9 m -116.09 125.73 52.79 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.714 -0.476 . . . . 1.0 109.714 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.3 p -163.24 115.11 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.981 -0.748 . . . . 1.0 108.981 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 85.3 mtm-85 -123.23 12.29 9.51 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.003 -0.544 . . . . 1.0 111.468 -178.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.1 p -163.38 163.13 25.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.182 0.515 . . . . 1.0 110.592 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.4 p -157.58 148.37 21.19 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.489 -0.778 . . . . 1.0 110.546 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -128.08 150.18 50.07 Favored 'General case' 0 CA--C 1.513 -0.442 0 N-CA-C 109.844 -0.428 . . . . 1.0 109.844 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.468 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 3.7 tt -101.69 121.71 42.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.825 -1.176 . . . . 1.0 107.825 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 7.2 mt -86.08 120.41 72.45 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.011 -178.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -50.41 146.08 19.95 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 121.598 1.532 . . . . 1.0 113.077 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.449 ' O ' ' O ' ' A' ' 85' ' ' SER . 27.1 p80 -64.19 -24.39 67.66 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 114.903 -1.044 . . . . 1.0 111.26 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.449 ' O ' ' O ' ' A' ' 84' ' ' HIS . 14.4 t 53.35 165.65 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.374 -0.83 . . . . 1.0 111.059 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.451 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . -106.35 -89.22 2.09 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.529 -1.028 . . . . 1.0 110.529 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.7 p -77.92 158.53 29.34 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 109.881 -0.414 . . . . 1.0 109.881 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.451 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 1.6 m170 -127.58 102.48 6.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.895 0.332 . . . . 1.0 111.895 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 57.1 mtt180 -136.06 138.21 41.9 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.669 -0.413 . . . . 1.0 110.598 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.3 tt -148.44 144.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-N 116.483 -0.326 . . . . 1.0 110.847 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -122.87 97.91 5.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.367 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.47 139.8 39.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.449 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -120.17 135.76 54.86 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.892 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.51 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.42 -62.36 1.77 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.817 -0.629 . . . . 1.0 111.239 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 34.7 mtt-85 -99.18 165.25 11.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.278 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.634 ' O ' ' O ' ' A' ' 97' ' ' ASP . 97.8 mt-10 -52.65 159.13 1.13 Allowed 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.648 -0.705 . . . . 1.0 110.06 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.818 ' O ' ' N ' ' A' ' 99' ' ' ARG . 76.0 m-20 52.06 125.66 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 108.209 -1.034 . . . . 1.0 108.209 -178.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.478 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.2 OUTLIER -36.58 70.71 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.163 -0.472 . . . . 1.0 111.58 -178.13 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.818 ' N ' ' O ' ' A' ' 97' ' ' ASP . 3.5 tpt180 -134.91 178.96 6.61 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.015 0.436 . . . . 1.0 109.928 -178.472 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 61.88 -160.65 29.67 Favored Glycine 0 CA--C 1.519 0.321 0 N-CA-C 110.393 -1.083 . . . . 1.0 110.393 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -66.2 140.23 58.16 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.535 -0.466 . . . . 1.0 110.235 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.8 ptm -132.26 154.19 49.89 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.122 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tt -148.16 140.6 18.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.436 -0.579 . . . . 1.0 109.436 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.53 143.04 44.37 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.717 0.77 . . . . 1.0 110.68 -179.095 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.0 m-85 -129.38 154.25 47.09 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 114.764 -1.107 . . . . 1.0 110.472 -179.674 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.24 22.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.541 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.61 -170.66 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.625 -0.43 . . . . 1.0 110.552 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 54.5 p-10 -77.91 144.15 37.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.741 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.8 m -137.0 93.1 2.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.09 -31.21 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.034 0.445 . . . . 1.0 111.086 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.7 m -136.82 90.3 2.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.408 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.581 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.9 tp -60.48 -39.84 89.13 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.19 -178.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.541 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 18.4 mp0 -43.69 -9.19 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.147 -0.479 . . . . 1.0 112.268 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.581 ' H ' ' C ' ' A' ' 112' ' ' LEU . 65.8 t0 -94.69 -22.07 18.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.163 0.506 . . . . 1.0 110.215 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.442 ' N ' ' O ' ' A' ' 112' ' ' LEU . 82.5 mmt-85 -107.93 -37.14 6.17 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.446 -0.797 . . . . 1.0 112.821 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.664 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.67 136.84 54.73 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 122.51 1.148 . . . . 1.0 110.752 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.444 ' O ' ' C ' ' A' ' 118' ' ' PHE . 71.1 mtp180 -72.55 -71.46 0.29 Allowed 'General case' 0 C--N 1.315 -0.933 0 O-C-N 120.718 -1.239 . . . . 1.0 110.684 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.608 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.1 m-85 -34.61 146.4 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.631 . . . . 1.0 110.31 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -105.14 8.02 33.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.796 0.332 . . . . 1.0 110.713 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -139.02 142.27 38.28 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.238 0.542 . . . . 1.0 110.816 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 36.5 mm -121.3 123.2 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 115.566 -0.743 . . . . 1.0 109.267 178.242 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.404 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 19.6 m-70 -112.14 24.54 12.49 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.501 -0.318 . . . . 1.0 111.634 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 1.6 p 166.28 150.54 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.074 0.464 . . . . 1.0 109.94 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -161.29 156.94 24.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.286 -178.78 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.76 115.7 22.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 24.4 t -100.56 105.18 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.111 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.515 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.21 -44.39 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 1.0 110.774 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -159.1 158.56 33.18 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.747 0.308 . . . . 1.0 110.861 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.54 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.16 73.84 0.68 Allowed Glycine 0 CA--C 1.508 -0.348 0 C-N-CA 121.45 -0.405 . . . . 1.0 112.38 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 129' ' ' GLY . 8.1 t -31.87 146.78 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.899 0.381 . . . . 1.0 110.596 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.54 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 30.8 m95 -122.1 169.23 11.07 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.075 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.448 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 2.3 p -141.47 96.86 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 121.017 0.437 . . . . 1.0 110.756 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.4 mt -68.04 142.01 56.01 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.04 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -118.15 130.75 56.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.785 -0.643 . . . . 1.0 109.98 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -44.25 -48.61 9.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.999 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.413 ' C ' ' CD1' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.68 175.28 6.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.442 0.639 . . . . 1.0 110.57 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.8 m -81.45 172.35 13.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.522 -0.763 . . . . 1.0 110.817 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 63.0 t30 64.04 17.24 10.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 37.01 78.88 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.952 -0.567 . . . . 1.0 111.665 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -148.52 39.7 0.9 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.12 0.486 . . . . 1.0 110.302 179.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.83 -137.67 2.57 Favored Glycine 0 N--CA 1.465 0.571 0 N-CA-C 111.157 -0.777 . . . . 1.0 111.157 -178.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -80.27 167.81 19.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.102 0.477 . . . . 1.0 110.308 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.573 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -146.58 141.97 27.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.544 -0.753 . . . . 1.0 111.11 -179.08 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 9.0 m-85 -130.76 142.27 50.4 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.341 -0.985 . . . . 1.0 108.341 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 46.2 tp -94.84 124.2 38.74 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.169 0.509 . . . . 1.0 111.329 -179.129 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.591 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.3 mm? -113.7 88.94 2.96 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.529 -0.76 . . . . 1.0 108.951 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 4.5 mtm -70.82 162.66 70.39 Favored Pre-proline 0 CA--C 1.531 0.246 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.22 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.23 116.69 3.22 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 121.621 1.547 . . . . 1.0 111.221 178.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.88 -157.46 22.61 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 110.698 -0.961 . . . . 1.0 110.698 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -128.04 114.52 17.18 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.04 0.447 . . . . 1.0 110.519 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 31.2 m-85 -106.01 130.69 53.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 1.0 109.954 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -116.12 -0.69 12.63 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.792 0.329 . . . . 1.0 110.491 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.672 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.2 ptm180 -158.97 165.7 33.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.362 0.601 . . . . 1.0 110.484 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.413 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -77.19 -23.14 51.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.295 -0.866 . . . . 1.0 112.615 -178.384 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.672 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.9 mt-30 -67.53 -20.36 65.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.447 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -49.97 -48.72 52.06 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.381 -0.372 . . . . 1.0 110.808 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.413 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 23.1 p90 -96.6 20.96 9.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.09 -0.504 . . . . 1.0 110.573 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.59 74.78 0.27 Allowed Glycine 0 CA--C 1.521 0.446 0 N-CA-C 111.204 -0.758 . . . . 1.0 111.204 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -119.1 148.53 42.94 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.257 0.551 . . . . 1.0 110.377 179.879 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.6 t -77.76 -10.86 59.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.969 -1.014 . . . . 1.0 110.356 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.544 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 32.6 t-20 -171.76 -169.02 0.64 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.45 -0.5 . . . . 1.0 110.366 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.544 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -109.12 -8.69 15.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.625 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -44.3 116.25 0.99 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.891 0.377 . . . . 1.0 111.772 -178.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 36.8 t -128.31 131.25 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.814 -0.63 . . . . 1.0 109.677 177.701 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.402 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -108.65 -28.42 4.55 Favored Glycine 0 N--CA 1.463 0.443 0 N-CA-C 111.694 -0.562 . . . . 1.0 111.694 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.8 p -160.74 -168.58 2.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.704 0.288 . . . . 1.0 110.514 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.8 pp -173.06 137.1 0.69 Allowed 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.532 -179.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.642 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 1.3 ttm180 -131.04 149.77 52.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.559 0.695 . . . . 1.0 109.706 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.87 155.97 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.951 -1.022 . . . . 1.0 109.953 178.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 45.9 t -93.29 79.39 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.879 -179.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . 0.503 ' CG2' ' H ' ' A' ' 173' ' ' PHE . 3.5 mp -137.39 128.15 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.654 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 174' ' ' SER . 33.5 t70 -82.2 15.6 2.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.869 -0.605 . . . . 1.0 110.025 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.503 ' H ' ' CG2' ' A' ' 171' ' ' ILE . 4.3 m-85 57.56 -72.36 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.602 -0.727 . . . . 1.0 110.34 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 174' ' ' SER . . . . . 0.582 ' N ' ' O ' ' A' ' 172' ' ' ASP . 0.9 OUTLIER . . . . . 0 C--N 1.322 -0.594 0 CA-C-O 118.014 -0.993 . . . . 1.0 110.78 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.276 -0.639 . . . . 1.0 109.276 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -82.4 173.96 53.16 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -174.1 101.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.925 -0.31 . . . . 1.0 110.56 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.2 168.78 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 CA-C-N 116.47 -0.332 . . . . 1.0 110.533 -178.52 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 26.6 m -127.44 122.17 32.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 176.401 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.7 mt -104.79 132.7 50.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.328 -0.851 . . . . 1.0 110.438 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.8 m-85 -114.82 126.87 55.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.373 -0.83 . . . . 1.0 110.863 -178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.512 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.2 tt0 -54.49 -32.23 57.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.597 -0.728 . . . . 1.0 110.72 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -115.22 152.16 33.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.217 0.532 . . . . 1.0 110.262 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 12' ' ' PHE . 19.3 ptt-85 -56.83 -171.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.393 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.63 23.97 0.07 OUTLIER Glycine 0 N--CA 1.46 0.292 0 N-CA-C 111.135 -0.786 . . . . 1.0 111.135 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 10' ' ' ARG . 11.8 m-85 52.64 69.02 0.74 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.47 -0.365 . . . . 1.0 110.213 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -129.76 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.917 0.389 . . . . 1.0 110.473 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.33 -151.22 0.11 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.03 -0.828 . . . . 1.0 111.03 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.512 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.6 mtm180 -68.73 146.61 52.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.771 0.32 . . . . 1.0 110.755 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -136.49 143.88 44.04 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.155 0.502 . . . . 1.0 110.261 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE1' ' O ' ' A' ' 18' ' ' GLU . 11.3 t80 -137.39 141.52 41.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.293 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.445 ' O ' ' CE1' ' A' ' 17' ' ' TYR . 19.5 tt0 -110.33 127.84 55.25 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.403 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -115.45 127.11 55.1 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.607 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -118.41 10.31 12.67 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.894 -0.594 . . . . 1.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.0 m -156.45 169.97 23.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 1.0 110.745 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -59.42 137.49 57.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.947 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.58 150.1 51.64 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.774 -0.648 . . . . 1.0 109.924 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.5 p -119.65 -16.8 8.77 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.524 -0.762 . . . . 1.0 112.131 -178.746 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.491 ' OD1' ' NE2' ' A' ' 27' ' ' GLN . 15.2 t30 -144.75 111.04 5.56 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.912 0.387 . . . . 1.0 110.188 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.1 mt -117.73 -5.72 11.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.866 -0.606 . . . . 1.0 110.58 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.603 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -45.1 -53.13 17.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.263 179.202 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.603 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 12.8 Cg_endo -54.17 -29.99 58.94 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 C-N-CA 122.078 1.852 . . . . 1.0 111.96 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -95.17 -51.44 4.62 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 120.751 -0.38 . . . . 1.0 110.43 -178.738 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.6 126.8 52.07 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.5 t -95.89 -11.61 26.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.909 -0.587 . . . . 1.0 111.491 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.549 ' O ' ' O ' ' A' ' 75' ' ' SER . 26.2 mmt180 -142.22 -53.12 0.42 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.612 -178.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . 0.464 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 20.3 t 55.97 67.84 0.95 Allowed 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 1.0 109.885 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -89.05 4.54 47.99 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.161 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.2 p -154.85 157.63 38.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.088 -0.338 . . . . 1.0 110.088 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.56 155.51 36.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.858 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.4 mtp85 -135.21 122.77 22.06 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.802 -0.814 . . . . 1.0 108.802 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.5 t -108.26 133.11 54.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.153 0.501 . . . . 1.0 110.133 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.64 -39.5 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.419 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 96.3 p -162.96 155.72 19.03 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.4 ' N ' ' OD2' ' A' ' 172' ' ' ASP . . . 80.42 176.06 49.7 Favored Glycine 0 CA--C 1.522 0.474 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 179.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.0 m -111.26 147.53 34.86 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.706 -0.479 . . . . 1.0 109.706 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.411 ' CE2' HD12 ' A' ' 81' ' ' LEU . 56.5 m95 -132.1 150.86 52.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.81 -0.632 . . . . 1.0 111.246 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.503 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 21.4 tpp -127.38 129.58 47.84 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.881 -0.785 . . . . 1.0 108.881 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -110.15 137.82 47.37 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.105 -0.498 . . . . 1.0 109.757 -178.924 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -112.73 129.95 56.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.955 0.407 . . . . 1.0 110.554 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.604 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 3.2 pt-20 -54.55 -33.93 60.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.791 -0.64 . . . . 1.0 110.295 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -105.7 154.32 39.35 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.174 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -55.43 150.37 42.47 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.23 1.954 . . . . 1.0 111.212 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.826 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.4 OUTLIER 78.61 -120.2 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 124.035 0.834 . . . . 1.0 109.103 -178.97 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.57 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 13.1 m-85 -141.98 79.06 1.65 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.665 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.9 t -152.73 166.22 32.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.825 -0.435 . . . . 1.0 109.825 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.15 -150.07 31.66 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.289 -0.725 . . . . 1.0 111.289 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.604 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.5 tp -78.73 142.78 36.77 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.255 -0.276 . . . . 1.0 110.255 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.15 150.41 41.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.297 -0.26 . . . . 1.0 110.297 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.503 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.1 m-85 -127.5 127.04 43.34 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.389 -0.369 . . . . 1.0 110.732 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 41.8 t80 -82.83 122.96 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.392 0.615 . . . . 1.0 109.719 -179.407 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.415 ' N ' ' CD2' ' A' ' 58' ' ' LEU . 3.2 mm? -109.71 136.09 49.6 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.136 -0.938 . . . . 1.0 110.343 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 60' ' ' ARG . 38.5 mtm-85 -127.0 149.14 50.03 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.15 -0.932 . . . . 1.0 109.856 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.459 ' CZ ' ' O ' ' A' ' 172' ' ' ASP . 27.4 ptt180 -34.44 126.93 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.985 -0.552 . . . . 1.0 111.389 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 153.36 -177.38 30.97 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.637 -0.985 . . . . 1.0 110.637 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -115.31 130.81 57.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.869 0.366 . . . . 1.0 110.195 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.89 112.11 16.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 1.0 109.536 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.437 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -89.59 -4.45 57.84 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.827 -0.624 . . . . 1.0 110.991 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 83.2 m-20 -147.3 148.44 31.41 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.723 -0.473 . . . . 1.0 109.723 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.548 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.2 p-80 -67.66 -42.53 82.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.019 0.437 . . . . 1.0 111.338 -179.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.523 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 4.6 pt20 -50.79 -8.58 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.734 -0.666 . . . . 1.0 110.519 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.548 ' H ' ' C ' ' A' ' 66' ' ' HIS . 24.9 mm-40 -82.42 -33.35 28.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.355 -0.384 . . . . 1.0 111.256 -177.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.518 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -98.1 21.72 10.41 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 119.27 -0.395 . . . . 1.0 110.907 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.436 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 57.6 mtp 80.46 10.48 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.58 0.55 . . . . 1.0 110.256 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.42 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -56.88 99.19 0.08 OUTLIER Glycine 0 C--N 1.339 0.704 0 N-CA-C 111.096 -0.801 . . . . 1.0 111.096 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.8 mt -73.0 -39.15 66.3 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.023 -0.362 . . . . 1.0 110.023 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.5 t -115.44 116.28 27.95 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 109.612 -0.514 . . . . 1.0 109.612 178.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 50.8 p-10 -67.73 53.18 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.012 -0.54 . . . . 1.0 111.019 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.549 ' O ' ' O ' ' A' ' 32' ' ' ARG . 55.7 m -114.57 -114.73 0.33 Allowed 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 109.295 -0.632 . . . . 1.0 109.295 179.156 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.517 ' CB ' ' O ' ' A' ' 75' ' ' SER . 11.3 t 91.2 108.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 123.66 0.6 . . . . 1.0 109.884 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -122.68 7.62 9.44 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.553 -0.294 . . . . 1.0 111.092 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 9.7 p -163.76 161.78 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.428 . . . . 1.0 110.653 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.7 p -154.81 146.05 22.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.026 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.2 ptm180 -127.61 146.66 50.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.102 -0.333 . . . . 1.0 110.102 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.411 HD12 ' CE2' ' A' ' 43' ' ' TRP . 29.8 tp -96.19 130.0 43.37 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.494 -0.558 . . . . 1.0 109.494 178.166 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -92.05 114.56 62.5 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.017 -179.895 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -51.32 148.64 18.59 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.439 2.093 . . . . 1.0 112.776 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -72.01 -179.35 2.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.641 -0.709 . . . . 1.0 110.361 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.9 t -166.4 145.09 5.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.843 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -88.44 -70.97 1.27 Allowed Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.322 -1.111 . . . . 1.0 110.322 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m -88.55 153.67 20.95 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 109.787 -0.449 . . . . 1.0 109.787 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.6 m80 -132.43 121.78 23.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.548 -0.296 . . . . 1.0 111.032 -179.645 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -147.92 136.59 21.77 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 1.0 110.288 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.6 tt -150.94 149.92 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.517 -0.311 . . . . 1.0 110.535 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -130.09 100.55 5.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.389 0.614 . . . . 1.0 111.445 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.2 mt -77.44 139.43 39.66 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.645 -0.707 . . . . 1.0 110.301 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.603 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 54.6 m-85 -115.27 139.28 50.1 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.603 0.716 . . . . 1.0 111.138 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.509 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.6 OUTLIER -59.27 -63.54 1.27 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.395 -0.821 . . . . 1.0 111.512 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.5 mmm-85 -96.07 174.09 7.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.113 0.482 . . . . 1.0 110.955 -178.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -66.32 169.25 7.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.547 -0.751 . . . . 1.0 110.988 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.501 ' C ' ' CG ' ' A' ' 98' ' ' TYR . 66.0 t0 48.1 40.03 12.79 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.066 -0.97 . . . . 1.0 111.307 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER 54.01 35.99 23.41 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.688 -0.687 . . . . 1.0 111.225 178.221 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -101.16 150.36 23.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.164 0.507 . . . . 1.0 110.508 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.74 -166.79 31.66 Favored Glycine 0 CA--C 1.519 0.323 0 CA-C-N 115.803 -0.635 . . . . 1.0 111.527 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -61.4 146.6 47.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.374 . . . . 1.0 110.398 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.603 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 5.9 ttp -133.36 149.1 51.87 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.82 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.421 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -141.19 142.46 29.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 109.8 -0.444 . . . . 1.0 109.8 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -112.38 136.71 51.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.417 0.627 . . . . 1.0 110.647 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 82.3 m-85 -122.41 156.13 34.65 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.844 -1.071 . . . . 1.0 110.256 -179.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -142.82 13.03 1.88 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.396 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -156.33 -168.69 2.8 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 120.616 -0.434 . . . . 1.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -76.63 145.16 39.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.42 . . . . 1.0 110.801 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.453 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 13.5 m -133.47 93.2 3.11 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.04 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 78.2 p -67.75 -28.29 67.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.319 -0.401 . . . . 1.0 111.247 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.2 t -138.26 97.05 3.29 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.328 0.585 . . . . 1.0 111.174 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.556 ' C ' ' H ' ' A' ' 114' ' ' ASP . 3.5 mt -63.82 -40.49 96.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.172 -0.922 . . . . 1.0 110.505 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.452 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 25.9 mm-40 -46.21 -11.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.896 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.556 ' H ' ' C ' ' A' ' 112' ' ' LEU . 38.5 t70 -96.21 -25.83 15.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.804 0.335 . . . . 1.0 110.547 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.3 mmt180 -110.31 -41.05 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 1.0 111.546 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.421 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 5.1 t80 -122.41 116.68 24.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.15 0.5 . . . . 1.0 110.408 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 118' ' ' PHE . 23.5 mmm180 -56.67 -67.81 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.444 -0.798 . . . . 1.0 111.16 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.509 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 80.0 m-85 -38.08 139.98 0.31 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.51 -0.313 . . . . 1.0 110.304 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.452 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 81.2 m-20 -100.43 2.84 42.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.914 -178.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -132.76 142.27 48.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.191 0.52 . . . . 1.0 111.151 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.8 mm -122.92 120.64 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 CA-C-N 115.518 -0.765 . . . . 1.0 109.52 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.456 ' O ' ' CB ' ' A' ' 123' ' ' SER . 30.7 m-70 -110.94 28.48 8.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 1.0 111.514 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.456 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.7 t 162.27 151.06 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 120.986 0.422 . . . . 1.0 110.695 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.3 pp -163.73 158.79 20.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.573 -0.74 . . . . 1.0 110.371 -178.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 3.2 t30 -126.33 119.1 26.49 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.848 -0.427 . . . . 1.0 109.848 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 26.5 t -100.9 105.42 17.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 109.722 -0.473 . . . . 1.0 109.722 179.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.593 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.69 -41.67 30.53 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.634 -0.712 . . . . 1.0 111.263 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -140.34 146.29 38.26 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.976 0.417 . . . . 1.0 110.87 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 61.21 -175.39 5.46 Favored Glycine 0 CA--C 1.518 0.242 0 N-CA-C 111.183 -0.767 . . . . 1.0 111.183 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 146' ' ' LEU . 8.4 t -117.65 154.38 31.7 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.655 -0.498 . . . . 1.0 109.655 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.3 m95 -127.64 160.21 32.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.808 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 65.7 t -132.26 135.38 58.17 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 N-CA-C 109.659 -0.497 . . . . 1.0 109.659 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 23.5 mt -107.77 143.29 36.52 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.238 -0.282 . . . . 1.0 110.238 179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -118.79 133.07 56.1 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.755 0.312 . . . . 1.0 110.629 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -43.27 -52.23 5.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.958 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.423 HD12 ' C ' ' A' ' 140' ' ' ARG . 0.5 OUTLIER -121.99 172.3 8.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.176 0.513 . . . . 1.0 110.181 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.7 m -75.56 170.05 16.9 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.529 -0.76 . . . . 1.0 110.918 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 62.0 t30 66.37 16.94 10.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.279 -0.873 . . . . 1.0 109.982 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.478 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 1.4 m-85 38.55 80.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 1.0 111.679 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.423 ' C ' HD12 ' A' ' 136' ' ' LEU . 51.3 ttp180 -149.48 42.11 0.89 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.983 0.421 . . . . 1.0 109.904 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.44 -135.11 2.17 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 111.309 -0.716 . . . . 1.0 111.309 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -82.98 168.54 16.9 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.962 -0.384 . . . . 1.0 109.962 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.38 137.82 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.116 -0.493 . . . . 1.0 110.919 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -128.22 132.11 48.8 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.162 -0.681 . . . . 1.0 109.162 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -87.53 126.65 35.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.083 -179.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.443 ' O ' ' OG ' ' A' ' 130' ' ' SER . 21.8 mt -115.43 99.9 7.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.993 -0.549 . . . . 1.0 109.599 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.422 ' O ' ' OH ' ' A' ' 151' ' ' TYR . 5.2 mtm -81.94 156.77 69.66 Favored Pre-proline 0 C--N 1.327 -0.373 0 C-N-CA 120.704 -0.398 . . . . 1.0 110.604 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.39 120.33 3.13 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 C-N-CA 122.081 1.854 . . . . 1.0 111.569 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.54 -154.81 24.9 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.431 -1.068 . . . . 1.0 110.431 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -127.02 135.98 51.59 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.835 0.35 . . . . 1.0 110.458 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.518 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 11.9 m-85 -126.87 130.97 51.21 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.754 -0.461 . . . . 1.0 109.754 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -119.39 -0.37 10.94 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.747 0.308 . . . . 1.0 110.589 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -158.15 163.11 37.9 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 121.173 0.511 . . . . 1.0 109.947 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.572 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -76.19 -18.48 59.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.354 -0.839 . . . . 1.0 111.918 -178.436 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.572 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -67.62 -21.68 65.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 1.0 110.712 -179.028 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -50.27 -48.42 54.86 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.614 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.544 ' HE1' ' HB3' ' A' ' 159' ' ' ALA . 21.7 p90 -102.27 19.41 18.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 1.0 110.562 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 76.67 0.16 Allowed Glycine 0 CA--C 1.52 0.354 0 N-CA-C 111.272 -0.731 . . . . 1.0 111.272 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.544 ' HB3' ' HE1' ' A' ' 157' ' ' TRP . . . -94.12 -169.75 2.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.037 0.446 . . . . 1.0 110.115 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 1.2 t -123.49 -36.31 2.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.542 -0.754 . . . . 1.0 111.776 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.548 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 0.2 OUTLIER -145.64 -24.1 0.47 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 1.0 111.61 -178.648 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.548 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 93.23 0.8 0.09 Allowed 'General case' 0 N--CA 1.465 0.305 0 O-C-N 124.031 0.832 . . . . 1.0 110.68 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -67.98 116.07 8.22 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.849 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.2 125.28 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.115 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -102.07 -24.59 8.41 Favored Glycine 0 N--CA 1.464 0.503 0 N-CA-C 111.507 -0.637 . . . . 1.0 111.507 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.9 p -161.51 171.21 18.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.88 0.371 . . . . 1.0 110.68 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.73 148.5 24.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.98 -0.555 . . . . 1.0 111.617 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.478 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 15.4 ptp180 -138.17 154.2 49.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.363 . . . . 1.0 110.094 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -86.66 155.94 20.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.043 -0.526 . . . . 1.0 110.053 178.035 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.07 85.62 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 1.0 111.191 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.5 mp -137.25 133.68 46.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.034 -0.53 . . . . 1.0 110.436 179.341 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.459 ' O ' ' CZ ' ' A' ' 60' ' ' ARG . 19.2 p-10 -104.01 -7.37 20.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.846 -0.616 . . . . 1.0 110.805 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -107.38 -172.06 2.0 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.015 0.436 . . . . 1.0 110.629 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 117.947 -1.025 . . . . 1.0 110.526 179.915 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.456 ' C ' ' HE2' ' A' ' 84' ' ' HIS . 57.5 tt0 . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.21 -0.663 . . . . 1.0 109.21 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -87.32 173.33 44.19 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.694 -0.963 . . . . 1.0 110.694 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.9 tttt -172.91 106.24 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.891 -0.324 . . . . 1.0 110.321 179.134 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.26 168.48 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 116.468 -0.333 . . . . 1.0 110.595 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.0 m -127.63 121.72 31.23 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 177.191 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.8 mt -105.67 132.97 51.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.047 -0.979 . . . . 1.0 110.262 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 49.9 m-85 -115.06 127.26 55.51 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.307 -0.86 . . . . 1.0 110.909 -178.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.426 ' OE1' ' OD1' ' A' ' 9' ' ' ASP . 6.9 tm-20 -53.94 -32.86 55.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.557 -0.747 . . . . 1.0 110.588 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' OD1' ' OE1' ' A' ' 8' ' ' GLU . 90.4 m-20 -115.74 152.14 33.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.292 0.568 . . . . 1.0 110.292 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.44 ' C ' ' N ' ' A' ' 12' ' ' PHE . 32.5 ptt85 -57.04 -172.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.494 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.81 22.65 0.3 Allowed Glycine 0 CA--C 1.517 0.207 0 N-CA-C 110.918 -0.873 . . . . 1.0 110.918 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.44 ' N ' ' C ' ' A' ' 10' ' ' ARG . 10.3 m-85 53.23 67.37 1.01 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.26 -0.274 . . . . 1.0 110.26 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' A' ' 12' ' ' PHE . 10.9 mm100 -129.8 -158.65 0.9 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.138 0.494 . . . . 1.0 110.594 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.67 -149.97 0.67 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -70.83 147.13 49.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.681 0.277 . . . . 1.0 110.701 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -136.49 146.6 46.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.187 0.518 . . . . 1.0 110.299 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -139.63 141.43 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.383 -0.826 . . . . 1.0 109.978 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 62.1 tt0 -111.07 122.92 49.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.336 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.6 126.83 54.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.464 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.3 p -117.43 10.29 13.55 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.345 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.8 m -156.88 169.02 25.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.732 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.8 139.68 56.03 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.639 -0.709 . . . . 1.0 111.244 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.61 155.33 49.3 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.64 -0.709 . . . . 1.0 110.409 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -123.66 -15.03 7.14 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.382 -0.826 . . . . 1.0 112.326 -179.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -138.08 112.97 9.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.954 0.406 . . . . 1.0 110.408 -178.285 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 mp -115.95 -9.74 11.73 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.063 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -48.61 -52.53 43.84 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.46 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.576 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 16.8 Cg_endo -55.39 -33.69 86.46 Favored 'Trans proline' 0 C--N 1.316 -1.181 0 C-N-CA 121.848 1.699 . . . . 1.0 112.103 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -95.0 -49.43 5.55 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 120.388 -0.525 . . . . 1.0 110.68 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 mt -121.66 126.32 48.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.668 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 t -95.01 -12.85 25.92 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.909 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.559 ' O ' ' O ' ' A' ' 75' ' ' SER . 99.7 mtt180 -143.39 -51.17 0.34 Allowed 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 116.167 -0.469 . . . . 1.0 111.737 -178.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.5 t 56.88 78.5 0.22 Allowed 'General case' 0 C--N 1.314 -0.955 0 O-C-N 122.134 -0.354 . . . . 1.0 110.099 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.442 ' OD1' ' OD1' ' A' ' 74' ' ' ASP . 34.2 m-20 -95.19 5.69 51.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.294 -178.703 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.6 p -158.13 158.32 34.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 1.0 110.254 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.79 154.3 32.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.942 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.9 mtp85 -133.05 121.95 23.45 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.598 -0.89 . . . . 1.0 108.598 178.847 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.8 133.19 53.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.627 -0.509 . . . . 1.0 109.627 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.59 -43.94 7.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.744 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.2 t -160.82 154.09 21.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.95 177.59 50.99 Favored Glycine 0 C--N 1.317 -0.5 0 N-CA-C 111.194 -0.762 . . . . 1.0 111.194 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.1 m -112.16 134.05 53.93 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.589 -0.522 . . . . 1.0 109.589 178.565 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.414 ' CE2' HD12 ' A' ' 81' ' ' LEU . 58.4 m95 -121.96 142.41 50.33 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.017 -0.538 . . . . 1.0 111.179 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.48 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 10.4 tpp -120.15 130.29 54.53 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.546 -0.752 . . . . 1.0 109.172 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.402 ' CD2' ' N ' ' A' ' 45' ' ' LEU . 0.2 OUTLIER -111.49 138.96 47.33 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.084 -0.507 . . . . 1.0 109.808 -178.823 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -111.58 130.99 55.57 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.322 0.582 . . . . 1.0 110.979 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 16.0 pt-20 -55.39 -30.7 60.88 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.12 -0.945 . . . . 1.0 110.532 -178.812 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.554 HE21 ' CA ' ' A' ' 53' ' ' GLY . 15.0 pt20 -114.87 156.29 45.25 Favored Pre-proline 0 N--CA 1.465 0.297 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.46 ' C ' HD21 ' A' ' 50' ' ' ASN . 14.4 Cg_endo -52.94 152.38 17.96 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 121.753 1.635 . . . . 1.0 111.911 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.737 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.5 OUTLIER 70.32 -120.48 0.11 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.747 -1.115 . . . . 1.0 109.313 -178.448 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER -153.64 76.28 1.08 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.648 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.545 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 30.7 t -143.29 16.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.541 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.554 ' CA ' HE21 ' A' ' 48' ' ' GLN . . . -133.11 -168.93 12.05 Favored Glycine 0 N--CA 1.464 0.549 0 N-CA-C 111.33 -0.708 . . . . 1.0 111.33 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 48.4 tp -55.34 145.54 21.82 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 109.522 -0.547 . . . . 1.0 109.522 179.867 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -122.33 152.49 40.07 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.903 0.383 . . . . 1.0 110.624 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.48 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.0 m-85 -130.52 125.92 35.52 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.945 -0.57 . . . . 1.0 110.731 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -84.15 123.93 30.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.885 -0.598 . . . . 1.0 110.26 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.0 mp -121.26 145.91 47.37 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.582 -0.735 . . . . 1.0 110.686 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.406 ' O ' ' C ' ' A' ' 60' ' ' ARG . 43.8 mtp180 -132.51 158.66 41.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.293 179.616 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 59' ' ' ARG . 40.5 ptt180 -35.14 127.56 0.54 Allowed 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.701 -0.681 . . . . 1.0 111.116 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.79 -178.3 30.0 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 110.873 -0.891 . . . . 1.0 110.873 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.442 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.5 p-10 -116.92 128.01 54.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.08 0.467 . . . . 1.0 110.435 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -120.46 112.72 19.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 1.0 109.6 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.86 -3.71 57.15 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.283 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -148.28 141.34 24.93 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.49 -0.559 . . . . 1.0 109.49 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.513 ' C ' ' H ' ' A' ' 68' ' ' GLN . 25.6 p-80 -62.57 -40.1 95.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.096 0.474 . . . . 1.0 111.166 -179.099 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -54.56 -6.78 0.12 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.355 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.513 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -84.5 -34.65 23.31 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.779 -0.368 . . . . 1.0 111.363 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -95.1 18.42 12.21 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 119.225 -0.417 . . . . 1.0 111.063 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.472 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 39.9 mtt 82.37 12.92 0.54 Allowed 'General case' 0 N--CA 1.463 0.225 0 O-C-N 123.884 0.74 . . . . 1.0 110.128 -178.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.416 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -59.97 100.87 0.22 Allowed Glycine 0 C--N 1.343 0.926 0 C-N-CA 120.526 -0.845 . . . . 1.0 111.311 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.9 mt -71.56 -40.57 69.91 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.814 -0.439 . . . . 1.0 109.814 177.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.8 m -115.78 116.96 28.94 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 109.486 -0.561 . . . . 1.0 109.486 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.442 ' OD1' ' OD1' ' A' ' 34' ' ' ASN . 54.1 t0 -68.09 53.6 0.07 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.978 -0.555 . . . . 1.0 111.271 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.559 ' O ' ' O ' ' A' ' 32' ' ' ARG . 8.5 t -113.75 -113.37 0.34 Allowed 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 108.798 -0.816 . . . . 1.0 108.798 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.525 ' N ' ' OG ' ' A' ' 75' ' ' SER . 7.5 t 90.69 109.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 O-C-N 123.646 0.592 . . . . 1.0 110.362 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -126.09 8.51 7.33 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.742 0.306 . . . . 1.0 110.928 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 p -163.45 161.21 24.14 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.144 0.497 . . . . 1.0 110.789 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 27.4 p -154.75 146.98 23.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.456 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.7 ptm180 -127.84 148.01 50.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.224 -0.288 . . . . 1.0 110.224 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.414 HD12 ' CE2' ' A' ' 43' ' ' TRP . 19.9 tp -98.64 127.3 44.52 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.858 -0.793 . . . . 1.0 108.858 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.405 ' N ' HD13 ' A' ' 81' ' ' LEU . 2.8 mt -93.16 120.49 66.8 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.189 -0.459 . . . . 1.0 109.827 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -48.34 140.47 20.57 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.145 1.897 . . . . 1.0 112.884 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.497 ' O ' ' O ' ' A' ' 85' ' ' SER . 90.5 m-70 -61.89 -30.87 71.16 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.955 -1.021 . . . . 1.0 110.993 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' ' O ' ' A' ' 84' ' ' HIS . 1.3 m 53.59 154.73 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.75 -0.659 . . . . 1.0 111.302 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -97.28 -79.02 1.44 Allowed Glycine 0 CA--C 1.522 0.486 0 N-CA-C 109.941 -1.264 . . . . 1.0 109.941 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.3 m -87.27 158.93 18.97 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.752 -0.462 . . . . 1.0 109.752 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.451 ' HE2' ' HB2' ' A' ' 85' ' ' SER . 5.8 m-70 -132.52 128.43 37.3 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.887 0.375 . . . . 1.0 110.926 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -155.1 133.91 12.11 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.679 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.6 tt -146.21 150.12 15.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.442 -0.344 . . . . 1.0 110.754 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.4 98.28 5.0 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.25 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.24 137.63 38.22 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.326 0.584 . . . . 1.0 111.43 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.45 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 56.9 m-85 -111.93 134.42 53.49 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 115.11 -0.95 . . . . 1.0 110.841 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.466 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.9 tm-20 -52.98 -56.93 12.35 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.511 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -104.1 171.5 7.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.564 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -47.78 156.96 0.29 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.63 -0.714 . . . . 1.0 110.311 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.436 ' C ' ' CD2' ' A' ' 98' ' ' TYR . 13.5 m-20 55.36 -97.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.878 -0.601 . . . . 1.0 109.92 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.436 ' CD2' ' C ' ' A' ' 97' ' ' ASP . 0.8 OUTLIER -167.83 30.19 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.305 -0.558 . . . . 1.0 109.697 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -88.63 50.51 1.98 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.789 -0.641 . . . . 1.0 111.219 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -173.03 -172.52 38.7 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.32 -0.854 . . . . 1.0 111.407 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -58.31 146.83 32.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.988 -0.375 . . . . 1.0 109.988 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.455 ' HG2' ' N ' ' A' ' 103' ' ' ILE . 11.7 ttp -131.54 153.06 50.22 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.897 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.455 ' N ' ' HG2' ' A' ' 102' ' ' MET . 11.9 tt -146.51 142.12 20.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.5 -0.556 . . . . 1.0 109.5 177.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -112.54 143.41 43.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.47 0.653 . . . . 1.0 110.427 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -129.52 156.96 43.31 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 114.814 -1.084 . . . . 1.0 110.567 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.6 p -143.73 15.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.433 -0.803 . . . . 1.0 110.592 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.413 ' C ' ' NE ' ' A' ' 169' ' ' ARG . 16.8 pt-20 -156.6 -168.55 2.73 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.202 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.631 ' N ' ' NE ' ' A' ' 169' ' ' ARG . 49.1 p30 -79.87 147.98 31.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.805 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.479 ' O ' ' OG ' ' A' ' 166' ' ' SER . 2.2 t -138.03 93.95 2.83 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.013 -0.54 . . . . 1.0 109.996 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.3 p -65.04 -22.28 66.96 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.809 -0.357 . . . . 1.0 111.209 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 16.4 t -140.56 94.23 2.71 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.311 0.577 . . . . 1.0 110.618 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.57 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.0 tp -62.62 -43.5 98.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.342 -0.845 . . . . 1.0 110.299 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.65 ' NE2' HD21 ' A' ' 119' ' ' ASN . 22.5 mp0 -48.93 -7.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.925 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.57 ' H ' ' C ' ' A' ' 112' ' ' LEU . 45.7 t0 -94.88 -26.49 16.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.945 0.402 . . . . 1.0 110.346 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.8 mmt180 -108.31 -34.46 6.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.191 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.452 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 5.3 t80 -124.23 118.48 26.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.12 0.486 . . . . 1.0 109.871 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -54.51 -67.62 0.25 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.529 -0.76 . . . . 1.0 111.12 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.466 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 92.6 m-85 -40.14 141.66 0.45 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.233 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.65 HD21 ' NE2' ' A' ' 113' ' ' GLN . 19.1 t-20 -102.22 2.32 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.809 0.338 . . . . 1.0 111.35 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -130.24 138.86 50.76 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.219 0.533 . . . . 1.0 111.045 -178.146 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 37.4 mm -122.2 125.9 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 CA-C-N 115.303 -0.862 . . . . 1.0 109.358 178.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.522 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.5 m-70 -114.06 17.57 17.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.473 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.522 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 3.2 m 170.5 156.08 0.06 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.997 0.427 . . . . 1.0 110.965 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.443 ' CD2' ' CD1' ' A' ' 151' ' ' TYR . 0.0 OUTLIER -160.11 162.08 33.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.818 179.466 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.57 112.31 16.04 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.045 -0.724 . . . . 1.0 109.045 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 40.4 t -101.72 103.95 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.634 179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.587 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.55 -37.45 36.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.75 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 129' ' ' GLY . 31.1 tp10 -138.87 158.34 44.39 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.875 0.369 . . . . 1.0 110.416 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.433 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.08 -173.2 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 111.078 -0.809 . . . . 1.0 111.078 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.497 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.7 OUTLIER -115.71 176.18 5.2 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.384 -0.598 . . . . 1.0 109.384 179.545 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.497 ' CD1' ' C ' ' A' ' 130' ' ' SER . 67.3 m95 -147.12 161.1 41.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.694 -0.684 . . . . 1.0 110.346 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 60.1 t -132.05 134.01 60.13 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 116.058 -0.519 . . . . 1.0 109.771 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.48 143.53 37.32 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . 0.536 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 13.6 m-85 -119.43 131.9 55.72 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.041 0.448 . . . . 1.0 110.306 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -47.69 -23.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.945 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.425 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -147.75 179.67 7.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.061 0.458 . . . . 1.0 110.199 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.5 p -84.8 170.58 13.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.023 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . 0.61 ' ND2' ' HE ' ' A' ' 140' ' ' ARG . 57.5 t30 66.01 16.37 10.44 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.049 -0.978 . . . . 1.0 110.262 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.545 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 5.1 m-85 40.37 78.66 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.801 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.61 ' HE ' ' ND2' ' A' ' 138' ' ' ASN . 90.9 mtt-85 -147.94 37.38 0.87 Allowed 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 120.905 0.383 . . . . 1.0 110.658 179.345 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -148.3 -145.64 4.19 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.428 -0.669 . . . . 1.0 111.428 -178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -74.34 157.45 35.72 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 110.18 -0.304 . . . . 1.0 110.18 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.472 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 66.1 mt-30 -133.75 133.66 42.02 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.538 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -128.5 133.3 48.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.305 -0.628 . . . . 1.0 109.305 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -91.54 128.72 37.48 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.363 0.602 . . . . 1.0 110.587 -179.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.605 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.34 90.55 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.194 -0.912 . . . . 1.0 109.103 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -68.86 150.72 97.54 Favored Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 114.857 -1.065 . . . . 1.0 111.097 -178.657 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -44.93 119.22 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 C-N-CA 121.404 1.403 . . . . 1.0 111.298 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 166.2 -151.0 19.02 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.405 -1.078 . . . . 1.0 110.405 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -136.01 125.54 25.19 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.676 0.274 . . . . 1.0 110.614 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 3.1 m-85 -116.43 129.41 56.21 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.325 -0.62 . . . . 1.0 109.325 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . 0.428 ' CA ' ' HG ' ' A' ' 123' ' ' SER . 72.9 mtm-85 -107.24 -1.54 21.69 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.02 0.438 . . . . 1.0 110.432 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.663 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -156.99 163.03 39.56 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.474 0.654 . . . . 1.0 110.867 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.535 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 9.1 p90 -78.28 -21.08 50.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.905 -1.043 . . . . 1.0 112.565 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.663 ' NE2' HH21 ' A' ' 153' ' ' ARG . 55.0 mt-30 -68.8 -20.03 64.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.93 -0.577 . . . . 1.0 111.167 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -51.96 -48.42 64.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.86 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.535 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 16.8 p90 -95.77 20.92 9.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.84 75.76 0.2 Allowed Glycine 0 CA--C 1.521 0.429 0 N-CA-C 111.212 -0.755 . . . . 1.0 111.212 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.46 ' CB ' ' HE1' ' A' ' 157' ' ' TRP . . . -118.85 149.24 41.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.086 0.469 . . . . 1.0 110.146 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 13.4 t -76.93 -21.3 55.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.254 -0.884 . . . . 1.0 110.207 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -163.33 -170.1 2.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.879 0.371 . . . . 1.0 110.492 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -108.91 -7.12 15.5 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.102 -0.499 . . . . 1.0 110.577 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -49.23 119.56 3.39 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.067 0.461 . . . . 1.0 111.121 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.9 t -135.05 121.25 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.372 -0.831 . . . . 1.0 109.382 177.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.403 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -100.54 -23.09 10.48 Favored Glycine 0 N--CA 1.467 0.717 0 N-CA-C 111.716 -0.554 . . . . 1.0 111.716 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.661 ' HG ' ' N ' ' A' ' 167' ' ' LEU . 5.2 t -156.77 179.94 8.8 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.266 -0.573 . . . . 1.0 110.314 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.661 ' N ' ' HG ' ' A' ' 166' ' ' SER . 1.5 pp -166.29 142.65 4.92 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.002 -0.544 . . . . 1.0 111.165 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.545 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 13.4 ptp180 -136.15 152.57 50.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.836 0.351 . . . . 1.0 110.123 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.631 ' NE ' ' N ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -81.01 159.16 24.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.193 -0.669 . . . . 1.0 109.193 177.792 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.405 ' O ' HG21 ' A' ' 170' ' ' VAL . 27.1 m -92.41 66.14 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.791 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 19.5 mt -121.77 131.43 73.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.441 0.639 . . . . 1.0 110.948 179.441 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -95.18 -26.79 15.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.886 -1.052 . . . . 1.0 110.58 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 51.3 p90 -89.33 -165.47 1.35 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.9 0.381 . . . . 1.0 110.747 -179.863 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 46.4 t . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.989 -1.005 . . . . 1.0 110.635 -179.995 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.488 ' O ' ' O ' ' A' ' 2' ' ' GLY . 86.9 mt-30 . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.461 -0.57 . . . . 1.0 109.461 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 1' ' ' GLN . . . 51.18 168.17 0.01 OUTLIER Glycine 0 C--N 1.333 0.393 0 N-CA-C 110.726 -0.95 . . . . 1.0 110.726 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -174.77 100.4 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.673 -0.411 . . . . 1.0 110.24 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.4 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -119.99 164.8 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 CA-C-N 116.264 -0.426 . . . . 1.0 110.278 -178.902 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.8 m -124.16 118.6 27.25 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.29 -1.004 . . . . 1.0 108.29 177.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.8 mt -102.79 133.14 48.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.853 -1.067 . . . . 1.0 109.853 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 66.0 m-85 -115.92 126.1 53.45 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.499 -0.773 . . . . 1.0 111.005 -178.575 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.533 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 82.0 tt0 -53.51 -31.57 46.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.608 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -115.16 153.67 30.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.283 0.564 . . . . 1.0 110.439 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' C ' ' N ' ' A' ' 12' ' ' PHE . 4.4 ptm180 -58.63 -173.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.609 -0.723 . . . . 1.0 110.265 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.47 26.84 0.25 Allowed Glycine 0 N--CA 1.462 0.388 0 N-CA-C 110.956 -0.858 . . . . 1.0 110.956 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.5 m-85 50.28 70.94 0.45 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.362 -0.419 . . . . 1.0 110.279 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -132.0 -158.81 0.92 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.92 0.391 . . . . 1.0 110.532 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.89 -151.93 0.3 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.533 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 89.0 mtm180 -68.77 146.57 52.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 1.0 110.768 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.3 p-80 -136.03 152.66 51.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.247 0.546 . . . . 1.0 110.377 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.531 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -146.69 141.51 26.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.494 -0.776 . . . . 1.0 110.294 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.531 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.0 tt0 -110.2 123.1 49.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.057 -0.52 . . . . 1.0 110.177 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.423 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.1 t -112.69 126.92 55.92 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.86 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -117.49 10.85 13.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.353 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.0 p -154.34 165.95 34.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.61 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.437 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 47.1 p-10 -58.32 141.65 50.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.549 -0.75 . . . . 1.0 111.446 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.423 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -136.19 146.22 46.59 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.389 -0.823 . . . . 1.0 110.484 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.6 p -112.78 -16.17 12.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.738 -0.664 . . . . 1.0 111.651 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -151.03 117.48 5.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.271 0.558 . . . . 1.0 110.667 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.4 mt -118.24 -0.41 11.54 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.283 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.581 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 45.6 mt-30 -46.39 -53.44 23.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.795 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.581 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.4 Cg_endo -54.35 -30.35 62.45 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.842 1.695 . . . . 1.0 111.977 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.433 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -96.27 -54.32 3.32 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.586 -0.446 . . . . 1.0 110.664 -179.062 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -117.74 126.95 53.4 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.756 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.2 t -95.28 -9.45 33.07 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.746 -0.661 . . . . 1.0 111.499 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 94.4 mtm-85 -146.36 -59.56 0.3 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t 64.8 76.37 0.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 1.0 110.004 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -92.55 3.78 54.85 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.999 -0.546 . . . . 1.0 111.383 -178.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.0 p -158.67 158.76 34.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.818 0.342 . . . . 1.0 110.274 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.92 155.73 34.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.995 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.4 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 25.3 mtp180 -134.67 123.62 24.01 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 108.96 -0.756 . . . . 1.0 108.96 178.737 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.06 132.66 56.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.364 -0.606 . . . . 1.0 109.364 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -93.92 -43.59 8.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.627 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.7 t -160.99 151.84 18.46 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.269 -0.423 . . . . 1.0 109.874 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.26 175.78 47.58 Favored Glycine 0 C--N 1.319 -0.405 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.4 m -113.02 137.52 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.509 -0.552 . . . . 1.0 109.509 178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 46.8 m95 -124.02 155.98 37.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.242 0.544 . . . . 1.0 110.904 -178.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 1.4 tpt -127.78 129.1 46.47 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.694 -0.854 . . . . 1.0 108.694 178.783 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 2.7 mt -108.69 130.33 55.35 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 -179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.419 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 73.3 m-85 -108.26 131.61 54.53 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.665 0.745 . . . . 1.0 110.758 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.607 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 4.7 pt-20 -59.25 -35.11 73.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.711 -1.131 . . . . 1.0 110.347 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.403 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.3 mt-30 -111.0 153.41 43.85 Favored Pre-proline 0 N--CA 1.462 0.146 0 CA-C-N 116.446 -0.343 . . . . 1.0 110.49 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.93 159.17 43.44 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.443 2.095 . . . . 1.0 112.623 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.651 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.64 39.21 11.53 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.731 -0.668 . . . . 1.0 111.023 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.419 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 5.2 m-85 48.17 74.22 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 1.0 110.746 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.8 m -141.5 153.15 44.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.063 0.459 . . . . 1.0 110.168 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.42 -147.26 19.95 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.91 -0.662 . . . . 1.0 111.675 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.607 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 37.2 tp -80.31 146.0 31.82 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.388 -0.406 . . . . 1.0 110.647 -179.309 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.416 ' NE2' ' H ' ' A' ' 145' ' ' LEU . 12.1 pt20 -121.78 150.86 41.26 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.839 0.352 . . . . 1.0 110.537 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.419 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 24.7 m-85 -127.53 132.54 49.9 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.236 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.5 t80 -80.77 118.3 22.18 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.576 0.703 . . . . 1.0 109.961 -178.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -111.71 133.89 53.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.131 -0.94 . . . . 1.0 109.704 179.554 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.4 ptt85 -133.65 162.12 32.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.441 -0.799 . . . . 1.0 110.204 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -41.06 123.88 2.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.322 -0.399 . . . . 1.0 110.91 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.08 178.63 33.27 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.86 -0.896 . . . . 1.0 110.86 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.4 p-10 -115.29 124.43 51.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.206 0.527 . . . . 1.0 110.222 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -119.32 112.46 19.48 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.244 -0.651 . . . . 1.0 109.244 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.24 -4.04 54.65 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.496 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.9 m-20 -147.58 138.34 23.37 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.398 -0.593 . . . . 1.0 109.398 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.559 ' ND1' ' OD1' ' A' ' 74' ' ' ASP . 5.7 p80 -58.48 -40.96 84.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.133 0.492 . . . . 1.0 110.969 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -54.3 -7.82 0.17 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.709 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.485 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -81.89 -34.82 29.79 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.386 -0.526 . . . . 1.0 111.05 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.75 13.19 18.91 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.963 -0.295 . . . . 1.0 110.311 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.468 ' C ' ' H ' ' A' ' 72' ' ' LEU . 52.6 mtt 74.51 35.98 0.66 Allowed 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.915 0.759 . . . . 1.0 109.967 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -72.67 42.91 0.9 Allowed Glycine 0 CA--C 1.531 1.057 0 C-N-CA 120.158 -1.02 . . . . 1.0 111.463 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.475 ' C ' ' O ' ' A' ' 71' ' ' GLY . 14.9 mt -25.13 -44.36 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.761 0.424 . . . . 1.0 111.094 -178.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 71' ' ' GLY . 47.1 t -119.42 114.09 21.78 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 108.563 -0.902 . . . . 1.0 108.563 177.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.559 ' OD1' ' ND1' ' A' ' 66' ' ' HIS . 91.2 m-20 -62.43 -161.89 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.73 -0.471 . . . . 1.0 109.73 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.55 ' O ' ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER 83.48 69.0 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.905 0 CA-C-O 120.836 0.35 . . . . 1.0 111.387 178.975 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -100.02 114.4 38.39 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 N-CA-C 108.607 -0.886 . . . . 1.0 108.607 178.173 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -121.49 4.12 10.19 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.867 -0.606 . . . . 1.0 111.566 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.2 p -163.22 162.69 25.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.177 0.513 . . . . 1.0 110.543 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 25.2 p -155.55 147.26 23.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 1.0 110.188 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.08 146.46 50.36 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.933 -0.395 . . . . 1.0 109.933 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 24.0 tp -96.41 136.15 37.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.485 -0.932 . . . . 1.0 108.485 178.095 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mt -96.41 112.91 61.42 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.606 -0.516 . . . . 1.0 109.606 179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -51.77 148.62 21.55 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 122.143 1.895 . . . . 1.0 113.224 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -71.03 179.44 2.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.452 -0.795 . . . . 1.0 110.301 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.2 t -171.91 153.24 3.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.906 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -100.59 -58.35 0.85 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.471 -1.052 . . . . 1.0 110.471 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 m -88.04 147.65 24.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 1.0 110.244 179.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -136.06 114.69 11.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 1.0 110.94 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -142.29 133.76 26.55 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.195 -0.298 . . . . 1.0 110.195 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.9 tt -145.93 143.29 21.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.387 -0.37 . . . . 1.0 111.007 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -121.58 101.75 7.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.447 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.9 mt -82.89 139.29 33.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.964 -0.562 . . . . 1.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.471 ' CE1' ' CG ' ' A' ' 102' ' ' MET . 67.7 m-85 -115.15 136.96 52.55 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.527 0.679 . . . . 1.0 111.276 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.588 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 17.4 pt-20 -58.48 -47.12 85.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.278 -0.874 . . . . 1.0 110.354 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.493 ' N ' ' CG ' ' A' ' 94' ' ' GLU . 24.7 mtt85 -115.22 165.91 12.42 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.086 -0.506 . . . . 1.0 111.089 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.641 ' O ' ' O ' ' A' ' 97' ' ' ASP . 95.7 mt-10 -52.91 159.07 1.22 Allowed 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 115.312 -0.858 . . . . 1.0 110.354 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.791 ' O ' ' N ' ' A' ' 99' ' ' ARG . 53.3 t0 50.66 124.94 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.703 0 O-C-N 124.235 0.959 . . . . 1.0 108.686 -179.104 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.516 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.2 OUTLIER -35.0 73.51 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.292 -0.413 . . . . 1.0 111.501 -177.868 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.791 ' N ' ' O ' ' A' ' 97' ' ' ASP . 10.3 ptm180 -139.68 169.99 16.72 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 120.636 -0.426 . . . . 1.0 109.917 -178.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 69.94 -161.98 52.82 Favored Glycine 0 CA--C 1.521 0.413 0 N-CA-C 110.828 -0.909 . . . . 1.0 110.828 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.588 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 11.6 tp-100 -61.39 139.45 58.19 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.917 -0.313 . . . . 1.0 110.205 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.724 ' SD ' ' N ' ' A' ' 103' ' ' ILE . 4.3 tmm? -131.73 137.66 48.32 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.585 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.724 ' N ' ' SD ' ' A' ' 102' ' ' MET . 8.3 tt -134.37 137.41 51.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.094 -0.706 . . . . 1.0 109.094 178.134 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -111.33 146.88 36.3 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.526 0.679 . . . . 1.0 110.362 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.408 ' CZ ' ' CD1' ' A' ' 112' ' ' LEU . 89.0 m-85 -130.27 155.67 45.93 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.037 -0.983 . . . . 1.0 110.466 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.6 p -143.77 27.76 1.47 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.681 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.408 ' CD ' ' N ' ' A' ' 107' ' ' GLU . 1.4 pm0 -168.08 -167.68 0.86 Allowed 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.713 -0.395 . . . . 1.0 110.47 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -81.64 147.34 29.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.419 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.521 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 3.2 m -139.16 97.05 3.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.44 -30.88 71.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.901 0.382 . . . . 1.0 110.983 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 51.5 m -137.74 93.14 2.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.982 -0.553 . . . . 1.0 110.511 -179.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.528 ' O ' ' N ' ' A' ' 115' ' ' ARG . 13.4 tp -60.59 -39.19 87.19 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.448 -0.796 . . . . 1.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.552 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 25.3 mp0 -43.86 -13.49 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.634 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 112' ' ' LEU . 93.6 m-20 -93.82 2.07 56.29 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.189 0.519 . . . . 1.0 110.751 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.3 mmt180 -133.59 -39.87 0.89 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.886 -1.052 . . . . 1.0 112.654 -177.019 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.727 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -123.1 136.08 54.65 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 122.061 0.934 . . . . 1.0 111.136 -179.036 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 118' ' ' PHE . 20.3 mmm180 -72.44 -70.09 0.36 Allowed 'General case' 0 C--N 1.315 -0.898 0 O-C-N 121.059 -1.026 . . . . 1.0 110.367 -178.438 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.672 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 61.0 m-85 -31.51 143.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.618 0.574 . . . . 1.0 110.187 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -105.03 6.79 33.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.998 0.428 . . . . 1.0 110.522 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -139.74 139.86 36.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.937 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.401 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 42.0 mm -120.11 120.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.385 -0.825 . . . . 1.0 109.108 178.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -110.59 22.29 15.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 1.0 111.584 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.478 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.8 p 169.08 151.71 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.071 0.463 . . . . 1.0 110.015 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -161.96 157.11 23.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 1.0 110.183 -178.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -125.01 117.67 24.53 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 22.0 t -101.59 105.07 17.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 109.597 -0.52 . . . . 1.0 109.597 179.376 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.583 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.8 OUTLIER -78.54 -40.95 33.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.787 -0.642 . . . . 1.0 111.494 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.7 mm-40 -139.69 167.3 22.42 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.443 0.639 . . . . 1.0 110.633 -178.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 44.26 -179.49 0.01 OUTLIER Glycine 0 C--N 1.315 -0.637 0 CA-C-N 113.911 -1.495 . . . . 1.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 20.2 m -119.4 149.63 41.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.358 -0.608 . . . . 1.0 109.358 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.459 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 37.2 m95 -121.61 167.19 13.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.822 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.428 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 2.0 p -141.8 96.5 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.911 -0.315 . . . . 1.0 110.917 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 7.7 mt -66.53 142.63 57.45 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.389 -0.524 . . . . 1.0 110.966 -178.115 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -117.8 129.96 55.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.773 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -43.21 -49.11 6.62 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.053 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.415 ' C ' ' CD1' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.39 175.45 7.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.197 0.522 . . . . 1.0 110.559 -179.122 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -81.81 172.78 12.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.562 -0.745 . . . . 1.0 110.508 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 38.4 m-20 63.44 17.65 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.29 -0.868 . . . . 1.0 110.278 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.429 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 7.4 m-85 36.29 77.89 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.174 -0.467 . . . . 1.0 111.71 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 52.9 ttm-85 -147.0 39.87 1.04 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.953 0.406 . . . . 1.0 110.64 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -154.51 -138.62 2.65 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.105 -0.798 . . . . 1.0 111.105 -178.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -79.27 169.59 17.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.93 0.395 . . . . 1.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.94 137.91 21.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.747 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . 0.428 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 17.8 m-85 -125.48 137.97 53.98 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 108.609 -0.886 . . . . 1.0 108.609 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.416 ' H ' ' NE2' ' A' ' 55' ' ' GLN . 38.5 tp -95.05 126.37 40.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.339 0.59 . . . . 1.0 111.149 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.579 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.6 mm? -114.33 109.31 18.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.208 -0.905 . . . . 1.0 109.832 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -83.26 166.66 33.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 116.295 -0.411 . . . . 1.0 110.1 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -62.01 114.03 2.13 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.979 1.786 . . . . 1.0 111.223 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.43 -150.87 11.3 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.587 -1.005 . . . . 1.0 110.587 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 66.6 t0 -128.56 134.62 48.68 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.815 0.34 . . . . 1.0 110.551 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.6 m-85 -125.95 131.4 52.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.209 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -117.22 -1.31 11.86 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.952 0.406 . . . . 1.0 110.419 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.662 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -157.16 165.3 36.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.892 -0.595 . . . . 1.0 110.402 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 14.4 p90 -79.39 -20.77 46.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.261 -0.881 . . . . 1.0 112.253 -177.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.662 ' NE2' HH21 ' A' ' 153' ' ' ARG . 51.8 mt-30 -68.6 -19.61 64.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 1.0 111.218 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -51.37 -48.81 62.42 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.894 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.451 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 17.8 p90 -97.64 20.74 11.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.714 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.92 75.57 0.21 Allowed Glycine 0 CA--C 1.518 0.223 0 N-CA-C 111.125 -0.79 . . . . 1.0 111.125 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.43 ' CB ' ' HE1' ' A' ' 157' ' ' TRP . . . -117.84 149.59 40.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 121.069 0.461 . . . . 1.0 110.274 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.3 t -79.11 -12.46 60.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.354 -0.839 . . . . 1.0 110.238 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.557 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 9.0 t-20 -170.5 -171.25 1.04 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.996 0.427 . . . . 1.0 110.486 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.557 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -108.98 -8.83 15.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.624 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -48.37 123.88 7.18 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 121.498 0.666 . . . . 1.0 111.171 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 41.5 t -131.28 133.78 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.924 178.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.464 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -111.19 -31.18 2.92 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 111.715 -0.554 . . . . 1.0 111.715 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 9.3 p -158.84 -169.46 2.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.763 0.316 . . . . 1.0 110.462 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 pp -173.03 138.1 0.74 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.794 -179.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -129.6 141.96 50.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.57 0.7 . . . . 1.0 109.878 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.748 ' CD ' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -77.22 145.91 37.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.155 178.135 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 48.7 t -82.52 88.32 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.691 -0.404 . . . . 1.0 111.839 -178.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.1 mp -144.27 111.61 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.187 -0.46 . . . . 1.0 110.496 179.368 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -68.4 -35.52 77.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.512 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -59.34 -78.48 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.951 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 63.3 m . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.942 -1.028 . . . . 1.0 110.532 179.956 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . 0.497 ' O ' ' O ' ' A' ' 2' ' ' GLY . 12.9 pt20 . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.586 -0.524 . . . . 1.0 109.586 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.497 ' O ' ' O ' ' A' ' 1' ' ' GLN . . . 50.4 168.63 0.01 OUTLIER Glycine 0 C--N 1.334 0.463 0 N-CA-C 110.752 -0.939 . . . . 1.0 110.752 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 tttt -176.34 100.87 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.498 -0.481 . . . . 1.0 110.319 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.422 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -118.89 165.38 14.26 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.659 -179.401 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 26.9 m -124.0 120.3 32.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.542 -0.91 . . . . 1.0 108.542 177.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.4 mt -104.11 132.87 49.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.94 -1.027 . . . . 1.0 109.845 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 67.1 m-85 -115.05 124.99 53.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.938 -178.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -52.71 -29.85 29.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.596 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -117.23 154.96 30.26 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.112 0.482 . . . . 1.0 110.298 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 12' ' ' PHE . 11.5 ptm180 -59.86 -172.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.548 -0.751 . . . . 1.0 110.362 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.11 25.71 0.27 Allowed Glycine 0 N--CA 1.461 0.336 0 N-CA-C 111.086 -0.805 . . . . 1.0 111.086 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.55 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 51.44 69.17 0.69 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.527 -0.337 . . . . 1.0 110.25 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -131.28 -156.58 0.76 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.032 0.444 . . . . 1.0 110.521 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.12 -153.15 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.071 -0.812 . . . . 1.0 111.071 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -69.25 148.33 49.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.74 0.305 . . . . 1.0 110.712 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -136.64 152.57 50.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.138 0.494 . . . . 1.0 110.453 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.526 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -145.13 140.98 28.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.2 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.526 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.8 tt0 -110.3 123.63 50.17 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.269 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.499 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.2 t -112.58 127.0 55.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.737 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.7 t -118.06 15.52 14.16 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.026 -0.533 . . . . 1.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.1 p -158.89 167.58 29.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.458 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.458 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 54.1 p-10 -57.75 141.36 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.502 -0.772 . . . . 1.0 111.388 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.499 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.43 145.14 44.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.198 179.693 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 p -112.16 -16.66 12.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.735 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.8 120.34 6.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.1 0.476 . . . . 1.0 110.624 -179.635 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.3 mt -119.1 0.11 11.19 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.586 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 31.5 mt-30 -48.41 -52.13 45.62 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.784 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.586 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.8 Cg_endo -54.55 -32.58 74.92 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.933 1.756 . . . . 1.0 112.22 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -94.37 -52.37 4.37 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 120.527 -0.469 . . . . 1.0 110.555 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.2 mt -116.95 127.07 53.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.714 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -95.13 -10.56 30.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.47 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.529 ' NH2' ' OD1' ' A' ' 74' ' ' ASP . 3.0 tpt85 -145.55 -61.97 0.34 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.28 -0.418 . . . . 1.0 111.475 -178.333 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.8 t 66.83 81.32 0.2 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.779 -0.452 . . . . 1.0 109.779 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.565 ' ND2' ' HD1' ' A' ' 66' ' ' HIS . 2.4 t30 -96.93 1.78 50.84 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 120.687 0.28 . . . . 1.0 110.966 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.55 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.9 t -155.2 156.51 35.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.835 0.35 . . . . 1.0 110.087 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.4 153.72 34.15 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.912 -0.585 . . . . 1.0 110.926 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.422 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.5 mtp180 -136.05 123.41 21.94 Favored 'General case' 0 C--O 1.206 -1.189 0 N-CA-C 109.347 -0.612 . . . . 1.0 109.347 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.513 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.5 p -109.66 132.0 59.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.036 0.446 . . . . 1.0 110.259 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -85.41 -42.59 14.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.231 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 t -163.95 150.42 11.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.937 -0.394 . . . . 1.0 109.937 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.56 177.81 42.73 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 110.745 -0.942 . . . . 1.0 110.745 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -111.85 140.8 46.2 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.594 -0.521 . . . . 1.0 109.594 178.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 57.2 m95 -128.46 133.75 48.58 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.495 0.664 . . . . 1.0 111.355 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.43 ' SD ' ' C ' ' A' ' 56' ' ' TYR . 27.5 tpp -107.45 129.37 54.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.294 -0.866 . . . . 1.0 109.233 178.49 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.409 ' CD1' ' N ' ' A' ' 45' ' ' LEU . 9.9 mp -109.32 130.86 55.48 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.868 -0.605 . . . . 1.0 109.832 -179.239 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -111.09 130.65 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 1.0 111.402 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.586 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 9.3 pt-20 -56.69 -37.26 70.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.767 -0.651 . . . . 1.0 111.214 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.431 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 5.2 mt-30 -106.29 153.53 40.33 Favored Pre-proline 0 C--O 1.233 0.203 0 CA-C-N 115.83 -0.623 . . . . 1.0 110.688 -178.661 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.26 159.23 48.21 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.386 2.058 . . . . 1.0 112.208 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.639 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.4 45.04 6.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.744 -0.662 . . . . 1.0 111.149 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 42.96 74.93 0.1 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.419 -0.81 . . . . 1.0 110.837 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 m -145.38 157.31 44.05 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.061 0.458 . . . . 1.0 109.867 -178.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.7 -148.15 23.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.732 -0.746 . . . . 1.0 111.683 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.586 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.7 tp -76.83 142.41 40.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.44 -0.38 . . . . 1.0 110.202 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -119.41 150.42 40.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.487 -0.19 . . . . 1.0 110.487 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.447 ' HH ' ' H ' ' A' ' 73' ' ' SER . 18.5 m-85 -126.18 124.15 39.82 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 116.52 -0.309 . . . . 1.0 110.771 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -84.23 123.64 30.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.255 -0.43 . . . . 1.0 109.893 -179.862 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.5 mp -118.32 147.33 43.59 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.82 179.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' A' ' 60' ' ' ARG . 31.4 mtm-85 -134.74 155.02 51.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.89 -178.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' A' ' 59' ' ' ARG . 27.7 tpt85 -32.41 125.46 0.31 Allowed 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.542 0.526 . . . . 1.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.513 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 153.62 -177.34 31.2 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.242 -1.143 . . . . 1.0 110.242 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -115.6 136.18 53.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.825 0.345 . . . . 1.0 110.186 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.425 ' O ' ' OG ' ' A' ' 35' ' ' SER . 46.2 m-85 -128.25 112.41 14.46 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.819 179.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.51 -4.57 55.34 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.677 -0.692 . . . . 1.0 111.339 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 19.6 m-20 -147.14 141.94 26.81 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.417 -0.586 . . . . 1.0 109.417 179.361 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.565 ' HD1' ' ND2' ' A' ' 34' ' ' ASN . 29.9 p-80 -63.6 -39.92 95.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.979 0.419 . . . . 1.0 111.367 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -54.43 -6.77 0.12 Allowed 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.244 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.517 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.3 mm-40 -83.65 -35.28 24.7 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.676 -0.41 . . . . 1.0 111.402 -177.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.477 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -95.92 19.53 11.36 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 119.229 -0.415 . . . . 1.0 110.978 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.439 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 48.6 mtt 81.46 12.15 0.73 Allowed 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.91 0.756 . . . . 1.0 110.35 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.403 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -60.14 102.39 0.35 Allowed Glycine 0 C--N 1.342 0.88 0 C-N-CA 120.548 -0.834 . . . . 1.0 111.152 179.637 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 44.9 mt -80.55 -34.69 35.23 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.79 -0.448 . . . . 1.0 109.79 177.096 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.447 ' H ' ' HH ' ' A' ' 56' ' ' TYR . 86.8 p -121.34 109.73 15.26 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.978 -0.749 . . . . 1.0 108.978 178.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.529 ' OD1' ' NH2' ' A' ' 32' ' ' ARG . 50.9 p-10 -69.58 50.84 0.1 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.964 -0.562 . . . . 1.0 110.496 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.525 ' O ' ' C ' ' A' ' 76' ' ' VAL . 2.1 m -111.31 -47.13 3.22 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.548 -0.297 . . . . 1.0 111.336 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . 0.525 ' C ' ' O ' ' A' ' 75' ' ' SER . 1.4 p 19.6 92.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 123.979 0.799 . . . . 1.0 110.487 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -102.24 8.74 40.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.795 -0.362 . . . . 1.0 110.656 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.2 p -163.81 162.69 23.89 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.068 0.461 . . . . 1.0 110.828 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.3 p -155.34 146.88 23.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.689 -0.687 . . . . 1.0 110.273 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.3 ptm180 -128.4 150.05 50.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.455 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 38.0 tp -96.99 133.94 41.0 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.033 -0.729 . . . . 1.0 109.033 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.418 HG22 HD13 ' A' ' 82' ' ' ILE . 10.0 mt -97.18 112.7 61.6 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.892 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.6 149.92 12.84 Favored 'Trans proline' 0 N--CA 1.499 1.817 0 C-N-CA 122.353 2.035 . . . . 1.0 112.983 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -71.82 -178.07 2.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.515 -0.766 . . . . 1.0 110.32 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.0 m -163.98 157.93 19.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.207 -0.452 . . . . 1.0 110.747 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.98 -76.62 1.33 Allowed Glycine 0 CA--C 1.52 0.37 0 N-CA-C 110.229 -1.149 . . . . 1.0 110.229 179.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 m -85.96 156.53 20.44 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 109.718 -0.475 . . . . 1.0 109.718 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -128.94 109.02 10.88 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 121.061 -0.256 . . . . 1.0 111.166 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -138.46 141.9 39.46 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 120.384 -0.526 . . . . 1.0 110.516 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.4 tt -155.52 149.86 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.491 -0.322 . . . . 1.0 110.637 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.476 ' HE ' ' CB ' ' A' ' 125' ' ' ASN . 22.8 ptt180 -131.47 103.94 6.7 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.558 0.694 . . . . 1.0 111.048 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.59 150.15 26.11 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.598 -0.728 . . . . 1.0 111.801 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.413 ' CG ' ' HA ' ' A' ' 98' ' ' TYR . 99.6 m-85 -122.55 136.93 55.01 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.26 -0.882 . . . . 1.0 111.371 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.639 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.23 -52.95 61.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.276 -0.875 . . . . 1.0 111.017 179.55 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.639 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 74.5 mtp180 -109.12 177.02 4.88 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 120.843 0.354 . . . . 1.0 110.138 -178.378 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.627 ' O ' ' O ' ' A' ' 97' ' ' ASP . 57.6 mp0 -61.1 161.17 8.97 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 115.45 -0.796 . . . . 1.0 110.229 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.767 ' O ' ' N ' ' A' ' 99' ' ' ARG . 33.9 t70 50.31 125.2 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.736 0 O-C-N 124.305 1.003 . . . . 1.0 108.843 -179.223 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.485 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.6 OUTLIER -40.58 73.63 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.312 -177.69 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.767 ' N ' ' O ' ' A' ' 97' ' ' ASP . 13.8 ptm180 -127.18 -159.75 0.96 Allowed 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.922 -0.399 . . . . 1.0 109.922 -178.257 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . 0.404 ' O ' ' O ' ' A' ' 99' ' ' ARG . . . 36.91 -157.19 0.01 OUTLIER Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.076 -0.809 . . . . 1.0 111.076 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.466 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 66.4 tp60 -65.91 148.67 51.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.554 0.692 . . . . 1.0 111.174 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.64 149.17 47.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.34 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.488 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -140.5 140.46 34.09 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 109.437 -0.579 . . . . 1.0 109.437 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -113.71 132.09 55.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.369 0.604 . . . . 1.0 110.935 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.466 ' CZ ' ' CD2' ' A' ' 112' ' ' LEU . 96.9 m-85 -116.06 155.87 27.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 114.658 -1.155 . . . . 1.0 110.106 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.2 p -144.38 20.18 1.71 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.532 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -159.43 -170.8 3.07 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.595 -0.442 . . . . 1.0 110.109 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.452 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 53.6 p-10 -73.82 141.83 46.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 1.0 111.2 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.416 ' O ' ' OH ' ' A' ' 139' ' ' TYR . 2.8 m -131.17 118.91 21.14 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.259 -0.645 . . . . 1.0 109.259 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.43 ' O ' ' OG ' ' A' ' 137' ' ' SER . 87.6 p -95.86 -22.42 17.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 1.0 111.006 -179.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 50.3 t -146.07 96.82 2.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.299 0.571 . . . . 1.0 111.839 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.541 ' O ' ' N ' ' A' ' 114' ' ' ASP . 8.3 mt -62.45 -41.19 98.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.025 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -45.15 -12.58 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.139 -0.482 . . . . 1.0 111.098 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 112' ' ' LEU . 64.5 t0 -96.77 -27.18 14.85 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.958 0.409 . . . . 1.0 110.508 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.4 mmt180 -108.77 -40.64 4.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.103 -0.498 . . . . 1.0 111.497 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.488 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 5.9 t80 -121.94 118.52 29.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.208 0.528 . . . . 1.0 110.341 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -56.51 -69.07 0.16 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.215 -0.902 . . . . 1.0 111.079 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -39.72 138.46 0.74 Allowed 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 110.059 -0.348 . . . . 1.0 110.059 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -99.81 -0.41 39.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.515 -0.312 . . . . 1.0 111.038 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -125.52 138.36 53.97 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.538 0.685 . . . . 1.0 110.854 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.5 mm -121.17 119.01 58.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 CA-C-N 114.973 -1.012 . . . . 1.0 109.617 178.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.417 ' O ' ' CB ' ' A' ' 123' ' ' SER . 23.0 m-70 -110.92 22.02 15.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.694 -0.685 . . . . 1.0 111.675 -178.802 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.474 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 1.8 p 166.97 152.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.865 0.364 . . . . 1.0 110.651 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . 0.518 ' CD2' ' CD1' ' A' ' 151' ' ' TYR . 0.0 OUTLIER -162.32 163.94 27.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.557 -179.518 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . 0.476 ' CB ' ' HE ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -126.92 116.06 20.24 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.009 -0.737 . . . . 1.0 109.009 179.634 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 58.0 t -99.72 106.38 19.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 O-C-N 123.553 0.533 . . . . 1.0 110.649 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.549 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.99 -42.74 23.3 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 124.025 0.828 . . . . 1.0 110.556 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -157.77 145.38 18.54 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.457 -0.497 . . . . 1.0 110.625 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.516 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 72.6 82.83 0.29 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 115.827 -0.624 . . . . 1.0 113.061 177.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.461 ' O ' ' O ' ' A' ' 129' ' ' GLY . 13.7 t -31.51 150.24 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.162 0.506 . . . . 1.0 110.616 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.516 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 53.3 m95 -124.12 163.49 21.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.13 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 46.4 t -134.22 137.93 50.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-N 115.881 -0.6 . . . . 1.0 109.479 179.188 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 143' ' ' GLN . 28.5 mt -109.02 140.39 42.6 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 109.166 -0.679 . . . . 1.0 109.166 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . 0.624 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 30.8 m-85 -117.27 132.36 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.89 0.376 . . . . 1.0 110.875 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.439 ' OE2' ' CZ ' ' A' ' 163' ' ' ARG . 84.6 tt0 -40.7 -55.18 2.45 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.053 -0.522 . . . . 1.0 111.08 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.45 HD12 ' C ' ' A' ' 140' ' ' ARG . 0.4 OUTLIER -121.26 172.84 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.122 0.487 . . . . 1.0 110.098 -178.87 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.43 ' OG ' ' O ' ' A' ' 110' ' ' SER . 2.1 t -74.7 169.5 17.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.546 179.297 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.9 t30 66.96 15.77 10.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.231 -0.895 . . . . 1.0 110.019 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.416 ' OH ' ' O ' ' A' ' 109' ' ' CYS . 2.5 m-85 40.21 80.66 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 1.0 111.698 179.224 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.45 ' C ' HD12 ' A' ' 136' ' ' LEU . 61.8 ttt180 -149.89 40.57 0.81 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.2 0.524 . . . . 1.0 109.786 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -150.84 -140.43 3.18 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.281 -0.728 . . . . 1.0 111.281 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.41 ' C ' HE21 ' A' ' 143' ' ' GLN . 80.7 mtp85 -76.25 171.25 14.86 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 110.121 -0.325 . . . . 1.0 110.121 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.439 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -150.3 137.42 19.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.012 -179.706 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.8 m-85 -127.52 141.28 51.69 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.195 -0.668 . . . . 1.0 109.195 178.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 59.1 tp -93.83 126.78 39.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.422 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 13.4 mt -116.33 90.46 3.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.83 -0.623 . . . . 1.0 109.397 179.81 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.6 mtm -73.59 161.61 78.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.939 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -49.94 113.58 1.05 Allowed 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.934 1.756 . . . . 1.0 111.31 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 173.08 -152.28 15.68 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.454 -1.058 . . . . 1.0 110.454 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.462 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 p-10 -135.48 127.19 29.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.831 0.348 . . . . 1.0 111.248 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 1.8 m-85 -118.58 133.66 55.7 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 109.385 -0.598 . . . . 1.0 109.385 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -112.85 -4.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.814 0.34 . . . . 1.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -153.42 162.81 40.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.251 0.548 . . . . 1.0 110.208 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -75.04 -19.83 59.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.134 -0.939 . . . . 1.0 112.202 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.557 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -67.48 -20.88 65.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.85 -179.029 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -51.64 -47.94 63.54 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 120.252 -0.579 . . . . 1.0 110.793 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.534 ' HE1' ' HB3' ' A' ' 159' ' ' ALA . 37.9 p90 -101.9 18.53 20.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 1.0 110.305 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.69 77.85 0.13 Allowed Glycine 0 C--N 1.331 0.265 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.534 ' HB3' ' HE1' ' A' ' 157' ' ' TRP . . . -96.12 -170.42 2.11 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.093 0.473 . . . . 1.0 109.995 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -34.92 2.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.462 -0.79 . . . . 1.0 111.621 -179.16 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.572 ' ND2' ' O ' ' A' ' 161' ' ' ASN . 0.6 OUTLIER -150.17 -15.81 0.25 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.85 0.315 . . . . 1.0 111.85 -178.86 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.518 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 88.52 -23.61 0.11 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.787 -0.642 . . . . 1.0 110.827 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.439 ' CZ ' ' OE2' ' A' ' 135' ' ' GLU . 34.2 ptt180 -42.17 119.4 1.35 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.568 0.699 . . . . 1.0 110.866 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 30.4 t -121.33 132.09 71.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.504 -0.771 . . . . 1.0 109.894 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -108.73 -26.87 5.15 Favored Glycine 0 N--CA 1.465 0.608 0 N-CA-C 111.338 -0.705 . . . . 1.0 111.338 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.7 p -163.88 169.02 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.961 0.41 . . . . 1.0 110.784 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -153.32 146.38 24.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.899 -0.592 . . . . 1.0 111.552 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.624 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 7.0 ptp180 -136.94 148.8 47.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.615 -0.513 . . . . 1.0 109.615 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.848 HH11 ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -82.06 152.59 26.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.219 -0.901 . . . . 1.0 109.622 177.735 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 59.2 t -85.67 85.23 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.935 0.398 . . . . 1.0 111.453 -179.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 2.3 mp -136.65 117.86 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.35 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' A' ' 172' ' ' ASP . 64.0 t0 -66.9 -39.91 87.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.43 -0.805 . . . . 1.0 110.32 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -58.43 -81.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.364 -0.38 . . . . 1.0 110.937 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.932 -1.032 . . . . 1.0 110.472 179.698 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 109.268 -0.642 . . . . 1.0 109.268 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -91.95 178.71 40.8 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.504 -1.038 . . . . 1.0 110.504 179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -172.92 106.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.062 -0.255 . . . . 1.0 110.698 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.444 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.55 173.31 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 120.813 0.34 . . . . 1.0 111.264 -179.311 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 33.5 m -130.24 120.96 25.27 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.456 -0.942 . . . . 1.0 108.456 177.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -105.91 133.09 51.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.044 -0.98 . . . . 1.0 110.058 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -114.29 129.55 56.64 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.553 -0.749 . . . . 1.0 111.231 -178.457 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.477 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 79.4 tt0 -56.15 -20.98 19.95 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.789 . . . . 1.0 110.324 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -127.14 154.56 44.6 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.146 0.498 . . . . 1.0 110.086 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 12' ' ' PHE . 29.0 ptt85 -58.95 -172.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.619 -0.719 . . . . 1.0 110.299 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.15 26.1 0.16 Allowed Glycine 0 N--CA 1.463 0.44 0 N-CA-C 111.083 -0.807 . . . . 1.0 111.083 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.436 ' N ' ' O ' ' A' ' 10' ' ' ARG . 5.7 m-85 50.54 66.99 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.934 -0.395 . . . . 1.0 109.934 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -126.15 -155.84 0.7 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.825 0.345 . . . . 1.0 110.469 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 39.78 -149.1 0.14 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -71.19 149.0 46.75 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.906 0.384 . . . . 1.0 110.497 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -135.01 144.78 47.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.353 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.561 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.5 t80 -140.94 142.34 34.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 1.0 110.039 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.561 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 40.5 tt0 -110.82 122.1 47.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.269 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.46 127.21 54.24 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.187 -0.461 . . . . 1.0 110.513 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -117.56 14.6 14.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 95.5 p -159.62 169.17 24.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.538 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 81' ' ' LEU . 47.7 m-20 -57.82 139.88 53.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.722 -0.672 . . . . 1.0 110.884 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.418 ' CE1' ' HH ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -134.83 148.58 50.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.552 -0.749 . . . . 1.0 110.146 -179.946 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -118.84 -18.84 8.8 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.654 -0.703 . . . . 1.0 112.07 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -143.87 108.66 4.91 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.197 0.522 . . . . 1.0 109.954 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 26.0 mt -111.78 0.41 16.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.747 -0.661 . . . . 1.0 110.172 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.8 mt-30 -55.28 -42.97 98.71 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.621 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.3 Cg_exo -58.85 -36.89 96.22 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.277 1.985 . . . . 1.0 112.029 -179.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -93.33 -44.61 8.21 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.962 0.41 . . . . 1.0 111.067 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.74 127.8 49.67 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.766 -0.652 . . . . 1.0 111.444 -178.438 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -91.44 -11.41 37.69 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.143 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.477 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 42.0 ttm180 -176.16 120.39 0.16 Allowed 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t -101.49 107.42 18.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.115 -0.366 . . . . 1.0 110.394 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -103.56 -4.71 23.54 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.375 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.6 p -156.18 156.41 34.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.965 0.412 . . . . 1.0 110.333 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.84 155.14 36.54 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.897 -0.592 . . . . 1.0 110.997 -179.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.3 mtt-85 -136.03 122.34 20.51 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.74 -0.664 . . . . 1.0 109.567 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.465 HG12 ' H ' ' A' ' 61' ' ' GLY . 1.4 p -110.47 129.39 65.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.981 0.42 . . . . 1.0 110.948 179.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -81.06 -46.02 15.63 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.453 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.463 ' HG ' ' N ' ' A' ' 41' ' ' GLY . 46.5 t -162.37 153.33 17.55 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.018 -0.364 . . . . 1.0 110.018 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . 0.463 ' N ' ' HG ' ' A' ' 40' ' ' SER . . . 91.54 175.27 43.17 Favored Glycine 0 C--N 1.32 -0.357 0 N-CA-C 110.876 -0.89 . . . . 1.0 110.876 179.385 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 84.5 m -111.0 132.36 54.27 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.209 -0.663 . . . . 1.0 109.209 178.464 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.444 ' CE2' HG23 ' A' ' 4' ' ' ILE . 50.3 m95 -118.62 146.93 44.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 1.0 111.195 -179.075 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -117.99 127.18 53.57 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 109.246 -0.649 . . . . 1.0 109.246 178.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.421 ' CD1' ' N ' ' A' ' 45' ' ' LEU . 10.4 mp -108.27 127.38 53.8 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.53 -0.544 . . . . 1.0 109.53 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -103.88 131.12 51.4 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.579 0.704 . . . . 1.0 111.429 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.548 ' O ' ' O ' ' A' ' 75' ' ' SER . 22.1 pt-20 -60.53 -35.34 75.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.908 -1.042 . . . . 1.0 109.557 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.418 ' O ' ' OG ' ' A' ' 78' ' ' SER . 6.8 mt-30 -102.24 152.59 38.3 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.066 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.514 ' C ' HD21 ' A' ' 50' ' ' ASN . 18.1 Cg_endo -56.94 151.16 51.01 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.752 1.635 . . . . 1.0 110.796 179.293 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.716 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.5 OUTLIER 70.26 -116.11 0.1 Allowed 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.241 -1.022 . . . . 1.0 108.241 -177.711 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -152.83 70.94 0.9 Allowed 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 178.298 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.7 t -137.18 18.08 2.97 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 120.785 0.326 . . . . 1.0 110.888 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -134.68 -171.18 12.42 Favored Glycine 0 CA--C 1.519 0.341 0 N-CA-C 111.069 -0.812 . . . . 1.0 111.069 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.539 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.2 tp -58.54 151.03 21.32 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.524 -0.338 . . . . 1.0 110.153 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -121.08 149.24 43.03 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.631 0.253 . . . . 1.0 111.196 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -126.09 129.18 48.6 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 116.42 -0.355 . . . . 1.0 110.849 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.462 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 21.8 t80 -82.94 120.43 25.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.419 0.628 . . . . 1.0 110.138 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -110.79 133.78 53.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.135 -0.939 . . . . 1.0 109.678 -179.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.69 ' NH1' HH12 ' A' ' 168' ' ' ARG . 76.6 mtm180 -127.92 145.67 50.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.266 -0.879 . . . . 1.0 109.534 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.44 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.1 ttt-85 -31.71 126.8 0.22 Allowed 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.447 0.467 . . . . 1.0 111.323 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.465 ' H ' HG12 ' A' ' 38' ' ' VAL . . . 152.09 -174.34 31.1 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.472 -1.051 . . . . 1.0 110.472 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.63 133.36 56.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.004 0.43 . . . . 1.0 110.353 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -127.39 113.33 16.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.042 -0.526 . . . . 1.0 109.646 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.39 -3.68 54.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.302 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -146.63 143.48 28.84 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.395 -0.594 . . . . 1.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.54 ' C ' ' H ' ' A' ' 68' ' ' GLN . 22.7 p-80 -66.03 -42.43 89.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 1.0 110.928 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -52.01 -7.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.802 -0.635 . . . . 1.0 110.449 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.54 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.5 mm-40 -82.38 -36.14 27.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.825 -0.35 . . . . 1.0 111.212 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.7 p90 -93.53 19.58 8.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 119.391 -0.338 . . . . 1.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.623 ' C ' ' H ' ' A' ' 72' ' ' LEU . 66.6 mtp 79.88 17.19 0.75 Allowed 'General case' 0 C--O 1.233 0.209 0 O-C-N 123.942 0.776 . . . . 1.0 109.749 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.573 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -64.23 29.81 0.09 OUTLIER Glycine 0 C--N 1.343 0.972 0 C-N-CA 120.898 -0.668 . . . . 1.0 112.123 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.623 ' H ' ' C ' ' A' ' 70' ' ' MET . 2.0 pp -22.47 -43.46 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.087 0.555 . . . . 1.0 110.891 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.573 ' N ' ' O ' ' A' ' 71' ' ' GLY . 12.2 t -116.12 118.07 31.84 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.532 -0.914 . . . . 1.0 108.532 177.609 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.575 ' CG ' ' H ' ' A' ' 75' ' ' SER . 32.8 t0 -70.23 -158.05 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.687 -0.405 . . . . 1.0 110.028 -179.035 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.575 ' H ' ' CG ' ' A' ' 74' ' ' ASP . 0.8 OUTLIER 81.78 67.2 0.02 OUTLIER 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 120.741 0.305 . . . . 1.0 111.395 178.9 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 5.4 t -103.66 121.35 54.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 109.053 -0.721 . . . . 1.0 109.053 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.8 mtm180 -127.94 6.25 6.02 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.477 -178.576 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 11.5 p -161.65 159.98 28.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.147 0.498 . . . . 1.0 110.305 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.6 p -155.8 146.98 22.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.109 -178.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -127.26 145.51 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.862 -0.421 . . . . 1.0 109.862 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.407 HD11 ' CE2' ' A' ' 43' ' ' TRP . 34.3 tp -95.04 134.36 37.81 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.052 -0.722 . . . . 1.0 109.052 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.2 mt -95.33 113.53 61.83 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 109.543 -0.54 . . . . 1.0 109.543 179.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -51.24 147.54 20.76 Favored 'Trans proline' 0 N--CA 1.498 1.763 0 C-N-CA 122.257 1.971 . . . . 1.0 112.968 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.445 ' N ' ' ND1' ' A' ' 84' ' ' HIS . 2.1 m-70 -71.82 179.93 2.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.413 -0.812 . . . . 1.0 110.39 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.0 t -172.15 156.75 4.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.716 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -102.75 -59.04 0.75 Allowed Glycine 0 N--CA 1.466 0.665 0 N-CA-C 110.494 -1.043 . . . . 1.0 110.494 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m -85.89 148.06 25.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.767 0.318 . . . . 1.0 110.377 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.5 m80 -136.54 111.9 9.18 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.341 -0.39 . . . . 1.0 110.981 -179.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 43.5 mtm-85 -142.32 139.21 31.75 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.755 -0.378 . . . . 1.0 110.425 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.4 tt -152.81 153.63 8.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.063 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -133.36 112.96 12.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.294 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . 0.57 ' N ' ' CD2' ' A' ' 92' ' ' LEU . 1.5 mm? -88.92 123.47 33.3 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.419 -0.809 . . . . 1.0 109.821 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.585 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 26.6 m-85 -100.04 135.43 41.47 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 115.308 -0.86 . . . . 1.0 110.757 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.486 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.5 tm-20 -57.2 -60.58 3.4 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.585 -0.734 . . . . 1.0 111.394 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.466 ' O ' ' OG ' ' A' ' 123' ' ' SER . 84.4 mtp180 -102.2 166.8 10.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.748 -178.708 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -46.78 157.66 0.15 Allowed 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.641 -0.709 . . . . 1.0 110.711 178.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.65 ' O ' ' CD1' ' A' ' 98' ' ' TYR . 37.4 t70 58.03 -111.3 0.57 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.749 -1.114 . . . . 1.0 110.624 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.65 ' CD1' ' O ' ' A' ' 97' ' ' ASP . 3.9 m-85 -150.82 30.58 0.65 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.89 -0.411 . . . . 1.0 109.89 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -102.17 79.78 1.9 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.102 0.477 . . . . 1.0 110.412 -178.635 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 161.15 -172.14 37.34 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-N 115.469 -0.787 . . . . 1.0 111.142 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -62.12 143.15 57.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 121.071 -0.251 . . . . 1.0 110.392 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.585 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 11.3 ttp -133.38 149.57 51.84 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.814 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.403 ' N ' ' HG2' ' A' ' 102' ' ' MET . 11.0 tt -143.0 141.8 26.48 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 N-CA-C 109.57 -0.53 . . . . 1.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -113.93 143.98 43.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 1.0 110.715 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.412 ' CE2' HD13 ' A' ' 112' ' ' LEU . 82.6 m-85 -131.36 154.83 48.18 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.011 -0.995 . . . . 1.0 110.489 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.6 p -144.52 19.85 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.805 -0.634 . . . . 1.0 111.137 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 1.019 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.0 pt-20 -167.45 83.35 0.21 Allowed 'General case' 0 C--O 1.213 -0.865 0 CA-C-O 118.025 -0.988 . . . . 1.0 109.967 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 1.019 ' O ' ' O ' ' A' ' 107' ' ' GLU . 51.9 p30 16.49 163.0 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 122.359 1.076 . . . . 1.0 113.358 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 108' ' ' ASP . 8.8 m -146.66 107.17 4.07 Favored 'General case' 0 C--N 1.308 -1.235 0 O-C-N 120.18 -1.575 . . . . 1.0 109.545 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.427 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.6 p -66.33 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.317 -0.401 . . . . 1.0 110.969 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 15.7 t -142.52 88.9 2.1 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.13 0.491 . . . . 1.0 110.208 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.59 ' C ' ' H ' ' A' ' 114' ' ' ASP . 11.7 tp -61.55 -41.71 97.77 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 115.553 -0.749 . . . . 1.0 110.265 -178.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.569 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 22.2 mp0 -43.15 -10.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.258 -0.428 . . . . 1.0 111.719 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.59 ' H ' ' C ' ' A' ' 112' ' ' LEU . 62.7 t0 -95.29 -21.81 18.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.055 0.455 . . . . 1.0 110.748 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 112' ' ' LEU . 25.2 mmt85 -108.86 -36.71 6.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.899 0.703 . . . . 1.0 112.899 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.706 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.16 138.37 54.24 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 122.2 1.0 . . . . 1.0 110.861 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.3 mmt-85 -75.33 -73.72 0.24 Allowed 'General case' 0 C--N 1.312 -1.041 0 O-C-N 120.641 -1.287 . . . . 1.0 110.62 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.683 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.4 m-85 -31.31 144.77 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.564 0 O-C-N 123.508 0.505 . . . . 1.0 110.314 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -105.6 9.25 33.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.826 0.346 . . . . 1.0 111.075 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -137.85 138.75 39.43 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.008 -0.542 . . . . 1.0 111.173 -178.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.409 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 40.6 mm -120.98 121.35 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.426 -0.807 . . . . 1.0 109.183 178.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -111.24 20.74 17.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.883 -0.599 . . . . 1.0 111.634 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 3.1 p 169.85 153.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.069 0.461 . . . . 1.0 110.273 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.5 pp -165.94 161.59 17.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.662 -0.699 . . . . 1.0 110.788 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 3.0 t30 -128.55 120.85 27.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.368 -0.378 . . . . 1.0 110.152 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.0 t -100.93 105.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.1 -0.704 . . . . 1.0 109.1 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.584 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.44 -42.2 30.62 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.932 -0.576 . . . . 1.0 111.212 -179.507 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.0 mm-40 -138.8 166.97 23.03 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.534 0.683 . . . . 1.0 110.498 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 42.96 -176.99 0.01 OUTLIER Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.953 -1.476 . . . . 1.0 111.007 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.36 152.9 35.99 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.379 -0.6 . . . . 1.0 109.379 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 39.6 m95 -125.25 168.09 13.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.697 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.425 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 1.9 p -141.83 99.27 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.733 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.57 141.08 56.93 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 120.275 -0.57 . . . . 1.0 110.789 -178.155 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -118.51 131.63 56.23 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.843 -0.617 . . . . 1.0 109.703 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -46.93 -49.17 20.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.033 -0.53 . . . . 1.0 111.679 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.418 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.2 175.63 6.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.318 0.58 . . . . 1.0 110.383 -178.957 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.7 p -82.7 170.68 14.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.437 -0.801 . . . . 1.0 110.355 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 138' ' ' ASN . 41.1 t-20 66.22 17.34 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.261 -179.431 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 37.13 79.25 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.0 111.751 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 28.2 ttm180 -149.59 39.24 0.79 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.026 0.441 . . . . 1.0 110.508 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.93 -143.11 3.61 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.374 -0.691 . . . . 1.0 111.374 -178.269 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -74.41 168.45 19.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.985 0.421 . . . . 1.0 110.24 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.462 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 6.6 pt20 -150.57 141.35 22.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.77 -0.65 . . . . 1.0 111.449 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . 0.425 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.8 m-85 -131.02 139.33 49.95 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.494 -0.928 . . . . 1.0 108.494 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 49.4 tp -92.67 126.47 37.77 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.634 0.584 . . . . 1.0 111.617 -179.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.577 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.7 mm? -114.83 102.71 10.25 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.437 -0.802 . . . . 1.0 109.608 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 3.6 mtm -81.99 164.82 46.68 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.451 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.62 119.28 6.44 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 121.968 1.779 . . . . 1.0 111.312 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.65 -153.17 21.22 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.536 -1.026 . . . . 1.0 110.536 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -128.36 132.63 48.56 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.755 0.312 . . . . 1.0 110.387 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.466 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 33.5 m-85 -123.26 132.07 53.89 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.003 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -117.03 -6.72 11.39 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -153.05 163.96 38.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.34 0.591 . . . . 1.0 110.03 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.443 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.4 p90 -76.76 -20.55 56.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.061 -0.972 . . . . 1.0 112.239 -178.277 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -68.82 -19.64 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 1.0 111.065 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.76 -49.56 57.76 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.934 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.443 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 17.3 p90 -96.84 22.54 8.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.317 -0.402 . . . . 1.0 110.713 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 75.56 0.21 Allowed Glycine 0 CA--C 1.517 0.195 0 N-CA-C 111.223 -0.751 . . . . 1.0 111.223 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -118.37 147.05 43.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 110.26 179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.9 t -78.21 -10.09 59.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.097 178.231 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.544 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 8.1 t-20 -171.99 -169.15 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.583 -0.447 . . . . 1.0 110.259 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.544 ' H ' ' CG ' ' A' ' 161' ' ' ASN . . . -110.28 -18.86 13.18 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.375 -0.375 . . . . 1.0 110.659 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 162' ' ' ALA . 20.0 ptp180 -37.22 123.69 0.93 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.309 0.576 . . . . 1.0 111.695 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 22.0 t -127.32 159.84 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.02 179.137 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.435 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -135.27 -35.7 0.23 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.689 -0.687 . . . . 1.0 111.543 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.427 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.6 m -158.88 -168.36 2.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.702 0.287 . . . . 1.0 110.278 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 pp -173.36 134.24 0.52 Allowed 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.472 -179.479 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.69 HH12 ' NH1' ' A' ' 59' ' ' ARG . 1.8 ttm180 -129.32 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.409 0.623 . . . . 1.0 109.643 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 10.4 ptt180 -80.27 153.44 28.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.841 -1.072 . . . . 1.0 110.075 178.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 47.9 t -90.33 86.03 2.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.861 0.363 . . . . 1.0 111.851 -178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.0 mp -140.29 115.92 7.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.264 179.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -66.89 -39.12 87.36 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.712 -0.677 . . . . 1.0 110.488 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -55.77 -79.75 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.133 -0.485 . . . . 1.0 110.747 -179.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 174' ' ' SER . . . . . 0.403 ' OG ' ' O ' ' A' ' 174' ' ' SER . 30.5 t . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 118.026 -0.988 . . . . 1.0 110.713 179.739 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 109.225 -0.657 . . . . 1.0 109.225 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.61 176.3 44.53 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.39 -1.084 . . . . 1.0 110.39 179.908 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -171.7 105.06 0.2 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.021 -0.271 . . . . 1.0 110.398 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 167.8 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.111 0.481 . . . . 1.0 111.399 -178.966 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.5 m -124.87 121.4 34.4 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.029 -1.1 . . . . 1.0 108.029 177.179 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -106.39 133.82 50.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.015 -0.993 . . . . 1.0 110.364 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.6 m-85 -115.8 126.85 54.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.539 -0.755 . . . . 1.0 111.256 -178.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -53.88 -28.07 34.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 1.0 110.515 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -119.45 151.4 38.61 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.433 0.635 . . . . 1.0 110.621 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.8 ptt-85 -56.87 -175.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 1.0 110.847 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.3 25.54 0.78 Allowed Glycine 0 N--CA 1.462 0.397 0 N-CA-C 110.912 -0.875 . . . . 1.0 110.912 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 51.61 67.16 1.0 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.198 -0.297 . . . . 1.0 110.198 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -128.86 -157.91 0.85 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.085 0.469 . . . . 1.0 110.555 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.59 -151.31 0.31 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.822 -0.911 . . . . 1.0 110.822 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -70.14 148.36 48.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.871 -0.332 . . . . 1.0 110.87 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -136.0 149.48 48.86 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.37 0.605 . . . . 1.0 110.374 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.4 t80 -143.95 142.45 30.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.255 -0.884 . . . . 1.0 110.014 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 70.5 tt0 -110.83 121.43 45.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.264 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -108.71 126.79 53.38 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.739 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.505 ' C ' ' HG ' ' A' ' 21' ' ' SER . 50.0 m -117.61 12.08 13.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.751 -0.659 . . . . 1.0 110.56 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.505 ' HG ' ' C ' ' A' ' 20' ' ' SER . 40.5 m -157.48 168.46 27.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.177 0.513 . . . . 1.0 110.447 -179.365 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -58.51 140.7 53.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.054 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.71 148.99 49.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.966 -0.561 . . . . 1.0 110.338 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.6 p -118.79 -13.54 9.54 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.748 -0.66 . . . . 1.0 112.047 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -150.28 111.99 4.51 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.314 0.578 . . . . 1.0 109.773 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.3 mt -116.02 -0.55 12.73 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.402 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -53.16 -42.28 90.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.3 -179.775 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 34.3 Cg_exo -58.23 -34.91 99.04 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.03 1.82 . . . . 1.0 111.548 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -95.98 -52.82 3.89 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 121.037 -0.265 . . . . 1.0 111.072 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -118.57 127.41 53.59 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.976 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -95.06 -7.52 39.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.794 -0.639 . . . . 1.0 111.955 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -146.75 -60.46 0.29 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.418 0.525 . . . . 1.0 112.418 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 50.3 t 64.99 75.38 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 122.499 0.319 . . . . 1.0 110.158 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -92.01 4.33 53.29 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.305 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -156.9 157.58 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.969 0.414 . . . . 1.0 110.19 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.81 154.46 32.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.813 -0.631 . . . . 1.0 111.336 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -132.1 121.0 23.1 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.83 -0.804 . . . . 1.0 108.83 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -107.21 114.82 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.63 0.582 . . . . 1.0 110.424 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.37 -44.37 45.34 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.101 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.1 p -160.91 159.07 29.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 109.38 -0.6 . . . . 1.0 109.38 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.14 175.79 50.8 Favored Glycine 0 C--N 1.315 -0.586 0 N-CA-C 111.026 -0.83 . . . . 1.0 111.026 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 85.6 m -113.46 136.99 52.19 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.0 -0.741 . . . . 1.0 109.0 178.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.453 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 58.2 m95 -124.66 142.42 51.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.247 0.546 . . . . 1.0 111.415 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.459 ' SD ' ' C ' ' A' ' 56' ' ' TYR . 10.4 tpp -115.91 129.01 56.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.331 -0.85 . . . . 1.0 109.164 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -107.97 130.17 55.07 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 -179.465 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.498 ' HH ' HH11 ' A' ' 80' ' ' ARG . 51.7 m-85 -104.81 131.87 51.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.674 0.75 . . . . 1.0 111.17 179.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.547 ' O ' ' O ' ' A' ' 75' ' ' SER . 0.4 OUTLIER -60.33 -33.82 72.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 1.0 110.808 -178.159 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.87 ' NE2' ' H ' ' A' ' 52' ' ' SER . 3.1 pp0? -108.54 154.64 41.46 Favored Pre-proline 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 1.0 108.861 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.463 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 20.9 Cg_endo -56.38 148.76 60.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 121.372 1.381 . . . . 1.0 111.621 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.823 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.3 OUTLIER 74.83 -123.92 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.812 -0.81 . . . . 1.0 108.812 -178.685 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -150.83 74.65 1.17 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.198 0.523 . . . . 1.0 110.695 179.061 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.87 ' H ' ' NE2' ' A' ' 48' ' ' GLN . 1.4 t -142.72 20.59 2.0 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.764 -0.653 . . . . 1.0 111.893 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -139.2 -159.53 8.03 Favored Glycine 0 N--CA 1.46 0.282 0 N-CA-C 111.181 -0.768 . . . . 1.0 111.181 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.413 ' H ' ' HG2' ' A' ' 47' ' ' GLU . 46.5 tp -64.77 146.47 54.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.818 -0.353 . . . . 1.0 110.499 -178.795 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -122.73 150.5 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 1.0 110.971 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.459 ' C ' ' SD ' ' A' ' 44' ' ' MET . 63.7 m-85 -125.61 123.66 39.5 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.569 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.629 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 46.1 t80 -83.94 121.73 27.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.237 0.541 . . . . 1.0 110.201 -178.643 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.5 mp -117.22 143.46 45.85 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.586 -0.734 . . . . 1.0 109.972 179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.436 ' O ' ' C ' ' A' ' 60' ' ' ARG . 28.6 mtt85 -129.67 153.67 47.9 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.58 -0.736 . . . . 1.0 109.398 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 59' ' ' ARG . 17.0 ptm180 -32.69 127.58 0.27 Allowed 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.294 0.371 . . . . 1.0 111.431 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 151.4 -175.47 30.26 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.814 -0.914 . . . . 1.0 110.814 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.8 p-10 -116.2 134.2 55.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.085 0.469 . . . . 1.0 110.696 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -127.57 114.56 17.56 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.937 -0.574 . . . . 1.0 109.792 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.414 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.58 -3.78 52.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.152 -0.477 . . . . 1.0 111.605 -179.264 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -147.64 142.74 27.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.979 -0.749 . . . . 1.0 108.979 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.566 ' H ' ' HD1' ' A' ' 66' ' ' HIS . 11.6 p-80 -62.11 -46.06 90.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.119 0.485 . . . . 1.0 111.116 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -49.22 -8.97 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.945 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.537 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.4 mm-40 -82.84 -35.32 26.43 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.488 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -91.49 19.73 5.94 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 118.956 -0.545 . . . . 1.0 111.571 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.488 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 61.6 mtp 87.38 8.33 0.19 Allowed 'General case' 0 N--CA 1.461 0.111 0 O-C-N 124.22 0.95 . . . . 1.0 109.368 -178.215 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.47 97.54 0.1 OUTLIER Glycine 0 C--N 1.341 0.813 0 N-CA-C 110.238 -1.145 . . . . 1.0 110.238 178.405 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 2.2 pp -93.36 -26.87 17.08 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.274 -0.639 . . . . 1.0 109.274 179.271 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.3 t -133.65 120.89 21.23 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 178.013 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.484 ' O ' ' CB ' ' A' ' 75' ' ' SER . 47.3 p-10 -65.65 -162.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.454 -0.498 . . . . 1.0 110.029 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.547 ' O ' ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER 84.23 67.64 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 O-C-N 123.342 0.401 . . . . 1.0 111.919 178.948 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 t -99.46 114.03 36.33 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 N-CA-C 108.836 -0.802 . . . . 1.0 108.836 178.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -120.32 1.95 10.78 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.796 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 6.1 p -161.44 160.69 29.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.404 0.621 . . . . 1.0 110.808 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.0 p -154.32 146.33 23.6 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.177 -0.919 . . . . 1.0 110.034 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.498 HH11 ' HH ' ' A' ' 46' ' ' TYR . 0.7 OUTLIER -127.86 146.05 50.74 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.889 -0.411 . . . . 1.0 109.889 179.653 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 31.1 tp -96.96 134.79 39.86 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.815 -0.809 . . . . 1.0 108.815 177.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.3 mt -96.24 111.26 55.99 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.485 -0.561 . . . . 1.0 109.485 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -50.62 151.41 10.57 Favored 'Trans proline' 0 N--CA 1.501 1.948 0 C-N-CA 121.872 1.715 . . . . 1.0 113.285 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -70.34 -178.9 1.84 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.24 -0.891 . . . . 1.0 110.44 179.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.8 m -166.84 150.33 6.8 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.035 -0.529 . . . . 1.0 111.156 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -91.64 -73.32 1.25 Allowed Glycine 0 CA--C 1.523 0.546 0 N-CA-C 109.82 -1.312 . . . . 1.0 109.82 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.9 m -82.96 150.42 26.42 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.667 -0.494 . . . . 1.0 109.667 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.5 m80 -130.28 104.73 7.45 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 121.124 -0.23 . . . . 1.0 110.999 -179.756 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -137.06 141.15 42.41 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.804 -0.359 . . . . 1.0 110.951 179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.9 tt -150.63 144.25 17.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.157 -0.474 . . . . 1.0 111.272 -179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -120.11 97.85 5.79 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.948 -0.569 . . . . 1.0 111.626 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 28.6 mt -78.54 142.67 37.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.966 -0.561 . . . . 1.0 109.936 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.469 ' CG ' ' HB3' ' A' ' 98' ' ' TYR . 38.3 m-85 -121.18 138.93 53.98 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.339 0.59 . . . . 1.0 111.801 -178.275 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.524 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 8.9 tp10 -63.1 -37.72 88.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.649 -0.705 . . . . 1.0 110.829 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -128.2 169.27 14.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.364 0.602 . . . . 1.0 111.075 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.421 ' O ' ' N ' ' A' ' 98' ' ' TYR . 93.6 mt-10 -61.38 163.42 6.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.928 -1.033 . . . . 1.0 110.717 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.53 ' C ' ' CD1' ' A' ' 98' ' ' TYR . 9.9 m-20 41.53 25.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.989 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.547 ' O ' ' CD2' ' A' ' 98' ' ' TYR . 26.4 p90 33.54 76.97 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.539 -0.755 . . . . 1.0 110.958 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -116.67 -5.46 11.62 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.554 -0.748 . . . . 1.0 111.108 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -118.27 -144.42 7.57 Favored Glycine 0 N--CA 1.47 0.954 0 CA-C-N 115.422 -0.808 . . . . 1.0 111.189 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 67.9 tp60 -68.16 142.91 55.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 1.0 110.878 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.9 ptm -133.27 155.25 49.73 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.612 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.475 ' CG2' ' CD1' ' A' ' 116' ' ' PHE . 11.8 tt -147.97 142.0 19.25 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 N-CA-C 109.817 -0.438 . . . . 1.0 109.817 178.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -112.8 142.39 45.5 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.809 0.814 . . . . 1.0 110.811 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.12 157.05 40.73 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.441 -1.254 . . . . 1.0 110.506 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.6 p -142.27 19.11 2.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.3 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -164.13 -167.18 1.27 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.938 0.399 . . . . 1.0 110.87 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 51.2 p30 -78.9 148.4 32.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.262 0.553 . . . . 1.0 111.021 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.434 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.8 t -135.65 93.98 3.02 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.592 -0.731 . . . . 1.0 109.759 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -65.31 -27.68 68.78 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.618 -0.433 . . . . 1.0 111.274 -179.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' A' ' 111' ' ' CYS . 28.2 p -139.28 95.67 2.97 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.415 0.626 . . . . 1.0 110.849 -179.042 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 114' ' ' ASP . 19.3 tp -62.47 -41.22 98.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.285 -0.87 . . . . 1.0 110.121 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.54 HE21 HD21 ' A' ' 119' ' ' ASN . 27.8 mp0 -45.23 -11.96 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.327 -0.397 . . . . 1.0 111.435 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.525 ' N ' ' O ' ' A' ' 112' ' ' LEU . 21.8 m-20 -95.07 -25.11 16.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.095 0.474 . . . . 1.0 110.73 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.511 ' HE ' ' C ' ' A' ' 114' ' ' ASP . 6.4 mmp_? -107.87 -41.73 4.9 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.785 -0.643 . . . . 1.0 111.937 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.475 ' CD1' ' CG2' ' A' ' 103' ' ' ILE . 2.3 t80 -123.54 122.24 37.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.217 0.532 . . . . 1.0 109.68 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.2 mtt-85 -61.64 -46.16 90.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.514 -0.766 . . . . 1.0 111.059 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.524 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 97.3 m-85 -58.05 139.67 54.12 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.691 -0.686 . . . . 1.0 109.616 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . 0.54 HD21 HE21 ' A' ' 113' ' ' GLN . 19.3 t-20 -100.89 4.14 42.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.886 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -135.11 141.41 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.193 0.52 . . . . 1.0 110.913 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.5 mm -122.94 117.25 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.658 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 123' ' ' SER . 27.2 m-70 -105.9 27.56 8.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.188 -0.46 . . . . 1.0 112.03 -178.354 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 151' ' ' TYR . 10.3 t 163.39 152.65 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 123.495 0.497 . . . . 1.0 109.818 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -163.58 158.09 20.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.476 -178.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.74 116.98 24.67 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 109.411 -0.588 . . . . 1.0 109.411 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 39.1 t -101.63 105.58 18.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 116.143 -0.481 . . . . 1.0 109.791 179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.518 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.78 -45.1 21.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.725 179.633 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -156.99 149.94 23.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.745 -0.382 . . . . 1.0 111.043 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 70.07 79.57 0.32 Allowed Glycine 0 C--N 1.329 0.163 0 CA-C-N 116.198 -0.456 . . . . 1.0 112.384 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.431 ' C ' ' O ' ' A' ' 129' ' ' GLY . 45.7 p -32.17 149.44 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 121.219 0.533 . . . . 1.0 111.202 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.512 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 44.1 m95 -123.38 164.99 17.77 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.466 -0.788 . . . . 1.0 111.521 -178.066 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 29.0 t -131.88 133.99 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 178.791 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.47 142.22 39.17 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -120.54 136.82 54.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.084 0.24 . . . . 1.0 110.917 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -48.94 -44.93 41.09 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.474 -0.49 . . . . 1.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.406 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.7 178.01 5.67 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.321 0.582 . . . . 1.0 110.684 -178.905 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.2 m -82.52 171.71 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.523 -0.762 . . . . 1.0 111.022 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 62.78 20.43 12.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 1.0 110.18 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.442 ' CE2' ' OG ' ' A' ' 166' ' ' SER . 1.0 OUTLIER 35.59 78.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.067 -0.515 . . . . 1.0 111.644 179.056 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -148.3 38.58 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.02 0.438 . . . . 1.0 110.408 179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.6 -137.67 2.52 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.13 -0.788 . . . . 1.0 111.13 -178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? -72.42 164.38 26.46 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.658 0.266 . . . . 1.0 110.439 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.629 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 5.7 pt20 -149.31 139.2 21.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.886 -0.597 . . . . 1.0 110.839 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -131.09 135.94 47.95 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.698 -0.852 . . . . 1.0 108.698 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.13 129.45 37.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.382 0.61 . . . . 1.0 109.649 -179.642 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.611 HD23 ' N ' ' A' ' 146' ' ' LEU . 1.6 mm? -114.43 102.92 10.54 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.212 -1.033 . . . . 1.0 108.212 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 1.8 mpp? -80.53 165.95 42.76 Favored Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 109.72 -0.474 . . . . 1.0 109.72 -179.096 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -60.53 122.99 12.15 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.624 1.55 . . . . 1.0 111.406 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.31 -154.14 23.78 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 -179.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -126.46 133.4 51.22 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.893 0.378 . . . . 1.0 110.327 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.1 m-85 -122.94 128.25 50.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.549 -0.537 . . . . 1.0 109.549 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -114.08 -5.13 13.09 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 110.341 -0.244 . . . . 1.0 110.341 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -154.96 163.22 40.62 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.494 0.664 . . . . 1.0 110.513 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.551 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -75.02 -22.01 58.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.175 -0.92 . . . . 1.0 111.807 -178.582 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.23 -22.39 66.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.134 -0.485 . . . . 1.0 111.361 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . 0.498 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.2 t0 -47.59 -50.03 25.16 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.333 -178.651 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.463 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.3 p90 -99.59 19.32 16.0 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.029 0.442 . . . . 1.0 110.131 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.93 72.72 0.47 Allowed Glycine 0 CA--C 1.522 0.481 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.43 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.463 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.25 -171.66 2.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.689 0.757 . . . . 1.0 110.84 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.13 -35.69 3.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.696 -1.138 . . . . 1.0 112.089 -178.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.533 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 0.2 OUTLIER -146.58 -25.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.006 -0.278 . . . . 1.0 111.64 -178.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.533 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 97.96 -19.87 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 124.301 1.001 . . . . 1.0 110.255 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -42.15 116.29 0.8 Allowed 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 115.145 -0.934 . . . . 1.0 111.345 -178.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 60.8 t -123.3 124.41 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.393 178.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.409 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -103.42 -24.76 7.7 Favored Glycine 0 N--CA 1.462 0.407 0 N-CA-C 111.055 -0.818 . . . . 1.0 111.055 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.442 ' OG ' ' CE2' ' A' ' 139' ' ' TYR . 5.7 t -160.14 171.34 19.43 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.644 -0.422 . . . . 1.0 110.311 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 166' ' ' SER . 0.9 OUTLIER -157.92 144.29 17.58 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.524 . . . . 1.0 111.699 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -133.42 162.35 32.1 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.604 -0.517 . . . . 1.0 109.604 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.406 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.42 153.9 17.57 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.446 -0.797 . . . . 1.0 109.261 178.922 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.407 ' CG2' ' OG ' ' A' ' 130' ' ' SER . 48.1 t -89.7 82.05 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.969 -0.457 . . . . 1.0 111.788 -178.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.2 mp -134.37 128.38 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.166 179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 23.6 p-10 -97.79 -11.19 23.61 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.705 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 49.5 p90 -102.64 -171.81 2.02 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.155 -0.475 . . . . 1.0 110.758 -179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.003 -0.998 . . . . 1.0 110.625 -179.896 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.327 -0.62 . . . . 1.0 109.327 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.28 174.02 42.46 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.609 -0.997 . . . . 1.0 110.609 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -171.76 105.81 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.856 -0.338 . . . . 1.0 110.589 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.18 168.8 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-O 120.908 0.385 . . . . 1.0 110.942 -178.841 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 28.3 m -126.28 120.73 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.263 -1.014 . . . . 1.0 108.263 176.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -105.4 132.91 50.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.1 -0.954 . . . . 1.0 110.242 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.6 m-85 -115.58 126.55 54.35 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.224 -0.898 . . . . 1.0 111.201 -178.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.13 -31.66 31.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.487 -0.779 . . . . 1.0 110.464 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -116.75 160.26 21.05 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.285 0.564 . . . . 1.0 110.486 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' C ' ' N ' ' A' ' 12' ' ' PHE . 11.2 ptm180 -63.87 -173.16 0.07 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.338 -0.846 . . . . 1.0 110.702 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.43 24.66 0.4 Allowed Glycine 0 N--CA 1.459 0.224 0 N-CA-C 110.732 -0.947 . . . . 1.0 110.732 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 8.3 m-85 50.43 70.09 0.55 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.527 -0.336 . . . . 1.0 110.275 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -131.83 -155.37 0.68 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.045 0.45 . . . . 1.0 110.309 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.64 -150.06 0.16 Allowed Glycine 0 CA--C 1.526 0.764 0 N-CA-C 111.036 -0.826 . . . . 1.0 111.036 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -69.36 145.92 52.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.774 0.321 . . . . 1.0 110.682 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -135.86 149.86 49.18 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.179 0.514 . . . . 1.0 110.296 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.602 ' HH ' ' CE1' ' A' ' 23' ' ' HIS . 6.1 t80 -144.32 141.57 29.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.36 -0.837 . . . . 1.0 110.204 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 33.0 tt0 -110.53 122.63 48.21 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.304 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -109.89 126.23 53.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.638 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.9 p -117.99 9.55 12.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.934 -0.576 . . . . 1.0 110.475 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.5 p -154.91 167.1 31.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.713 -178.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -58.08 137.45 56.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.557 -0.747 . . . . 1.0 111.512 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.602 ' CE1' ' HH ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -133.37 141.47 47.91 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.685 -0.689 . . . . 1.0 110.156 179.821 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.9 p -108.92 -14.49 14.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.679 -0.691 . . . . 1.0 111.841 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -152.6 118.16 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.103 0.478 . . . . 1.0 110.602 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 11.0 mt -117.46 0.84 12.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.582 -0.736 . . . . 1.0 110.266 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.575 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 55.5 mt-30 -48.8 -51.4 54.44 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.124 -0.489 . . . . 1.0 110.759 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.575 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.8 Cg_endo -55.93 -32.94 87.46 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 121.544 1.496 . . . . 1.0 112.33 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -94.27 -52.02 4.54 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.296 -0.562 . . . . 1.0 110.644 -178.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -117.28 127.73 54.37 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.0 110.551 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.1 t -95.51 -10.23 30.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.527 -0.761 . . . . 1.0 111.631 -179.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -147.12 -55.32 0.24 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.392 -0.367 . . . . 1.0 111.824 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 t 59.96 75.48 0.4 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -92.88 4.12 54.46 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.339 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.543 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -154.69 155.44 34.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.906 0.384 . . . . 1.0 110.036 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.2 154.53 35.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.153 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -134.46 122.41 22.45 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 108.554 -0.906 . . . . 1.0 108.554 178.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.9 t -107.61 117.39 53.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.276 0.56 . . . . 1.0 109.869 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -79.81 -43.33 22.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.395 -0.821 . . . . 1.0 110.76 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 t -161.64 155.91 22.43 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.48 173.87 50.0 Favored Glycine 0 C--N 1.317 -0.523 0 N-CA-C 110.97 -0.852 . . . . 1.0 110.97 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.2 m -110.28 140.77 44.1 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.456 -0.572 . . . . 1.0 109.456 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.418 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 56.1 m95 -128.3 155.76 44.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.322 0.582 . . . . 1.0 111.063 -179.168 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.511 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 15.7 ttm -131.17 131.28 43.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.827 -0.805 . . . . 1.0 108.827 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -108.62 131.1 55.22 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 108.948 -0.76 . . . . 1.0 108.948 -179.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -107.37 131.54 54.14 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.725 0.774 . . . . 1.0 110.667 -179.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.601 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.1 pt-20 -58.35 -36.35 73.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.917 -1.038 . . . . 1.0 110.974 -178.243 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.436 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.6 mt-30 -109.88 152.81 43.19 Favored Pre-proline 0 C--O 1.232 0.153 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.47 -178.759 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 157.28 54.02 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.378 2.052 . . . . 1.0 112.591 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.669 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 64.86 36.57 7.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.871 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.7 m-85 50.83 75.1 0.2 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.051 -0.977 . . . . 1.0 111.038 -179.492 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.4 m -142.61 154.27 44.25 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.884 0.373 . . . . 1.0 110.139 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.2 -148.13 22.06 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.854 -0.688 . . . . 1.0 111.728 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.601 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.8 tp -77.9 146.81 35.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.466 -0.367 . . . . 1.0 110.597 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.511 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 18.0 pt20 -122.86 153.72 39.24 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.065 -0.346 . . . . 1.0 110.065 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.457 ' CE1' ' O ' ' A' ' 70' ' ' MET . 20.6 m-85 -129.38 129.67 45.05 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.923 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -82.53 121.22 26.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.389 0.614 . . . . 1.0 109.814 -179.44 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -109.94 136.75 48.73 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.56 -179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 60' ' ' ARG . 23.0 mtm-85 -129.05 154.89 46.22 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.485 -0.779 . . . . 1.0 109.934 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 78.8 ttt-85 -38.29 125.9 1.33 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.668 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.0 -177.84 32.85 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.625 -0.99 . . . . 1.0 110.625 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.1 p-10 -116.16 125.38 52.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.151 0.501 . . . . 1.0 110.517 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -119.23 112.49 19.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 1.0 109.35 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.428 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.46 -2.43 56.27 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.923 -0.58 . . . . 1.0 111.762 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -149.48 131.86 15.63 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.201 -0.666 . . . . 1.0 109.201 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.66 ' CE1' HE21 ' A' ' 67' ' ' GLN . 5.4 p80 -53.67 -37.68 63.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.974 0.416 . . . . 1.0 110.963 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.66 HE21 ' CE1' ' A' ' 66' ' ' HIS . 98.1 mm-40 -56.4 -7.89 0.45 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.948 -0.569 . . . . 1.0 110.537 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.448 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.6 mm-40 -82.31 -32.91 29.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 120.546 -0.461 . . . . 1.0 111.107 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.2 p90 -96.21 13.47 27.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.868 -0.333 . . . . 1.0 110.586 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.483 ' C ' ' H ' ' A' ' 72' ' ' LEU . 58.3 mtt 74.77 31.61 0.91 Allowed 'General case' 0 C--O 1.225 -0.211 0 O-C-N 124.481 1.113 . . . . 1.0 110.306 -179.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.552 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -72.26 43.13 0.84 Allowed Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.448 -0.882 . . . . 1.0 111.877 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.489 ' C ' ' O ' ' A' ' 71' ' ' GLY . 55.0 mt -20.27 -47.06 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 O-C-N 124.167 0.569 . . . . 1.0 110.704 -178.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 71' ' ' GLY . 5.0 t -106.54 112.05 24.87 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.595 -0.729 . . . . 1.0 109.619 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 49.8 p-10 -72.57 38.56 0.08 Allowed 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.676 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.526 ' H ' ' C ' ' A' ' 73' ' ' SER . 5.2 m -113.3 74.75 0.88 Allowed 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.189 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.7 t -100.37 121.24 50.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 109.585 -0.524 . . . . 1.0 109.585 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -128.38 4.58 5.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.241 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.4 p -163.38 162.66 25.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.051 0.453 . . . . 1.0 110.851 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 19.2 p -153.66 144.85 22.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.752 -0.658 . . . . 1.0 109.744 -178.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -127.37 150.08 49.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 17.2 tp -95.37 125.84 40.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.461 -1.311 . . . . 1.0 107.461 177.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 22.9 mt -78.43 114.75 45.64 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 120.539 -0.464 . . . . 1.0 110.812 -178.294 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.477 ' C ' ' CG ' ' A' ' 84' ' ' HIS . 47.9 Cg_endo -81.63 175.68 9.24 Favored 'Trans proline' 0 N--CA 1.49 1.274 0 C-N-CA 122.017 1.811 . . . . 1.0 111.755 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.578 ' CD2' ' CD ' ' A' ' 148' ' ' PRO . 22.9 m-70 84.75 127.55 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 O-C-N 123.993 0.808 . . . . 1.0 112.759 177.041 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.6 p -158.24 16.74 0.22 Allowed 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.622 -0.431 . . . . 1.0 111.154 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.529 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . -86.07 -124.38 1.56 Allowed Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.897 -0.881 . . . . 1.0 110.897 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 m -72.84 155.28 40.07 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.967 -0.383 . . . . 1.0 109.967 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.529 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 1.1 m170 -124.31 99.51 6.25 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.898 -0.321 . . . . 1.0 111.736 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -135.4 137.67 42.52 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 120.558 -0.457 . . . . 1.0 110.359 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 16.8 tt -149.18 145.48 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.604 -0.271 . . . . 1.0 111.026 -179.437 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.571 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.4 mtp180 -124.39 98.83 5.92 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.051 -0.522 . . . . 1.0 111.633 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 20.5 mt -79.01 137.79 37.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.873 -0.603 . . . . 1.0 110.878 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 44.6 m-85 -116.5 135.29 53.95 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.638 -0.71 . . . . 1.0 110.711 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.527 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 1.0 OUTLIER -53.97 -67.01 0.3 Allowed 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.516 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 123' ' ' SER . 77.0 mtp85 -96.03 169.45 9.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.465 -179.222 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -46.31 156.82 0.15 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.495 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 54.57 -94.75 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.849 -0.614 . . . . 1.0 109.44 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.432 ' CB ' ' CE1' ' A' ' 93' ' ' TYR . 3.6 p90 -171.99 36.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.3 -0.56 . . . . 1.0 110.303 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -87.39 16.42 5.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.096 -0.502 . . . . 1.0 110.908 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -139.7 -175.53 14.31 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 111.013 -0.835 . . . . 1.0 111.013 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.55 147.95 13.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.356 . . . . 1.0 110.348 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.589 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 8.1 ttp -130.88 151.17 51.6 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.352 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.447 ' N ' ' HG2' ' A' ' 102' ' ' MET . 10.7 tt -146.42 141.06 20.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 177.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.41 143.96 42.66 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.677 0.751 . . . . 1.0 110.506 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -130.52 156.49 44.72 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 114.742 -1.117 . . . . 1.0 110.678 -179.482 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.2 p -143.93 32.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.731 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -171.14 -166.71 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.557 178.001 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 51.8 t0 -81.78 148.11 29.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.503 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.494 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.7 t -136.96 98.61 3.8 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.165 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.77 -23.84 64.36 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.878 0.371 . . . . 1.0 111.554 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.441 ' SG ' ' OD2' ' A' ' 114' ' ' ASP . 6.2 p -144.48 88.86 1.95 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.388 -179.271 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.591 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.9 tp -60.65 -40.91 93.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.368 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.547 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 17.4 mp0 -43.85 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.999 -0.546 . . . . 1.0 112.072 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.591 ' H ' ' C ' ' A' ' 112' ' ' LEU . 95.9 m-20 -94.78 -22.08 18.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.191 0.519 . . . . 1.0 110.42 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.5 mmt180 -107.93 -36.28 6.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.346 -0.843 . . . . 1.0 112.448 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.677 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.55 136.52 54.95 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 122.47 1.129 . . . . 1.0 110.812 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 15.0 mmp_? -73.43 -71.16 0.33 Allowed 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.609 -1.307 . . . . 1.0 110.669 -178.292 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.633 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.9 m-85 -34.2 147.88 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.295 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -106.98 8.19 30.31 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.758 0.313 . . . . 1.0 110.949 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -138.0 139.1 39.48 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.307 0.575 . . . . 1.0 111.118 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.402 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 40.7 mm -120.96 119.64 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 115.438 -0.801 . . . . 1.0 109.029 177.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -110.02 20.86 17.49 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.433 -178.505 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.2 p 170.94 150.76 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.089 0.471 . . . . 1.0 109.859 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -162.11 157.26 23.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.659 -0.7 . . . . 1.0 110.313 -178.407 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.57 112.95 18.62 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.349 -0.612 . . . . 1.0 109.349 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 21.4 t -100.34 105.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.048 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.524 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.6 OUTLIER -78.36 -43.04 28.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.981 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.403 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 26.0 tp10 -160.54 158.82 29.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.913 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.521 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 68.23 76.25 0.44 Allowed Glycine 0 CA--C 1.509 -0.324 0 CA-C-N 115.796 -0.638 . . . . 1.0 112.359 178.188 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.447 ' C ' ' O ' ' A' ' 129' ' ' GLY . 30.8 t -31.71 149.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.074 0.464 . . . . 1.0 111.021 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.521 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 33.0 m95 -124.42 169.14 12.14 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.72 -0.673 . . . . 1.0 110.835 -178.367 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 25.1 t -138.2 103.52 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.364 -0.38 . . . . 1.0 109.995 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.7 mt -77.38 141.77 39.65 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.787 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -120.54 133.82 55.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.618 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.55 ' CD ' HH21 ' A' ' 142' ' ' ARG . 48.0 tp10 -44.91 -49.95 10.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.453 -0.34 . . . . 1.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.77 171.06 10.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.411 0.624 . . . . 1.0 110.186 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.6 m -75.76 179.47 5.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.086 -0.961 . . . . 1.0 111.12 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 139' ' ' TYR . 10.3 m120 58.16 21.99 8.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.42 -1.264 . . . . 1.0 109.555 -179.088 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.445 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.4 m-85 33.82 77.67 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.21 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -148.75 44.1 1.0 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.245 0.545 . . . . 1.0 109.859 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.44 -135.15 2.1 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 111.423 -0.671 . . . . 1.0 111.423 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.606 HH12 ' CG2' ' A' ' 160' ' ' THR . 84.0 mtm180 -84.19 166.59 17.44 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.936 -0.394 . . . . 1.0 109.936 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.75 137.4 26.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.912 -0.586 . . . . 1.0 110.841 -179.385 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -128.69 145.01 51.28 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.109 -0.7 . . . . 1.0 109.109 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.449 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 39.5 tp -94.28 122.56 36.95 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.479 0.487 . . . . 1.0 111.937 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . 0.594 ' N ' ' CD2' ' A' ' 146' ' ' LEU . 1.1 mm? -112.87 100.29 8.54 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.52 -0.764 . . . . 1.0 109.483 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 163.42 62.44 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 114.914 -1.039 . . . . 1.0 109.904 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . 0.578 ' CD ' ' CD2' ' A' ' 84' ' ' HIS . 27.6 Cg_endo -63.67 107.23 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.301 2.001 . . . . 1.0 111.532 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -175.73 -153.04 9.95 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.598 -1.001 . . . . 1.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.453 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.0 p-10 -124.8 125.82 44.63 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.054 0.454 . . . . 1.0 110.61 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.4 m-85 -117.84 129.59 55.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.953 -0.567 . . . . 1.0 109.83 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -115.66 -4.24 12.22 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.809 0.338 . . . . 1.0 110.134 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -155.54 161.62 40.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.618 0.723 . . . . 1.0 110.148 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.423 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.8 p90 -75.02 -19.2 60.17 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.654 -1.157 . . . . 1.0 112.227 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -70.05 -19.36 63.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.279 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -50.62 -49.14 57.44 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.048 -179.044 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.423 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 19.4 p90 -96.81 22.45 8.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.483 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.77 75.92 0.2 Allowed Glycine 0 CA--C 1.521 0.457 0 N-CA-C 111.326 -0.71 . . . . 1.0 111.326 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -122.0 145.52 48.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.06 0.457 . . . . 1.0 110.327 179.508 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 160' ' ' THR . . . . . 0.606 ' CG2' HH12 ' A' ' 142' ' ' ARG . 14.7 t -74.15 -15.06 61.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.144 -0.934 . . . . 1.0 110.028 177.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.553 ' N ' HD21 ' A' ' 161' ' ' ASN . 0.0 OUTLIER -166.44 -167.4 1.01 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.132 0.492 . . . . 1.0 110.308 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.402 ' CB ' ' O ' ' A' ' 121' ' ' ILE . . . -109.37 -15.9 14.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.869 -0.605 . . . . 1.0 110.264 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -37.74 121.97 0.94 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.023 0.439 . . . . 1.0 111.889 -178.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 24.7 t -125.39 158.68 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.438 178.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -136.23 -36.77 0.19 Allowed Glycine 0 C--N 1.334 0.431 0 N-CA-C 111.461 -0.656 . . . . 1.0 111.461 -179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.4 m -156.77 -170.47 3.32 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.046 -0.353 . . . . 1.0 110.046 -179.261 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.9 pp -174.74 138.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.492 -179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -132.33 162.67 30.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.76 146.24 23.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.076 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 42.2 t -79.22 84.62 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.186 -0.461 . . . . 1.0 111.506 -178.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.9 mp -135.68 125.34 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 121.076 0.465 . . . . 1.0 109.972 178.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.43 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 36.7 p-10 -71.04 -35.08 71.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.649 -0.705 . . . . 1.0 110.492 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.43 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 90.2 m-85 -58.06 -79.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.698 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 118.006 -0.997 . . . . 1.0 110.452 179.84 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 109.16 -0.681 . . . . 1.0 109.16 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.9 -178.28 42.08 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.371 -1.092 . . . . 1.0 110.371 -179.71 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -175.86 109.03 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.636 -0.426 . . . . 1.0 110.366 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.06 169.21 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.952 0.406 . . . . 1.0 110.833 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 29.9 m -127.89 119.72 26.18 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.203 -1.036 . . . . 1.0 108.203 177.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.8 mt -105.55 133.14 50.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.68 -1.145 . . . . 1.0 109.819 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 70.8 m-85 -115.1 130.09 56.84 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.623 -0.717 . . . . 1.0 111.644 -178.328 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.478 ' O ' ' O ' ' A' ' 32' ' ' ARG . 80.8 tt0 -54.9 -24.44 23.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.402 -0.817 . . . . 1.0 110.459 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -125.39 161.06 27.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.284 0.564 . . . . 1.0 110.004 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 8.3 ptp180 -65.28 -175.33 0.22 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.311 -0.859 . . . . 1.0 110.929 -177.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.36 29.31 1.69 Allowed Glycine 0 C--N 1.335 0.482 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 48.36 68.03 0.75 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.489 -0.355 . . . . 1.0 110.288 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -129.78 -158.5 0.89 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.966 0.412 . . . . 1.0 110.454 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.48 -148.66 0.77 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.861 -0.895 . . . . 1.0 110.861 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.11 148.51 45.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.767 0.318 . . . . 1.0 110.463 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.7 146.84 48.16 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.381 0.61 . . . . 1.0 110.256 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.672 ' HH ' ' CE1' ' A' ' 23' ' ' HIS . 5.8 t80 -142.26 142.41 32.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.107 -0.951 . . . . 1.0 109.76 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.521 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 75.1 tt0 -111.7 123.48 50.33 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.229 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.6 126.54 54.57 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.306 -0.406 . . . . 1.0 110.67 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.3 p -118.17 11.06 13.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.861 -0.609 . . . . 1.0 110.425 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.6 p -156.45 169.36 24.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.579 -178.713 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -58.94 136.09 57.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.786 -0.643 . . . . 1.0 111.104 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.672 ' CE1' ' HH ' ' A' ' 17' ' ' TYR . 0.1 OUTLIER -132.39 146.53 52.03 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.676 -0.693 . . . . 1.0 110.423 179.832 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -117.52 -19.98 9.22 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.478 -0.783 . . . . 1.0 112.774 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -141.29 106.28 4.96 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.461 0.648 . . . . 1.0 109.652 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 mt -109.62 -3.38 16.9 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.171 -0.922 . . . . 1.0 110.058 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.544 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 1.4 mt-30 -52.23 -51.11 75.09 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.921 -0.581 . . . . 1.0 110.735 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.544 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.0 Cg_endo -56.04 -35.08 94.21 Favored 'Trans proline' 0 N--CA 1.487 1.127 0 C-N-CA 121.22 1.28 . . . . 1.0 112.759 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -90.79 -40.97 11.49 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.314 -0.555 . . . . 1.0 111.027 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.4 mt -126.14 127.76 46.25 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.423 -0.808 . . . . 1.0 111.284 -178.726 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 t -90.36 -14.15 33.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.191 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' GLU . 44.3 ttm180 -175.64 120.62 0.18 Allowed 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 108.89 -0.781 . . . . 1.0 108.89 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.5 t -100.22 106.36 18.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 1.0 110.258 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.432 ' OD1' ' OD2' ' A' ' 74' ' ' ASP . 98.9 m-20 -101.59 -5.17 25.45 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.521 179.504 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.449 ' OG ' ' C ' ' A' ' 64' ' ' ALA . 71.9 m -155.74 156.99 35.83 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.977 0.417 . . . . 1.0 110.54 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.56 155.48 37.48 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.949 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -133.99 123.81 25.22 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.71 -0.848 . . . . 1.0 108.71 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.8 t -109.0 134.71 50.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.098 -0.704 . . . . 1.0 109.098 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -97.42 -42.83 7.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.505 -0.771 . . . . 1.0 110.51 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 m -161.45 160.46 29.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.426 -0.583 . . . . 1.0 109.426 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.51 176.26 48.73 Favored Glycine 0 C--N 1.316 -0.538 0 N-CA-C 111.085 -0.806 . . . . 1.0 111.085 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.8 m -112.4 140.96 46.69 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.884 -0.784 . . . . 1.0 108.884 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.451 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 48.2 m95 -127.42 150.44 49.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.63 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -124.37 130.05 51.8 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.179 -0.674 . . . . 1.0 109.179 178.594 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -109.78 131.71 54.81 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.673 -0.862 . . . . 1.0 108.673 179.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -106.19 131.45 53.43 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.374 0.607 . . . . 1.0 111.279 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.634 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -56.04 -34.8 66.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.398 -0.819 . . . . 1.0 110.367 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -104.82 153.64 39.17 Favored Pre-proline 0 C--N 1.327 -0.41 0 O-C-N 121.945 -0.472 . . . . 1.0 109.918 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -55.68 150.84 42.23 Favored 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 121.363 1.375 . . . . 1.0 110.873 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.804 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.4 OUTLIER 79.68 -122.95 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.735 0.814 . . . . 1.0 109.115 -178.82 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.525 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 15.3 m-85 -138.73 78.42 1.68 Allowed 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.017 -0.538 . . . . 1.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.0 m -152.3 163.53 39.26 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.738 -0.467 . . . . 1.0 109.738 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.04 -153.16 33.81 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 115.627 -0.715 . . . . 1.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.634 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.3 tp -77.73 144.47 37.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.343 -0.429 . . . . 1.0 109.987 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -121.41 154.17 36.87 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.691 0.282 . . . . 1.0 110.261 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.468 ' CE1' ' O ' ' A' ' 70' ' ' MET . 36.2 m-85 -127.04 129.56 48.27 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.113 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -81.64 119.42 23.79 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.689 -0.687 . . . . 1.0 109.704 -179.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -111.36 134.42 52.96 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.9 -179.648 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.4 ' O ' ' C ' ' A' ' 60' ' ' ARG . 18.3 mtm-85 -129.52 154.84 46.63 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.301 -0.863 . . . . 1.0 109.931 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' CZ ' ' O ' ' A' ' 172' ' ' ASP . 34.5 ptt180 -36.6 128.54 0.81 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.186 0.517 . . . . 1.0 111.696 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.18 179.92 29.88 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 111.117 -0.793 . . . . 1.0 111.117 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -115.79 124.1 49.9 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -118.92 113.5 21.12 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.131 -0.692 . . . . 1.0 109.131 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.449 ' C ' ' OG ' ' A' ' 35' ' ' SER . . . -93.99 3.42 55.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.015 0.436 . . . . 1.0 111.756 -179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 67.3 m-20 -152.14 140.68 20.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.77 -0.826 . . . . 1.0 108.77 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.582 ' H ' ' CD2' ' A' ' 66' ' ' HIS . 5.6 p80 -64.36 -40.66 96.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.974 0.416 . . . . 1.0 110.846 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.67 -8.17 0.14 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.899 -0.591 . . . . 1.0 110.248 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.5 mm-40 -80.93 -32.95 34.43 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 120.43 -0.508 . . . . 1.0 111.306 -178.284 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.41 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -96.1 13.33 27.56 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 121.05 -0.26 . . . . 1.0 110.69 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.47 ' C ' ' H ' ' A' ' 72' ' ' LEU . 54.9 mtt 76.26 30.01 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 124.278 0.986 . . . . 1.0 109.807 -179.036 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.565 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.24 40.51 0.88 Allowed Glycine 0 C--N 1.34 0.762 0 C-N-CA 119.852 -1.166 . . . . 1.0 112.181 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.48 ' CD1' HH12 ' A' ' 142' ' ' ARG . 19.7 mt -18.73 -47.03 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.388 0.675 . . . . 1.0 111.002 -178.693 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.565 ' N ' ' O ' ' A' ' 71' ' ' GLY . 62.5 m -107.35 114.82 29.09 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.724 -0.671 . . . . 1.0 109.393 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 74' ' ' ASP . 67.1 t0 -75.14 38.32 0.13 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.288 -0.414 . . . . 1.0 110.274 -179.205 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.569 ' O ' ' O ' ' A' ' 47' ' ' GLU . 4.2 p -115.22 73.76 0.85 Allowed 'General case' 0 C--O 1.212 -0.88 0 CA-C-N 116.172 -0.467 . . . . 1.0 109.942 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.48 131.5 66.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 123.631 0.582 . . . . 1.0 110.106 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -137.39 14.25 3.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.743 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.3 p -162.04 161.13 28.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.218 0.532 . . . . 1.0 110.795 178.461 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.2 p -155.67 146.94 22.63 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.471 -0.786 . . . . 1.0 110.662 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.603 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.7 ptm180 -126.82 150.55 49.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.467 -0.568 . . . . 1.0 109.467 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.451 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt -102.41 124.92 48.85 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.911 -1.144 . . . . 1.0 107.911 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 3.2 mt -84.2 116.58 65.62 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.146 -178.656 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -52.85 148.53 28.69 Favored 'Trans proline' 0 N--CA 1.501 1.96 0 C-N-CA 121.906 1.737 . . . . 1.0 113.229 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.664 ' CG ' ' H ' ' A' ' 85' ' ' SER . 81.9 t60 -70.44 176.95 3.66 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.426 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.664 ' H ' ' CG ' ' A' ' 84' ' ' HIS . 2.2 t -164.75 144.7 7.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.991 -179.747 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.15 -64.19 1.03 Allowed Glycine 0 N--CA 1.465 0.577 0 N-CA-C 109.994 -1.242 . . . . 1.0 109.994 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m -83.47 148.06 27.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.011 -0.366 . . . . 1.0 110.011 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 9.0 m80 -135.04 110.78 9.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 1.0 111.162 -179.207 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.8 mtp180 -143.54 135.61 26.75 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.746 -0.381 . . . . 1.0 110.068 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 17.6 tt -146.59 146.59 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.622 -0.263 . . . . 1.0 110.614 -179.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -125.88 104.89 8.56 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.488 0.492 . . . . 1.0 111.424 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.4 mp -85.42 139.07 31.82 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.416 0.627 . . . . 1.0 111.87 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -116.44 136.25 53.15 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.798 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.51 ' OE1' ' CB ' ' A' ' 118' ' ' PHE . 78.2 mm-40 -55.72 -64.4 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.455 -0.793 . . . . 1.0 112.702 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -93.93 167.75 11.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.224 -177.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.655 ' O ' ' O ' ' A' ' 97' ' ' ASP . 96.6 mt-10 -53.68 159.62 1.54 Allowed 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.316 -0.857 . . . . 1.0 110.264 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.813 ' O ' ' N ' ' A' ' 99' ' ' ARG . 55.1 m-20 51.33 126.51 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 108.213 -1.032 . . . . 1.0 108.213 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.4 OUTLIER -35.93 68.91 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.143 -0.481 . . . . 1.0 112.011 -177.714 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . 0.813 ' N ' ' O ' ' A' ' 97' ' ' ASP . 74.3 mtt85 -134.82 165.83 24.37 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.117 -0.364 . . . . 1.0 110.501 -178.349 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.31 -168.35 52.96 Favored Glycine 0 CA--C 1.519 0.331 0 N-CA-C 110.175 -1.17 . . . . 1.0 110.175 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -60.83 145.99 47.94 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.607 -0.437 . . . . 1.0 109.837 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.2 ttp -131.08 145.55 52.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.324 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.1 tt -138.8 138.35 42.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -111.59 143.66 42.1 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.511 0.672 . . . . 1.0 110.66 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -129.15 153.15 47.97 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.586 -1.188 . . . . 1.0 110.537 -179.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 58.4 p -143.73 10.67 1.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 1.0 111.01 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.978 ' O ' ' O ' ' A' ' 108' ' ' ASP . 6.3 pt-20 -161.16 83.19 0.64 Allowed 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 118.657 -0.687 . . . . 1.0 110.016 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.978 ' O ' ' O ' ' A' ' 107' ' ' GLU . 53.4 p-10 14.99 164.83 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.021 1.119 . . . . 1.0 114.021 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -149.62 109.27 4.02 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 120.144 -1.597 . . . . 1.0 110.021 178.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 m -64.07 -31.88 73.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.651 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 t -135.41 89.68 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.246 0.546 . . . . 1.0 110.1 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.602 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.8 tp -61.4 -42.47 98.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.378 -0.828 . . . . 1.0 109.829 -178.843 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 79.0 mm-40 -42.93 -8.31 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.864 -0.607 . . . . 1.0 112.028 179.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.602 ' H ' ' C ' ' A' ' 112' ' ' LEU . 47.0 t0 -97.2 -22.32 16.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.118 0.485 . . . . 1.0 110.66 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.447 ' N ' ' O ' ' A' ' 112' ' ' LEU . 5.0 mmp_? -106.09 -37.21 6.68 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.183 0.809 . . . . 1.0 113.183 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.656 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.21 136.44 54.97 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.887 0.851 . . . . 1.0 110.128 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 118' ' ' PHE . 68.6 mtt85 -72.73 -69.61 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.632 -1.293 . . . . 1.0 110.371 -177.477 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.596 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -33.54 146.77 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.426 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -106.69 7.33 30.45 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.729 0.299 . . . . 1.0 111.326 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -138.41 139.74 39.04 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.11 0.481 . . . . 1.0 111.098 -178.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 40.0 mm -122.9 124.92 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.493 -0.776 . . . . 1.0 109.24 178.197 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.571 ' O ' ' OG ' ' A' ' 123' ' ' SER . 40.9 m-70 -116.0 21.62 13.62 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.543 -178.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.571 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 11.4 m 171.94 153.25 0.07 Allowed 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.161 0.505 . . . . 1.0 110.558 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 2.0 pp -165.72 157.7 14.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.321 -0.854 . . . . 1.0 110.788 -178.521 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.51 120.53 31.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.056 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 40.7 t -103.23 104.38 16.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 109.681 -0.488 . . . . 1.0 109.681 179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.593 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.25 -40.68 36.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.231 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.476 ' O ' ' O ' ' A' ' 129' ' ' GLY . 36.9 mm-40 -133.81 162.01 33.16 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.835 0.826 . . . . 1.0 110.933 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 38.11 -165.51 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 CA-C-N 113.474 -1.694 . . . . 1.0 110.91 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.478 ' OG ' ' CG2' ' A' ' 170' ' ' VAL . 32.1 p -119.73 162.41 19.09 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -134.49 160.9 36.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.069 -0.514 . . . . 1.0 109.995 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . 0.419 ' O ' ' HA ' ' A' ' 167' ' ' LEU . 46.6 t -132.09 139.39 50.36 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 N-CA-C 109.296 -0.631 . . . . 1.0 109.296 178.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 38.5 mt -111.11 141.73 44.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 110.184 -0.302 . . . . 1.0 110.184 179.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -117.41 132.84 56.5 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.26 0.35 . . . . 1.0 110.812 179.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -45.3 -36.85 4.33 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.371 -0.377 . . . . 1.0 110.725 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.418 ' CD1' ' C ' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -137.01 175.46 9.59 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.289 0.566 . . . . 1.0 110.767 -179.34 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.1 p -81.75 172.48 13.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.496 -0.775 . . . . 1.0 110.678 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 64.5 19.19 11.72 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.833 -1.076 . . . . 1.0 109.839 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.511 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 13.2 m-85 35.8 79.36 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.919 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -148.97 38.89 0.83 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.393 0.616 . . . . 1.0 109.989 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.72 -140.8 3.21 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 -178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . 0.48 HH12 ' CD1' ' A' ' 72' ' ' LEU . 28.8 mmt180 -74.64 165.44 25.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.918 -0.401 . . . . 1.0 109.918 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.52 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 1.3 pt20 -146.83 135.3 21.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.955 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . 0.432 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 7.2 m-85 -128.01 131.62 49.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 41.6 tp -87.72 126.37 34.94 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.29 0.567 . . . . 1.0 110.8 -179.534 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 28.6 mt -115.17 108.51 16.7 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.039 -0.982 . . . . 1.0 109.694 179.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.603 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 3.3 mtm -88.43 163.23 37.11 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.699 -0.4 . . . . 1.0 110.247 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -52.84 124.32 15.15 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 121.608 1.538 . . . . 1.0 111.393 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 165.64 -155.27 26.49 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 110.565 -1.014 . . . . 1.0 110.565 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 68.3 t0 -127.38 130.42 49.36 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.803 0.335 . . . . 1.0 110.299 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.2 m-85 -121.36 129.26 52.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 1.0 109.952 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . 0.5 ' C ' ' OG ' ' A' ' 123' ' ' SER . 13.5 ptm180 -118.95 5.99 11.37 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.838 0.351 . . . . 1.0 110.199 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.666 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.4 ptm180 -163.76 160.02 22.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.463 0.649 . . . . 1.0 110.319 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.466 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.4 p90 -75.99 -19.63 58.54 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.697 -1.138 . . . . 1.0 112.613 -177.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.666 ' NE2' HH21 ' A' ' 153' ' ' ARG . 40.3 mt-30 -70.52 -17.81 62.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.843 0.354 . . . . 1.0 111.228 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -54.68 -46.81 74.12 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.388 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.466 ' CZ2' ' HA ' ' A' ' 154' ' ' TYR . 14.3 p90 -97.45 20.47 11.62 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.266 -0.425 . . . . 1.0 110.738 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.82 75.32 0.23 Allowed Glycine 0 CA--C 1.521 0.439 0 N-CA-C 111.21 -0.756 . . . . 1.0 111.21 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.416 ' CB ' ' HE1' ' A' ' 157' ' ' TRP . . . -119.32 147.9 43.78 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 121.088 0.47 . . . . 1.0 110.336 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 160' ' ' THR . . . . . 0.411 ' O ' ' CG ' ' A' ' 161' ' ' ASN . 15.1 t -76.02 -20.46 57.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.894 -1.048 . . . . 1.0 110.106 177.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.411 ' CG ' ' O ' ' A' ' 160' ' ' THR . 13.1 m120 -163.56 -170.65 2.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.437 . . . . 1.0 110.503 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -108.27 -22.33 12.39 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.993 -0.548 . . . . 1.0 110.557 -179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -36.98 120.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.252 0.549 . . . . 1.0 111.651 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 21.3 t -124.23 162.12 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.714 -0.675 . . . . 1.0 109.794 179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -141.94 -33.67 0.11 Allowed Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.519 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 14.5 p -159.67 169.35 23.91 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.656 -0.417 . . . . 1.0 110.853 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . 0.494 ' N ' ' CD2' ' A' ' 167' ' ' LEU . 1.3 pt? -153.67 146.82 24.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.849 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.511 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 11.3 ptp180 -135.81 147.99 48.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.403 0.62 . . . . 1.0 110.01 178.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.404 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -83.12 150.69 26.12 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.144 -0.934 . . . . 1.0 108.902 178.204 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . 0.478 ' CG2' ' OG ' ' A' ' 130' ' ' SER . 35.6 t -83.71 85.25 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 111.837 0.31 . . . . 1.0 111.837 -177.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.7 mp -135.13 116.77 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 N-CA-C 109.491 -0.559 . . . . 1.0 109.491 179.384 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.401 ' O ' ' CZ ' ' A' ' 60' ' ' ARG . 20.5 t0 -68.45 -36.58 79.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.514 -0.766 . . . . 1.0 110.208 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.413 ' O ' ' OG ' ' A' ' 174' ' ' SER . 78.5 m-85 -67.12 179.76 1.11 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.906 -0.588 . . . . 1.0 110.81 -179.948 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 174' ' ' SER . . . . . 0.413 ' OG ' ' O ' ' A' ' 173' ' ' PHE . 14.4 p . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 118.001 -0.999 . . . . 1.0 110.425 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.094 -0.706 . . . . 1.0 109.094 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.31 -177.37 47.67 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 -179.401 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -168.22 140.93 3.03 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.25 -0.278 . . . . 1.0 110.25 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -148.46 167.43 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-N 116.448 -0.342 . . . . 1.0 110.912 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 29.2 m -127.09 121.09 30.51 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 108.278 -1.008 . . . . 1.0 108.278 176.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.3 mt -105.77 133.09 51.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.871 -1.059 . . . . 1.0 110.097 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 68.1 m-85 -115.92 126.52 54.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.361 -178.7 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -53.75 -29.31 39.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.561 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -118.19 153.29 34.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.206 0.527 . . . . 1.0 110.365 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -58.38 -174.51 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.348 -0.842 . . . . 1.0 110.348 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.13 26.45 0.53 Allowed Glycine 0 N--CA 1.461 0.32 0 N-CA-C 110.798 -0.921 . . . . 1.0 110.798 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 50.29 68.98 0.67 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.395 -0.403 . . . . 1.0 110.304 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -129.35 -156.48 0.76 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.958 0.409 . . . . 1.0 110.485 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.41 -151.68 0.1 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.088 -0.805 . . . . 1.0 111.088 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.1 147.16 51.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.319 . . . . 1.0 110.689 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.8 p-80 -135.84 150.57 49.45 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.363 0.601 . . . . 1.0 110.25 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.573 ' HH ' ' CE1' ' A' ' 23' ' ' HIS . 6.1 t80 -145.22 142.13 29.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.22 -0.9 . . . . 1.0 110.203 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.54 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 31.0 tt0 -110.62 122.53 48.0 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.174 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . 0.453 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -110.41 127.05 54.91 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.535 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' SER . . . . . 0.404 ' O ' ' OG ' ' A' ' 20' ' ' SER . 9.0 t -119.41 13.6 12.71 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.392 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.8 m -158.29 172.31 18.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 1.0 110.692 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 50.0 p-10 -62.49 137.33 58.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.505 -0.771 . . . . 1.0 112.051 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.573 ' CE1' ' HH ' ' A' ' 17' ' ' TYR . 0.2 OUTLIER -133.08 143.49 49.36 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.463 -0.789 . . . . 1.0 110.404 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.4 p -112.36 -16.11 13.0 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.527 -0.76 . . . . 1.0 111.724 -179.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -149.88 115.19 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 1.0 110.32 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.7 mt -117.89 0.51 11.93 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.334 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -52.92 -42.16 88.79 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.043 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 39.1 Cg_exo -59.26 -33.66 97.98 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.078 1.852 . . . . 1.0 111.556 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.94 -53.13 3.78 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.828 0.347 . . . . 1.0 111.012 -179.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -117.3 126.27 52.45 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.463 -178.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.6 t -93.93 -7.68 42.31 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.61 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.403 ' CG ' HD22 ' A' ' 34' ' ' ASN . 15.5 tpp180 -146.97 -60.65 0.29 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.436 -0.347 . . . . 1.0 111.923 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.3 t 64.98 75.81 0.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 O-C-N 123.269 0.356 . . . . 1.0 110.128 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . 0.403 HD22 ' CG ' ' A' ' 32' ' ' ARG . 15.6 m120 -93.1 3.34 55.89 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 116.33 -0.396 . . . . 1.0 111.32 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.9 p -155.41 157.35 36.91 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.959 -0.386 . . . . 1.0 109.959 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.75 155.32 34.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.006 -0.543 . . . . 1.0 111.059 -178.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.478 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 24.3 mtp85 -133.81 122.02 22.65 Favored 'General case' 0 C--O 1.21 -0.98 0 N-CA-C 108.371 -0.974 . . . . 1.0 108.371 178.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.94 114.63 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-O 121.259 0.552 . . . . 1.0 110.05 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -74.22 -44.89 51.38 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.002 -0.999 . . . . 1.0 110.695 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.1 t -162.68 155.13 19.01 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.643 -0.503 . . . . 1.0 109.643 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.89 175.97 50.06 Favored Glycine 0 C--N 1.317 -0.513 0 N-CA-C 110.566 -1.014 . . . . 1.0 110.566 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.1 m -111.94 138.1 49.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 54.9 m95 -126.04 146.29 49.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.619 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.462 ' SD ' ' C ' ' A' ' 56' ' ' TYR . 18.5 tpp -121.4 130.78 53.79 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 108.684 -0.858 . . . . 1.0 108.684 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 1.3 mt -110.1 132.08 54.48 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.026 -0.731 . . . . 1.0 109.026 -179.374 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . 0.421 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 64.2 m-85 -108.12 130.96 55.08 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.634 0.731 . . . . 1.0 110.306 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.597 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.7 -34.61 71.5 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.006 -0.997 . . . . 1.0 110.596 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.411 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.0 mt-30 -109.5 153.04 43.04 Favored Pre-proline 0 C--N 1.333 -0.119 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.339 -178.758 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.29 160.24 35.93 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.308 2.005 . . . . 1.0 112.497 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.626 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.13 38.21 13.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.364 -0.835 . . . . 1.0 111.106 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.421 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.9 m-85 48.99 75.24 0.15 Allowed 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.899 -1.046 . . . . 1.0 111.02 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.6 m -143.91 154.2 43.09 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.021 0.439 . . . . 1.0 110.276 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.65 -150.02 22.15 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.978 -0.63 . . . . 1.0 111.947 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.597 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.8 tp -74.92 144.5 43.25 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.043 -0.579 . . . . 1.0 110.265 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -122.42 151.52 41.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.671 0.272 . . . . 1.0 110.433 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 8.4 m-85 -128.23 126.19 40.44 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.742 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -83.43 123.81 30.06 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.019 0.437 . . . . 1.0 109.886 -179.604 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.8 mp -117.3 145.61 43.88 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.079 179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtm-85 -131.98 157.11 44.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.401 -0.818 . . . . 1.0 109.767 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 59' ' ' ARG . 71.8 ttt180 -36.32 126.52 0.79 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.69 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.94 -177.89 32.78 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.348 -1.101 . . . . 1.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.478 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 68.6 m-20 -115.99 129.56 56.43 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.86 0.362 . . . . 1.0 110.209 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -123.27 112.86 18.14 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.439 -0.578 . . . . 1.0 109.439 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.6 -4.23 55.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.882 -0.599 . . . . 1.0 111.456 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 76.7 m-20 -147.72 139.33 23.87 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.18 -0.674 . . . . 1.0 109.18 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.499 ' C ' ' H ' ' A' ' 68' ' ' GLN . 15.2 p-80 -59.98 -41.14 91.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.093 0.473 . . . . 1.0 110.971 -179.072 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . 0.493 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 97.3 mm-40 -53.84 -7.6 0.13 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.67 179.345 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.499 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.0 mm-40 -83.96 -35.29 24.08 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.58 -0.448 . . . . 1.0 111.506 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.81 15.45 12.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 119.286 -0.388 . . . . 1.0 110.938 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.585 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 77.0 mtp 83.77 16.35 0.26 Allowed 'General case' 0 N--CA 1.463 0.215 0 O-C-N 123.922 0.764 . . . . 1.0 109.932 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . -62.73 101.57 0.42 Allowed Glycine 0 C--N 1.344 1.007 0 C-N-CA 120.068 -1.063 . . . . 1.0 110.68 178.748 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 64.6 mt -77.9 -35.84 50.25 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.976 -0.379 . . . . 1.0 109.976 177.185 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.556 ' C ' ' H ' ' A' ' 75' ' ' SER . 27.5 t -124.52 121.01 33.63 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.844 0.354 . . . . 1.0 110.151 178.858 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 55.5 p-10 -71.16 35.91 0.05 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.21 -0.45 . . . . 1.0 110.697 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.556 ' H ' ' C ' ' A' ' 73' ' ' SER . 27.2 m -111.17 72.39 0.78 Allowed 'General case' 0 C--O 1.213 -0.853 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.539 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.87 118.57 46.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 109.317 -0.623 . . . . 1.0 109.317 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -124.41 3.14 8.42 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.192 -0.458 . . . . 1.0 111.393 -178.546 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 p -163.47 162.54 24.73 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.062 0.458 . . . . 1.0 110.647 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.4 p -155.49 147.09 23.01 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.748 . . . . 1.0 110.105 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.45 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 2.9 ptm180 -128.02 152.44 47.93 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.456 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.1 tt -104.65 128.54 52.73 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.957 -1.127 . . . . 1.0 107.957 178.262 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.438 ' N ' HD21 ' A' ' 81' ' ' LEU . 2.3 mt -90.56 115.71 64.76 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.295 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.0 153.94 14.41 Favored 'Trans proline' 0 N--CA 1.502 2.013 0 C-N-CA 122.468 2.112 . . . . 1.0 112.97 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.6 m170 -73.44 -174.51 1.69 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.646 -0.706 . . . . 1.0 110.191 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.422 ' OG ' ' CA ' ' A' ' 129' ' ' GLY . 3.1 t -167.88 137.46 2.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.028 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -82.22 -73.27 1.22 Allowed Glycine 0 CA--C 1.521 0.425 0 N-CA-C 109.843 -1.303 . . . . 1.0 109.843 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 m -87.15 152.1 22.63 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -132.2 120.22 21.92 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.624 -0.262 . . . . 1.0 111.179 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -146.92 134.7 21.19 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.957 -0.386 . . . . 1.0 109.957 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.0 tt -147.81 138.61 17.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.71 -0.223 . . . . 1.0 110.83 -179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -118.03 102.2 8.86 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.457 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.78 147.32 27.66 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.315 -0.402 . . . . 1.0 111.288 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.464 ' CD2' ' O ' ' A' ' 97' ' ' ASP . 65.3 m-85 -118.28 133.66 55.7 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 115.554 -0.748 . . . . 1.0 111.508 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.648 ' OE1' ' O ' ' A' ' 101' ' ' GLN . 0.5 OUTLIER -55.21 -36.49 66.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.965 -1.016 . . . . 1.0 111.291 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.613 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 36.8 mtp85 -130.98 170.05 14.99 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.419 -0.355 . . . . 1.0 110.131 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . 0.465 ' C ' ' HG ' ' A' ' 123' ' ' SER . 96.8 mt-10 -43.15 152.25 0.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.837 -0.62 . . . . 1.0 110.723 179.443 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.464 ' O ' ' CD2' ' A' ' 93' ' ' TYR . 69.7 m-20 57.13 -102.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.266 -0.879 . . . . 1.0 110.369 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -166.64 37.77 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.092 -0.643 . . . . 1.0 109.536 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -95.38 70.82 3.17 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.416 0.627 . . . . 1.0 111.56 -178.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 161.78 -155.28 26.48 Favored Glycine 0 CA--C 1.533 1.173 0 CA-C-N 114.931 -1.031 . . . . 1.0 111.413 179.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.648 ' O ' ' OE1' ' A' ' 94' ' ' GLU . 67.4 tp60 -63.81 134.46 55.29 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 120.992 0.425 . . . . 1.0 111.728 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.402 ' SD ' ' C ' ' A' ' 102' ' ' MET . 0.5 OUTLIER -122.41 138.6 54.48 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.8 tt -139.99 138.57 37.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.246 -0.65 . . . . 1.0 109.246 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -112.95 147.25 37.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.203 0.525 . . . . 1.0 110.359 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -130.56 154.45 47.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.684 -1.144 . . . . 1.0 110.285 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 18.2 p -143.28 9.3 1.64 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.547 -0.751 . . . . 1.0 111.17 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.956 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.1 pt-20 -158.51 81.08 0.82 Allowed 'General case' 0 C--O 1.216 -0.664 0 CA-C-O 118.488 -0.768 . . . . 1.0 109.884 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.956 ' O ' ' O ' ' A' ' 107' ' ' GLU . 14.0 p-10 18.46 164.99 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.514 1.149 . . . . 1.0 113.482 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 108' ' ' ASP . 98.3 m -148.43 107.58 3.89 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 120.133 -1.604 . . . . 1.0 109.896 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.443 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.0 p -66.28 -19.59 65.86 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.667 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . 0.527 ' SG ' ' OG ' ' A' ' 137' ' ' SER . 4.1 m -146.61 95.09 2.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.269 0.557 . . . . 1.0 109.974 -179.898 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.492 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -62.39 -42.33 99.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.54 -0.754 . . . . 1.0 110.285 -179.201 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -45.72 -14.65 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.345 -0.388 . . . . 1.0 111.47 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.467 ' H ' ' C ' ' A' ' 112' ' ' LEU . 81.3 m-20 -93.05 7.15 45.33 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.582 0.706 . . . . 1.0 110.481 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.492 ' N ' ' O ' ' A' ' 112' ' ' LEU . 39.4 mmt180 -136.67 -42.78 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.508 -1.224 . . . . 1.0 113.719 -177.232 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.625 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -125.26 143.4 50.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.646 0.736 . . . . 1.0 110.667 -178.509 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 87.1 mtt180 -72.63 -73.7 0.19 Allowed 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.748 -0.781 . . . . 1.0 110.616 -177.673 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.606 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 93.2 m-85 -30.46 142.18 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 O-C-N 123.821 0.701 . . . . 1.0 110.391 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -104.3 12.44 33.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.851 0.358 . . . . 1.0 110.905 -178.467 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -142.02 138.48 31.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.536 0.684 . . . . 1.0 111.012 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.9 mm -120.43 118.09 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-N 115.067 -0.97 . . . . 1.0 109.088 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -109.9 24.09 13.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.629 -0.714 . . . . 1.0 111.497 -178.783 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.3 p 170.17 150.0 0.04 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.046 0.451 . . . . 1.0 109.825 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.8 pp -163.48 157.97 20.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.353 -0.84 . . . . 1.0 110.232 -178.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.16 120.27 30.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.529 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 43.5 t -103.83 104.21 16.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 178.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.583 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.13 -40.32 31.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.564 -0.744 . . . . 1.0 111.22 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -139.88 148.21 41.74 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.106 0.479 . . . . 1.0 110.766 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.422 ' CA ' ' OG ' ' A' ' 85' ' ' SER . . . 59.11 -176.86 2.46 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.029 -0.828 . . . . 1.0 111.029 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 22.0 p -117.46 151.71 36.52 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 179.512 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -127.56 168.21 15.27 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.53 -0.759 . . . . 1.0 110.526 -178.632 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.54 144.84 25.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 48.3 mt -111.48 142.83 43.24 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -179.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . 0.411 ' CE2' ' CG ' ' A' ' 143' ' ' GLN . 39.1 m-85 -117.55 131.61 56.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.801 0.334 . . . . 1.0 110.247 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -43.82 -44.74 7.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.283 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.431 HD13 ' C ' ' A' ' 140' ' ' ARG . 0.5 OUTLIER -130.77 169.25 15.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.999 0.428 . . . . 1.0 110.001 -179.345 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.527 ' OG ' ' SG ' ' A' ' 111' ' ' CYS . 3.1 t -73.64 168.81 18.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.849 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . 0.463 ' ND2' ' HE ' ' A' ' 140' ' ' ARG . 57.8 t30 69.32 14.82 8.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.142 -0.935 . . . . 1.0 109.911 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 41.42 78.43 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.241 -0.436 . . . . 1.0 111.997 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.463 ' HE ' ' ND2' ' A' ' 138' ' ' ASN . 89.0 mtt-85 -147.46 35.36 0.87 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 120.926 0.393 . . . . 1.0 110.462 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -145.81 -150.14 5.14 Favored Glycine 0 N--CA 1.464 0.516 0 N-CA-C 111.763 -0.535 . . . . 1.0 111.763 -177.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 -69.51 165.35 21.16 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.904 -0.406 . . . . 1.0 109.904 179.528 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.585 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 42.3 mt-30 -142.8 135.01 27.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.552 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -126.86 124.75 40.32 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 108.807 -0.812 . . . . 1.0 108.807 178.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.2 126.63 32.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.048 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 23.7 mt -114.79 100.01 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.206 -0.907 . . . . 1.0 109.391 179.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.568 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -82.28 158.69 66.27 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.319 -179.199 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -47.36 121.76 5.8 Favored 'Trans proline' 0 N--CA 1.491 1.375 0 C-N-CA 121.632 1.555 . . . . 1.0 111.518 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.53 -154.83 24.93 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.38 -1.088 . . . . 1.0 110.38 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -129.49 129.27 44.35 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.874 0.368 . . . . 1.0 110.226 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.51 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -119.24 130.12 55.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.054 -0.521 . . . . 1.0 109.996 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -118.01 -3.8 11.1 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.843 0.354 . . . . 1.0 110.569 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -155.41 157.73 37.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.26 0.552 . . . . 1.0 109.964 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.533 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -70.3 -21.32 62.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.879 -1.055 . . . . 1.0 111.459 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.533 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.4 mt-30 -66.06 -21.3 66.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.234 0.54 . . . . 1.0 110.971 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -50.21 -47.96 54.59 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.793 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.469 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 19.1 p90 -101.9 18.45 20.57 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.16 0.505 . . . . 1.0 110.167 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.36 75.7 0.21 Allowed Glycine 0 C--N 1.331 0.269 0 N-CA-C 111.103 -0.799 . . . . 1.0 111.103 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.469 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -95.07 -171.05 2.32 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.053 0.454 . . . . 1.0 110.264 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.74 -35.94 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.342 -0.844 . . . . 1.0 111.588 -178.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.559 ' ND2' ' O ' ' A' ' 161' ' ' ASN . 0.5 OUTLIER -146.31 -18.98 0.44 Allowed 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 111.948 0.351 . . . . 1.0 111.948 -178.376 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.517 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 90.66 -21.95 0.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.658 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -42.39 122.57 2.27 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.565 -0.743 . . . . 1.0 110.72 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 26.0 t -123.21 133.24 69.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.275 -0.875 . . . . 1.0 110.106 179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.33 -29.5 3.94 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.879 -0.489 . . . . 1.0 111.879 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.443 ' OG ' ' O ' ' A' ' 110' ' ' SER . 16.0 m -163.56 176.69 9.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.829 0.347 . . . . 1.0 110.188 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -160.2 142.6 13.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.841 -0.618 . . . . 1.0 110.52 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -131.84 157.28 44.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.498 -0.556 . . . . 1.0 109.498 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -88.85 153.11 21.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.832 -0.622 . . . . 1.0 109.411 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 59.0 t -88.56 88.43 2.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.588 -0.445 . . . . 1.0 111.659 -179.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.7 mp -139.28 138.34 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.235 -0.439 . . . . 1.0 110.439 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -96.73 -33.77 11.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.777 -0.647 . . . . 1.0 110.643 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.691 ' CG ' ' N ' ' A' ' 174' ' ' SER . 0.0 OUTLIER -69.82 -64.77 0.82 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.461 0.648 . . . . 1.0 109.954 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 174' ' ' SER . . . . . 0.691 ' N ' ' CG ' ' A' ' 173' ' ' PHE . 86.1 p . . . . . 0 C--N 1.321 -0.658 0 CA-C-O 117.725 -1.131 . . . . 1.0 111.191 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.078 -0.712 . . . . 1.0 109.078 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.66 172.82 45.23 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.429 -1.068 . . . . 1.0 110.429 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -171.38 111.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 121.034 -0.266 . . . . 1.0 110.692 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.83 169.37 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 120.928 0.394 . . . . 1.0 111.049 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 27.3 m -127.33 120.23 28.09 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.842 -1.17 . . . . 1.0 107.842 177.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -104.72 132.7 50.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.937 -1.029 . . . . 1.0 110.057 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 54.8 m-85 -115.15 125.87 53.95 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.394 -0.821 . . . . 1.0 111.022 -178.711 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -51.63 -34.28 37.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.634 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -114.84 151.54 33.72 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.205 0.526 . . . . 1.0 110.423 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' PHE . 12.0 ptm180 -56.42 -171.96 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.588 -179.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.28 23.76 0.17 Allowed Glycine 0 C--N 1.332 0.334 0 N-CA-C 110.937 -0.865 . . . . 1.0 110.937 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.451 ' N ' ' O ' ' A' ' 10' ' ' ARG . 9.6 m-85 52.54 69.59 0.67 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.568 -0.316 . . . . 1.0 110.172 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -131.69 -161.37 1.12 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.944 0.402 . . . . 1.0 110.482 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.76 -148.68 1.86 Allowed Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.951 -0.86 . . . . 1.0 110.951 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -72.48 148.1 45.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.786 0.327 . . . . 1.0 110.735 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.4 p-80 -137.04 151.98 49.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.259 0.552 . . . . 1.0 110.409 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.5 t80 -145.23 141.61 28.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.297 -0.865 . . . . 1.0 110.148 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.519 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.5 tt0 -110.42 123.04 49.14 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.895 -0.593 . . . . 1.0 110.183 -179.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -111.69 126.95 55.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.288 -0.415 . . . . 1.0 110.994 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 72.0 p -118.78 11.24 12.62 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.809 -0.632 . . . . 1.0 110.566 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.5 p -156.02 168.81 26.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.477 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 50.2 p-10 -58.86 136.75 57.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.638 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -131.74 142.99 49.92 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.443 -0.798 . . . . 1.0 110.533 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' THR . . . . . 0.504 ' O ' ' OG ' ' A' ' 78' ' ' SER . 65.4 p -115.73 -11.96 11.57 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.401 -0.818 . . . . 1.0 111.887 -178.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -149.95 110.96 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.274 0.559 . . . . 1.0 109.777 -179.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 36.4 mt -118.01 -3.55 11.12 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.428 -179.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.556 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -47.17 -52.67 33.15 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.488 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.556 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.5 Cg_endo -55.88 -32.45 85.21 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 C-N-CA 121.556 1.504 . . . . 1.0 112.295 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.1 m-85 -91.98 -49.5 6.19 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.362 -0.535 . . . . 1.0 110.38 -178.515 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.3 mt -121.41 126.95 50.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.44 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -94.7 -14.59 24.67 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.725 -0.671 . . . . 1.0 111.942 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -144.59 -55.84 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.381 . . . . 1.0 111.685 -178.067 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.0 t 60.75 79.5 0.24 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.096 -0.335 . . . . 1.0 110.096 -178.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -94.25 4.83 53.35 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.243 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.1 p -156.83 158.03 36.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.958 0.409 . . . . 1.0 110.372 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.68 154.45 32.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.624 . . . . 1.0 110.893 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.5 mtp85 -133.16 122.46 24.06 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 108.688 -0.856 . . . . 1.0 108.688 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.7 t -107.82 115.93 50.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.149 0.5 . . . . 1.0 109.873 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.51 ' C ' ' HG ' ' A' ' 40' ' ' SER . 22.4 t0 -78.44 -43.6 26.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.465 -0.788 . . . . 1.0 110.914 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' SER . . . . . 0.51 ' HG ' ' C ' ' A' ' 39' ' ' ASP . 57.7 m -160.42 159.81 31.43 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.375 -0.602 . . . . 1.0 109.375 -179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.93 176.02 48.98 Favored Glycine 0 C--N 1.316 -0.565 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.9 m -112.49 138.02 49.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.091 -0.707 . . . . 1.0 109.091 178.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.459 ' CE2' ' HG ' ' A' ' 81' ' ' LEU . 52.4 m95 -127.94 148.82 50.52 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.288 0.566 . . . . 1.0 110.916 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.516 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 1.9 ttt -128.06 137.04 52.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.413 -0.812 . . . . 1.0 110.021 178.289 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -113.27 139.73 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.374 -178.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -109.64 134.93 51.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.461 0.648 . . . . 1.0 111.711 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.526 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 15.4 pt-20 -57.86 -32.41 67.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.863 -1.062 . . . . 1.0 111.133 -178.243 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 52' ' ' SER . 10.9 pt20 -115.93 155.16 48.17 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.31 -0.626 . . . . 1.0 109.31 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.404 ' C ' HD21 ' A' ' 50' ' ' ASN . 15.9 Cg_endo -52.82 149.0 26.97 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 121.089 1.193 . . . . 1.0 111.87 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.809 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.4 OUTLIER 75.78 -123.46 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.566 -1.197 . . . . 1.0 109.403 -178.662 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.543 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -150.96 73.29 1.1 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.18 0.514 . . . . 1.0 110.218 179.034 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.51 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 3.4 m -140.08 18.19 2.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.776 -0.647 . . . . 1.0 112.037 -177.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -137.7 -164.74 10.13 Favored Glycine 0 N--CA 1.467 0.73 0 N-CA-C 111.127 -0.789 . . . . 1.0 111.127 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.526 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 38.9 tp -59.39 146.76 38.8 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.516 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 4.9 pt20 -121.97 150.09 42.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.696 0.284 . . . . 1.0 110.692 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -125.61 123.64 39.47 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.009 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -83.58 122.32 28.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.112 0.482 . . . . 1.0 110.59 -179.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.5 mp -118.36 145.25 45.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.724 -0.671 . . . . 1.0 110.144 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.635 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 64.1 mtm180 -132.11 157.71 43.51 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.468 -0.787 . . . . 1.0 110.025 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.2 ptm180 -34.32 125.23 0.49 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.035 -0.529 . . . . 1.0 110.941 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.65 -178.3 32.32 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.35 129.02 56.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.059 0.457 . . . . 1.0 110.644 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -122.22 113.2 19.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.507 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.81 -3.66 54.33 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.982 -0.554 . . . . 1.0 111.537 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.9 m-20 -147.64 137.26 22.64 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.001 -0.74 . . . . 1.0 109.001 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.5 ' H ' ' CD2' ' A' ' 66' ' ' HIS . 6.1 p80 -58.93 -37.87 77.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.059 0.457 . . . . 1.0 111.035 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.73 -7.83 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.917 -0.583 . . . . 1.0 110.494 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.459 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.7 mm-40 -83.14 -33.9 26.15 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 120.675 -0.41 . . . . 1.0 111.694 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.445 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.0 p90 -94.41 15.57 17.36 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.812 -0.355 . . . . 1.0 110.813 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.476 ' C ' ' H ' ' A' ' 72' ' ' LEU . 53.3 mtt 75.4 27.92 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.912 0.757 . . . . 1.0 109.942 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.588 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.04 39.82 0.82 Allowed Glycine 0 C--N 1.339 0.727 0 C-N-CA 120.135 -1.031 . . . . 1.0 111.999 -179.46 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.494 ' C ' ' O ' ' A' ' 71' ' ' GLY . 10.3 mt -17.38 -47.75 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.352 0.661 . . . . 1.0 110.823 -178.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.588 ' N ' ' O ' ' A' ' 71' ' ' GLY . 83.2 p -102.64 117.34 34.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.628 -0.715 . . . . 1.0 109.113 177.503 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -66.26 37.28 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.335 -0.393 . . . . 1.0 111.172 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.569 ' H ' ' C ' ' A' ' 73' ' ' SER . 35.6 t -117.36 127.14 53.75 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 109.742 -0.466 . . . . 1.0 109.742 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.1 p -163.57 118.1 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.03 -0.73 . . . . 1.0 109.03 -179.291 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -131.21 12.99 5.12 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.976 -178.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' SER . . . . . 0.504 ' OG ' ' O ' ' A' ' 24' ' ' THR . 3.5 m -160.84 159.55 29.99 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.306 0.574 . . . . 1.0 111.104 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.5 p -155.56 146.55 22.42 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.229 -0.896 . . . . 1.0 110.984 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.602 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 7.9 ptm180 -125.49 150.8 47.05 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.459 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 3.8 tt -102.6 121.84 43.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.347 -1.353 . . . . 1.0 107.347 178.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.423 HG21 HD12 ' A' ' 82' ' ' ILE . 5.3 mt -84.12 116.64 65.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 116.115 -0.493 . . . . 1.0 109.903 -178.274 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -53.81 150.53 29.27 Favored 'Trans proline' 0 N--CA 1.5 1.884 0 C-N-CA 121.912 1.741 . . . . 1.0 113.219 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -71.77 177.7 4.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.251 -0.886 . . . . 1.0 110.614 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.7 t -168.24 147.4 4.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.971 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -99.31 -56.04 1.01 Allowed Glycine 0 N--CA 1.465 0.615 0 N-CA-C 110.397 -1.081 . . . . 1.0 110.397 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.6 m -90.19 144.69 25.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.85 0.357 . . . . 1.0 110.093 179.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -133.48 110.11 9.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.856 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -137.99 131.69 31.14 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.839 -0.344 . . . . 1.0 110.084 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 19.5 tt -147.84 148.26 16.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.84 0.352 . . . . 1.0 111.114 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -125.73 98.07 5.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.565 -0.743 . . . . 1.0 111.699 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 17.4 mt -75.57 135.95 40.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 1.0 110.071 179.075 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -117.78 138.28 52.16 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.566 0.698 . . . . 1.0 111.481 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.526 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.8 OUTLIER -56.56 -65.04 0.68 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.348 -0.842 . . . . 1.0 111.79 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -96.68 173.25 7.42 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.352 0.596 . . . . 1.0 111.446 -178.674 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -64.05 167.53 6.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.845 -1.071 . . . . 1.0 111.697 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . 0.498 ' C ' ' CG ' ' A' ' 98' ' ' TYR . 66.5 t0 49.35 36.51 9.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.83 -1.077 . . . . 1.0 111.093 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.57 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER 56.13 35.75 26.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.313 -0.858 . . . . 1.0 110.639 178.344 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 78.7 mtp85 -99.25 148.91 23.65 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.129 0.49 . . . . 1.0 110.812 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.08 -164.62 31.17 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.27 -0.732 . . . . 1.0 111.27 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -63.07 146.13 53.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.958 0.408 . . . . 1.0 110.798 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.497 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.1 ppp? -132.49 158.67 41.5 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.743 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.8 tt -148.85 142.07 18.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 73.4 tt0 -113.53 141.94 46.55 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.619 0.723 . . . . 1.0 110.804 -178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 83.7 m-85 -129.32 151.68 49.71 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 114.669 -1.15 . . . . 1.0 110.267 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.4 p -143.63 16.95 1.82 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.082 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.97 ' O ' ' O ' ' A' ' 108' ' ' ASP . 4.9 pt-20 -166.31 86.14 0.32 Allowed 'General case' 0 C--O 1.213 -0.867 0 CA-C-O 118.328 -0.844 . . . . 1.0 111.013 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.97 ' O ' ' O ' ' A' ' 107' ' ' GLU . 7.8 t70 16.68 154.34 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 122.231 1.015 . . . . 1.0 113.16 178.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 4.1 t -140.99 104.82 4.74 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.098 -1.001 . . . . 1.0 110.531 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.3 m -64.52 -31.72 73.05 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.246 -0.434 . . . . 1.0 110.726 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.2 t -137.09 90.14 2.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.073 -0.512 . . . . 1.0 110.099 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.58 ' C ' ' H ' ' A' ' 114' ' ' ASP . 12.2 tp -62.03 -42.86 99.62 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.736 -0.666 . . . . 1.0 110.423 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.548 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 25.8 mp0 -43.08 -9.7 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.58 ' H ' ' C ' ' A' ' 112' ' ' LEU . 84.0 m-20 -95.31 -20.83 18.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.176 0.512 . . . . 1.0 110.472 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.457 ' N ' ' O ' ' A' ' 112' ' ' LEU . 24.9 mmt85 -109.96 -35.72 6.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.405 -0.816 . . . . 1.0 113.149 -178.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.676 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.71 137.24 54.83 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.765 0.793 . . . . 1.0 110.151 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.8 mtt180 -75.27 -70.66 0.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 120.914 -1.116 . . . . 1.0 110.653 -177.739 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.632 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 87.4 m-85 -33.0 145.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.307 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -104.32 10.49 35.48 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.779 0.323 . . . . 1.0 111.115 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 76.7 mt-10 -141.07 141.72 34.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.087 0.47 . . . . 1.0 111.228 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 35.4 mm -122.68 116.44 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.564 -0.744 . . . . 1.0 109.116 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.463 ' O ' ' CB ' ' A' ' 123' ' ' SER . 41.7 m-70 -109.34 31.13 5.99 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.333 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.6 t 161.59 150.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.14 0.495 . . . . 1.0 110.661 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -159.63 156.05 27.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.524 -0.762 . . . . 1.0 110.529 -178.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.87 107.26 9.95 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.702 -0.481 . . . . 1.0 109.702 -179.239 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 1.1 p -104.57 108.18 24.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 108.666 -0.864 . . . . 1.0 108.666 179.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.599 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.3 OUTLIER -78.4 -33.25 48.86 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.875 -1.057 . . . . 1.0 110.83 -179.04 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -148.61 164.76 33.34 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.277 0.561 . . . . 1.0 110.859 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 55.81 170.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 110.416 -1.074 . . . . 1.0 110.416 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 4.1 t -115.67 146.76 41.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.363 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 41.1 m95 -120.79 161.16 21.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.076 -177.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.7 t -135.84 98.56 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . 0.421 HD11 ' N ' ' A' ' 133' ' ' LEU . 5.5 mp -69.71 138.51 52.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.527 -0.306 . . . . 1.0 110.26 -179.012 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . 0.63 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 43.3 m-85 -118.31 133.4 55.92 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.825 -0.625 . . . . 1.0 110.802 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . 0.448 ' OE2' ' CD ' ' A' ' 163' ' ' ARG . 42.9 tp10 -39.94 -56.14 1.88 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.858 -0.61 . . . . 1.0 111.199 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.442 HD12 ' C ' ' A' ' 140' ' ' ARG . 0.5 OUTLIER -123.92 170.45 10.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.487 -178.494 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 22.0 p -74.7 169.16 18.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.372 -0.831 . . . . 1.0 110.744 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 59.6 t30 67.24 17.27 10.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.268 -0.878 . . . . 1.0 109.667 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.429 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.0 m-85 38.1 80.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.873 -0.603 . . . . 1.0 112.215 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . 0.442 ' C ' HD12 ' A' ' 136' ' ' LEU . 15.9 tpp180 -148.98 39.79 0.86 Allowed 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.815 0.34 . . . . 1.0 110.326 179.302 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.15 -136.28 2.47 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.197 -0.761 . . . . 1.0 111.197 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 77.1 mtp85 -81.22 172.34 13.75 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.209 -0.293 . . . . 1.0 110.209 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -149.35 134.85 18.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.512 . . . . 1.0 111.188 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -130.05 120.0 24.0 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.924 0.392 . . . . 1.0 110.212 179.122 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 53.2 tp -79.97 131.24 35.78 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.614 0.721 . . . . 1.0 110.8 179.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 22.9 mt -117.27 105.03 11.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.023 179.34 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.602 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.7 mtm -77.52 159.56 76.89 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 109.823 -0.436 . . . . 1.0 109.823 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.45 114.81 2.08 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.207 1.938 . . . . 1.0 111.999 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.21 -154.98 19.46 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 -179.299 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 50.5 p-10 -121.23 136.11 55.02 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.061 0.458 . . . . 1.0 110.715 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.542 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 9.8 m-85 -127.29 126.76 43.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 32.1 ptt-85 -117.22 3.67 12.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.874 0.369 . . . . 1.0 110.305 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -162.37 160.72 26.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.532 0.682 . . . . 1.0 110.482 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.534 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -74.68 -17.96 60.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.869 -1.06 . . . . 1.0 111.93 -178.476 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.534 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.5 mt-30 -66.4 -20.55 66.1 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.115 -0.493 . . . . 1.0 111.214 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . 0.542 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 41.6 t0 -50.39 -49.47 54.39 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.067 -178.686 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.471 ' HE1' ' HB1' ' A' ' 159' ' ' ALA . 36.1 p90 -101.55 19.2 18.42 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.033 0.444 . . . . 1.0 110.323 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.0 75.14 0.24 Allowed Glycine 0 CA--C 1.518 0.253 0 CA-C-N 115.617 -0.719 . . . . 1.0 111.433 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.471 ' HB1' ' HE1' ' A' ' 157' ' ' TRP . . . -95.4 -171.14 2.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 1.0 110.71 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 160' ' ' THR . . . . . 0.589 ' HG1' ' N ' ' A' ' 161' ' ' ASN . 0.7 OUTLIER -121.31 -40.85 2.55 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.295 -0.866 . . . . 1.0 111.955 -178.099 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.589 ' N ' ' HG1' ' A' ' 160' ' ' THR . 0.7 OUTLIER -143.01 -16.52 0.68 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.974 -177.744 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.521 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 90.32 -21.24 0.12 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.832 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . 0.448 ' CD ' ' OE2' ' A' ' 135' ' ' GLU . 17.4 ptp180 -44.35 123.56 3.57 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.593 0.711 . . . . 1.0 110.939 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 11.8 t -119.54 156.08 22.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.159 -0.928 . . . . 1.0 110.343 179.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.469 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -128.11 -34.47 0.54 Allowed Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.711 -0.677 . . . . 1.0 111.512 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 4.9 p -159.17 -167.72 2.15 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.051 -0.351 . . . . 1.0 110.051 -178.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.8 pp -174.49 137.06 0.48 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.283 -0.417 . . . . 1.0 110.357 -179.376 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.635 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 8.1 ptp180 -131.94 150.18 52.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 1.0 109.845 179.278 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -81.49 153.25 26.94 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.454 -0.793 . . . . 1.0 108.956 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 54.7 t -87.78 88.19 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.921 0.391 . . . . 1.0 111.309 -179.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.5 mp -137.69 134.45 45.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.084 179.335 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.446 ' OD1' ' N ' ' A' ' 172' ' ' ASP . 19.6 p-10 -103.56 -6.36 21.8 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.977 -0.556 . . . . 1.0 110.737 -179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.694 ' CG ' ' N ' ' A' ' 174' ' ' SER . 0.0 OUTLIER -95.99 -65.27 0.98 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.501 -0.555 . . . . 1.0 109.501 179.763 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 174' ' ' SER . . . . . 0.694 ' N ' ' CG ' ' A' ' 173' ' ' PHE . 68.5 m . . . . . 0 C--O 1.221 -0.416 0 CA-C-O 117.678 -1.153 . . . . 1.0 111.143 -178.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.16 -0.681 . . . . 1.0 109.16 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -80.37 174.2 54.94 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.629 -0.988 . . . . 1.0 110.629 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 mttm 179.21 103.84 0.03 OUTLIER 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.676 -0.308 . . . . 1.0 110.289 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.77 170.94 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.838 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.4 m -129.53 121.24 26.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.256 -1.016 . . . . 1.0 108.256 177.112 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.3 mt -106.6 132.79 52.2 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 114.939 -1.028 . . . . 1.0 110.238 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . 0.401 ' CG ' ' HA ' ' A' ' 12' ' ' PHE . 50.9 m-85 -114.42 130.47 56.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.355 -0.839 . . . . 1.0 111.127 -178.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.447 ' O ' ' O ' ' A' ' 32' ' ' ARG . 83.8 tt0 -55.8 -24.15 34.31 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.464 -0.789 . . . . 1.0 110.403 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -126.91 153.48 45.71 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.173 0.511 . . . . 1.0 110.221 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.6 ptt85 -56.63 -173.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.51 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.69 30.24 0.32 Allowed Glycine 0 C--N 1.333 0.408 0 N-CA-C 110.994 -0.842 . . . . 1.0 110.994 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . 0.557 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 46.38 68.94 0.53 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.472 -0.364 . . . . 1.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -126.88 -157.49 0.81 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.15 -146.9 0.26 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.972 -0.851 . . . . 1.0 110.972 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.2 mmt180 -74.54 150.13 39.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.905 0.383 . . . . 1.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -136.98 145.38 44.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.334 0.588 . . . . 1.0 110.24 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 7.1 t80 -139.89 142.78 36.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.069 -0.969 . . . . 1.0 109.893 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.511 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.1 tt0 -111.24 122.99 49.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.293 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 t -109.51 126.58 53.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.17 -0.468 . . . . 1.0 109.947 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.0 m -117.38 7.32 12.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.308 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 89.5 p -153.84 167.9 28.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.816 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . 0.443 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 51.9 p-10 -57.72 137.46 56.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.708 -0.678 . . . . 1.0 111.493 -179.455 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.03 149.25 50.11 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.619 -0.718 . . . . 1.0 110.649 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 p -116.75 -18.9 10.14 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.799 -0.637 . . . . 1.0 112.083 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . 0.451 ' OD1' ' CG ' ' A' ' 28' ' ' PRO . 2.3 t-20 -132.1 115.64 16.01 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.246 0.546 . . . . 1.0 110.503 -178.633 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.8 mp -115.39 -8.14 12.26 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.027 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.621 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 12.6 mt-30 -60.13 -41.41 84.41 Favored Pre-proline 0 CA--C 1.516 -0.358 0 C-N-CA 120.454 -0.498 . . . . 1.0 110.43 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.6 Cg_exo -58.61 -41.28 65.85 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.084 1.856 . . . . 1.0 112.112 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -92.96 -47.41 7.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.164 0.507 . . . . 1.0 111.103 -178.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.56 128.02 54.54 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.46 -0.791 . . . . 1.0 111.307 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 t -90.88 -16.31 28.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.133 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.447 ' O ' ' O ' ' A' ' 8' ' ' GLU . 43.9 ttm180 -174.5 119.84 0.24 Allowed 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.955 -0.757 . . . . 1.0 108.955 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.6 t -99.2 112.08 24.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.678 0.275 . . . . 1.0 110.644 179.283 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -106.25 -3.97 20.67 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.343 -0.39 . . . . 1.0 110.229 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.557 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.6 t -156.16 155.64 32.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.881 0.372 . . . . 1.0 110.309 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.74 155.5 37.32 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.092 -0.503 . . . . 1.0 110.786 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.0 mtt-85 -135.15 122.76 22.11 Favored 'General case' 0 C--O 1.212 -0.872 0 N-CA-C 108.953 -0.758 . . . . 1.0 108.953 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.3 t -107.99 130.08 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.156 0.503 . . . . 1.0 109.66 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -90.07 -43.21 10.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.276 -0.875 . . . . 1.0 110.635 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.2 p -161.8 164.45 28.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.725 -0.472 . . . . 1.0 109.725 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.49 175.87 41.29 Favored Glycine 0 C--N 1.316 -0.549 0 N-CA-C 111.278 -0.729 . . . . 1.0 111.278 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 97.7 m -111.69 129.63 56.04 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.484 -0.562 . . . . 1.0 109.484 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.47 145.81 43.02 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.751 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.448 ' SD ' ' O ' ' A' ' 56' ' ' TYR . 17.3 tpp -122.05 130.55 53.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.282 -0.872 . . . . 1.0 109.496 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.416 ' CD1' ' N ' ' A' ' 45' ' ' LEU . 10.1 mp -108.69 131.82 54.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.544 -0.753 . . . . 1.0 109.429 -179.598 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -111.17 132.28 54.43 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.383 0.611 . . . . 1.0 111.814 -179.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.593 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.7 pt-20 -57.08 -36.14 70.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.271 -0.877 . . . . 1.0 111.261 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.9 mt-30 -107.31 153.37 41.21 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.598 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.13 159.59 46.04 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.419 2.079 . . . . 1.0 112.045 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.658 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.92 34.66 14.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.545 -0.752 . . . . 1.0 111.388 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 54.1 76.45 0.23 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.267 -0.878 . . . . 1.0 111.439 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.1 m -146.04 154.15 41.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.077 0.465 . . . . 1.0 110.442 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.64 -148.41 21.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.031 -0.604 . . . . 1.0 111.805 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.593 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.7 tp -75.61 144.11 41.94 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.358 -0.421 . . . . 1.0 110.475 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 2.0 pt20 -119.31 153.57 34.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.549 0.214 . . . . 1.0 110.496 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.448 ' O ' ' SD ' ' A' ' 44' ' ' MET . 39.9 m-85 -125.93 123.63 38.99 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 120.821 0.344 . . . . 1.0 110.457 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.465 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 43.2 t80 -82.87 123.25 29.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.128 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 mp -120.27 145.06 47.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.248 -0.887 . . . . 1.0 110.5 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 44.8 mtp180 -132.13 157.52 44.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.103 -0.953 . . . . 1.0 110.433 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.1 ttp85 -37.54 126.67 1.11 Allowed 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.856 -0.611 . . . . 1.0 110.765 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 179.9 31.9 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.471 -1.051 . . . . 1.0 110.471 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.7 p-10 -114.34 127.68 55.98 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.984 0.421 . . . . 1.0 110.399 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . 0.456 ' O ' ' OG ' ' A' ' 35' ' ' SER . 41.3 m-85 -122.3 113.53 19.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.85 -0.614 . . . . 1.0 109.761 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.94 -4.04 55.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.282 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -146.79 139.21 24.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.516 ' C ' ' H ' ' A' ' 68' ' ' GLN . 16.2 p-80 -60.18 -42.17 94.43 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 120.987 0.423 . . . . 1.0 111.121 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.18 -7.47 0.09 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.498 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.516 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -82.17 -32.25 30.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.269 -178.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.1 p90 -97.09 16.85 18.47 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 120.807 -0.357 . . . . 1.0 110.743 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.494 ' C ' ' H ' ' A' ' 72' ' ' LEU . 78.6 mtp 73.34 29.84 1.6 Allowed 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.838 0.711 . . . . 1.0 109.857 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . 0.591 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.55 38.46 0.87 Allowed Glycine 0 C--N 1.338 0.663 0 C-N-CA 120.122 -1.037 . . . . 1.0 111.606 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . 0.505 ' C ' ' O ' ' A' ' 71' ' ' GLY . 11.7 mt -16.45 -49.13 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.357 0.663 . . . . 1.0 110.937 -178.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.591 ' N ' ' O ' ' A' ' 71' ' ' GLY . 39.5 t -102.49 117.58 35.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.428 -0.805 . . . . 1.0 109.003 177.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 48.5 p-10 -68.05 37.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.84 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.555 ' H ' ' C ' ' A' ' 73' ' ' SER . 73.3 m -116.29 125.49 52.25 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.828 -0.434 . . . . 1.0 109.828 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p -163.67 111.58 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.021 -0.733 . . . . 1.0 109.021 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -120.76 14.38 11.69 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.353 -0.385 . . . . 1.0 110.941 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 p -164.91 163.07 21.04 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.05 0.452 . . . . 1.0 110.975 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -154.87 146.24 22.99 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.638 . . . . 1.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.428 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 1.6 ptm180 -127.68 148.01 50.39 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 120.637 0.256 . . . . 1.0 110.514 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -96.0 111.37 23.4 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.846 -1.168 . . . . 1.0 107.846 177.656 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mt -57.2 110.47 2.47 Favored Pre-proline 0 C--N 1.322 -0.591 0 C-N-CA 120.247 -0.581 . . . . 1.0 110.629 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . 0.462 ' C ' ' CG ' ' A' ' 84' ' ' HIS . 37.9 Cg_endo -79.64 174.12 12.16 Favored 'Trans proline' 0 N--CA 1.49 1.316 0 C-N-CA 121.989 1.792 . . . . 1.0 111.556 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . 0.474 ' CD2' ' CD ' ' A' ' 148' ' ' PRO . 29.2 m-70 83.27 132.45 0.05 Allowed 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 112.665 0.617 . . . . 1.0 112.665 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.1 p -160.05 163.02 34.28 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.774 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.518 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . 118.25 -112.46 2.39 Favored Glycine 0 N--CA 1.465 0.568 0 N-CA-C 110.877 -0.889 . . . . 1.0 110.877 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.2 m -83.18 155.61 23.65 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.663 -0.495 . . . . 1.0 109.663 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.518 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 2.5 m80 -131.64 115.28 15.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.115 -0.234 . . . . 1.0 110.811 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 46.3 mtm-85 -143.38 134.64 25.9 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 1.0 110.017 178.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 15.7 tt -146.58 143.81 20.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.719 0.295 . . . . 1.0 110.967 -179.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -121.33 97.7 5.63 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.872 -0.604 . . . . 1.0 111.427 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.9 mt -76.56 138.29 40.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.559 . . . . 1.0 110.184 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -117.0 136.47 52.92 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 115.432 -0.803 . . . . 1.0 111.093 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.561 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -57.99 -70.28 0.14 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.135 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -96.17 174.51 6.86 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.29 0.567 . . . . 1.0 110.639 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -65.51 165.05 12.82 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.188 -0.914 . . . . 1.0 110.58 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 42.6 26.54 0.07 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.502 -0.772 . . . . 1.0 110.855 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.521 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.7 OUTLIER 64.66 26.44 13.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.064 -0.517 . . . . 1.0 111.349 178.897 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -81.55 41.99 0.66 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.193 0.52 . . . . 1.0 111.373 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -169.72 -175.22 38.63 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.025 -0.83 . . . . 1.0 111.025 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -58.01 151.22 18.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 1.0 110.332 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ptm -130.79 156.37 45.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.358 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.9 tt -150.56 142.53 16.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 N-CA-C 109.632 -0.507 . . . . 1.0 109.632 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -113.56 144.09 43.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.435 0.636 . . . . 1.0 110.81 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . 0.427 ' CZ ' ' CD2' ' A' ' 112' ' ' LEU . 78.0 m-85 -131.01 152.73 50.0 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 114.59 -1.186 . . . . 1.0 110.265 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 p -143.2 10.85 1.73 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.893 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.969 ' O ' ' O ' ' A' ' 108' ' ' ASP . 7.3 pt-20 -158.85 81.49 0.79 Allowed 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.697 -0.668 . . . . 1.0 109.788 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.969 ' O ' ' O ' ' A' ' 107' ' ' GLU . 54.6 p30 19.86 162.02 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 122.336 1.065 . . . . 1.0 113.236 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 5.9 t -144.0 106.09 4.36 Favored 'General case' 0 C--N 1.315 -0.9 0 O-C-N 120.483 -1.386 . . . . 1.0 109.712 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.471 ' O ' ' OG ' ' A' ' 166' ' ' SER . 15.6 m -68.58 -28.02 66.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.667 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 37.1 t -139.38 89.19 2.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.183 0.516 . . . . 1.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . 0.592 ' C ' ' H ' ' A' ' 114' ' ' ASP . 1.8 mt -62.29 -42.34 99.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.411 -0.813 . . . . 1.0 110.696 -179.456 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -45.98 -8.07 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.288 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.592 ' H ' ' C ' ' A' ' 112' ' ' LEU . 63.8 t0 -96.73 -23.9 16.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.175 0.512 . . . . 1.0 110.526 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' A' ' 112' ' ' LEU . 28.2 mmt180 -104.49 -40.47 6.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.495 -0.775 . . . . 1.0 112.966 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.692 ' CZ ' ' O ' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -123.62 138.72 54.49 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.362 0.601 . . . . 1.0 109.8 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 118' ' ' PHE . 90.6 mtt180 -71.86 -74.06 0.17 Allowed 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.594 -0.691 . . . . 1.0 111.308 -177.17 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.692 ' O ' ' CZ ' ' A' ' 116' ' ' PHE . 72.4 m-85 -29.56 146.23 0.01 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 O-C-N 123.975 0.797 . . . . 1.0 110.413 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -106.47 13.18 28.79 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.041 0.448 . . . . 1.0 111.155 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -141.73 140.53 33.14 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.912 -0.585 . . . . 1.0 111.113 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.7 mm -120.74 117.12 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 115.38 -0.827 . . . . 1.0 109.036 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . 0.471 ' O ' ' CB ' ' A' ' 123' ' ' SER . 38.3 m-70 -108.53 30.16 6.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.914 -0.584 . . . . 1.0 111.395 -178.357 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.471 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.5 p 162.06 152.49 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.034 0.445 . . . . 1.0 110.103 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 pp -163.32 157.71 20.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 1.0 110.149 -178.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.75 116.21 21.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.965 0.412 . . . . 1.0 109.999 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 24.0 t -102.78 104.82 17.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 115.818 -0.628 . . . . 1.0 109.704 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.58 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.4 OUTLIER -78.33 -38.66 41.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.633 -0.712 . . . . 1.0 111.433 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -141.59 155.95 45.72 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 120.536 -0.465 . . . . 1.0 110.757 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.96 -175.03 0.14 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 110.475 -1.05 . . . . 1.0 110.475 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.526 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.9 OUTLIER -116.32 178.53 4.29 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.099 -0.704 . . . . 1.0 109.099 178.856 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.526 ' CD1' ' C ' ' A' ' 130' ' ' SER . 69.7 m95 -148.86 162.87 38.96 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.286 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 24.0 t -136.25 105.53 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.577 -0.283 . . . . 1.0 111.105 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 26.5 mt -77.06 143.0 39.59 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.947 -0.301 . . . . 1.0 110.266 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . 0.52 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 37.8 m-85 -119.29 133.24 55.84 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.68 0.276 . . . . 1.0 110.538 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -43.47 -46.86 7.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.531 -0.304 . . . . 1.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.9 165.91 21.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.062 0.458 . . . . 1.0 110.011 -178.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 137' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 4.1 t -69.71 174.78 4.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.768 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . 0.491 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.7 t30 63.39 18.78 11.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.046 -0.979 . . . . 1.0 109.752 -178.931 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 37.42 74.87 0.07 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.163 -0.471 . . . . 1.0 111.318 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 45.3 mmt-85 -144.2 40.38 1.35 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.872 0.368 . . . . 1.0 110.09 179.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.69 -146.82 4.42 Favored Glycine 0 N--CA 1.462 0.399 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -178.477 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -70.74 171.16 10.97 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.182 -0.303 . . . . 1.0 110.182 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.55 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 5.7 pt20 -149.29 135.48 19.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.203 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . 0.411 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 8.6 m-85 -130.15 124.03 31.71 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.757 -0.461 . . . . 1.0 109.757 179.275 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 42.7 tp -79.9 127.47 32.29 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.025 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 30.0 mt -117.47 107.86 14.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.42 -0.809 . . . . 1.0 110.5 179.785 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.428 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.3 OUTLIER -80.67 171.52 12.11 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.794 -179.589 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . 0.474 ' CD ' ' CD2' ' A' ' 84' ' ' HIS . 13.7 Cg_exo -67.45 115.7 3.84 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.225 1.95 . . . . 1.0 111.422 179.132 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 177.85 -152.26 11.61 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.621 -0.992 . . . . 1.0 110.621 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.459 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.3 p-10 -127.75 125.2 39.48 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.193 0.521 . . . . 1.0 110.603 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 12.2 m-85 -115.91 127.69 55.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.823 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -114.15 -3.07 13.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.827 0.346 . . . . 1.0 110.762 -179.262 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -157.23 164.45 37.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.732 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . 0.551 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.1 OUTLIER -75.57 -20.76 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.031 -0.986 . . . . 1.0 111.978 -178.547 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -65.55 -21.82 66.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.226 -0.443 . . . . 1.0 111.041 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -48.14 -51.24 25.69 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.029 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . 0.493 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.4 p90 -99.61 19.71 15.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.938 0.399 . . . . 1.0 110.258 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.0 74.36 0.3 Allowed Glycine 0 CA--C 1.518 0.243 0 N-CA-C 111.249 -0.741 . . . . 1.0 111.249 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . 0.493 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.22 -171.13 2.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 1.0 110.233 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 12.6 t -123.15 -33.67 3.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.144 -0.935 . . . . 1.0 111.573 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.553 ' ND2' ' O ' ' A' ' 161' ' ' ASN . 0.8 OUTLIER -149.43 -15.89 0.28 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.757 0.313 . . . . 1.0 111.646 -178.953 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.518 ' CB ' ' O ' ' A' ' 161' ' ' ASN . . . 89.49 -21.71 0.13 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.48 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -42.02 124.49 2.7 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.674 -0.694 . . . . 1.0 110.748 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 24.8 t -120.73 160.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.713 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -138.17 -35.08 0.17 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.282 -0.727 . . . . 1.0 111.282 -179.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.471 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -162.06 172.06 16.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.01 0.433 . . . . 1.0 110.577 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -154.4 144.17 21.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.325 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.52 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 12.5 ptp180 -134.6 150.3 50.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.268 0.556 . . . . 1.0 110.27 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.522 ' NH2' ' OG ' ' A' ' 174' ' ' SER . 0.0 OUTLIER -76.88 147.69 36.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.146 -0.934 . . . . 1.0 108.698 177.143 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 27.6 m -86.33 68.44 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.934 -0.575 . . . . 1.0 112.384 -178.102 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.3 mp -127.18 128.25 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 121.173 0.511 . . . . 1.0 109.913 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . 0.542 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 46.2 p-10 -65.08 -34.98 79.7 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.676 -0.693 . . . . 1.0 110.386 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . 0.542 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 88.6 m-85 -66.41 176.26 1.92 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.598 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 174' ' ' SER . . . . . 0.522 ' OG ' ' NH2' ' A' ' 169' ' ' ARG . 4.7 p . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.01 -0.995 . . . . 1.0 110.462 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 109.441 -0.577 . . . . 1.0 109.441 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -176.74 178.93 47.95 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.435 -1.066 . . . . 1.0 110.435 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.2 tttt -172.99 106.82 0.15 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.778 -0.369 . . . . 1.0 110.141 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.452 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.91 169.16 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.346 0.594 . . . . 1.0 111.647 -179.771 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 62.3 m -125.07 121.73 35.15 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.35 -0.982 . . . . 1.0 108.35 177.398 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.2 134.2 50.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.176 -0.92 . . . . 1.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TYR . . . . . . . . . . . . . 86.0 m-85 -114.53 129.73 56.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.036 -178.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.451 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 80.5 tt0 -55.62 -20.78 14.91 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.571 -0.741 . . . . 1.0 109.894 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -126.93 163.2 24.19 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.399 0.618 . . . . 1.0 111.0 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -67.82 179.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.0 111.37 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.59 25.98 7.11 Favored Glycine 0 C--N 1.335 0.518 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 51.7 66.02 1.32 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -128.51 -155.06 0.68 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.945 0.402 . . . . 1.0 110.535 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.07 -153.62 0.08 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.012 -0.835 . . . . 1.0 111.012 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -68.62 148.08 50.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.688 0.28 . . . . 1.0 110.75 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -135.46 151.32 50.29 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.418 0.628 . . . . 1.0 110.683 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.3 t80 -147.29 141.64 26.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.975 -1.011 . . . . 1.0 109.682 -179.344 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.8 tt0 -110.07 121.4 45.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.517 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.5 t -107.18 126.0 51.83 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.954 0.407 . . . . 1.0 110.891 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.5 m -118.72 13.22 13.24 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.755 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 49.8 m -158.03 169.49 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.421 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -61.03 136.41 58.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.029 -0.532 . . . . 1.0 111.457 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' HIS . . . . . 0.465 ' C ' ' HH ' ' A' ' 51' ' ' TYR . 0.1 OUTLIER -133.34 150.22 51.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.576 -179.87 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.7 p -117.05 -13.85 10.58 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.084 0.772 . . . . 1.0 113.084 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -152.01 109.43 3.59 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.127 -0.629 . . . . 1.0 111.618 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.3 mp -100.39 -1.76 35.18 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.052 -0.976 . . . . 1.0 110.336 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.576 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 28.5 mt-30 -51.85 -49.96 80.64 Favored Pre-proline 0 C--N 1.327 -0.409 0 C-N-CA 120.368 -0.533 . . . . 1.0 111.04 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' PRO . . . . . 0.576 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 19.6 Cg_endo -57.88 -33.55 97.18 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 121.52 1.48 . . . . 1.0 112.414 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -95.39 -51.48 4.56 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 111.131 -178.09 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LEU . . . . . 0.417 ' N ' ' O ' ' A' ' 26' ' ' LEU . 11.1 mt -121.32 129.94 53.37 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.032 -0.531 . . . . 1.0 111.327 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -93.7 -9.23 38.46 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.177 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 62.3 ttp180 -179.1 119.29 0.07 Allowed 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 108.637 -0.875 . . . . 1.0 108.637 -179.089 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.6 t -100.95 113.41 26.37 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.739 0.304 . . . . 1.0 110.289 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -105.5 -5.3 20.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.888 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.1 p -156.61 158.26 36.75 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.686 -0.406 . . . . 1.0 110.863 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.6 155.05 34.02 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.347 0.594 . . . . 1.0 112.036 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.7 mtt180 -136.47 122.45 20.15 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.207 -0.906 . . . . 1.0 108.838 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' VAL . . . . . 0.478 HG11 ' H ' ' A' ' 61' ' ' GLY . 1.2 p -110.29 123.17 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.973 0.416 . . . . 1.0 110.016 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -77.19 -45.06 27.92 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.985 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.5 p -159.8 162.87 34.88 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.74 -0.837 . . . . 1.0 108.74 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 173.1 46.01 Favored Glycine 0 C--N 1.314 -0.671 0 N-CA-C 110.253 -1.139 . . . . 1.0 110.253 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.78 142.98 43.45 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.714 -0.847 . . . . 1.0 108.714 178.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' TRP . . . . . 0.452 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 56.4 m95 -130.88 155.56 46.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.455 0.645 . . . . 1.0 111.206 -178.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' MET . . . . . 0.493 ' SD ' ' HB2' ' A' ' 145' ' ' LEU . 9.2 ttm -130.68 131.48 44.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.036 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.41 ' CD2' ' N ' ' A' ' 45' ' ' LEU . 0.3 OUTLIER -107.97 137.45 45.94 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.114 -0.699 . . . . 1.0 109.114 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -113.68 132.18 55.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.178 0.513 . . . . 1.0 110.925 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.593 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.3 pt-20 -60.9 -35.67 77.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.643 -0.708 . . . . 1.0 111.237 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.77 151.66 42.46 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.445 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . 0.421 ' O ' ' OG ' ' A' ' 52' ' ' SER . 42.1 Cg_endo -64.01 158.21 48.83 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.69 2.26 . . . . 1.0 113.533 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.655 ' N ' HD21 ' A' ' 50' ' ' ASN . 0.8 OUTLIER 63.82 36.24 10.56 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.091 -0.959 . . . . 1.0 111.626 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.465 ' HH ' ' C ' ' A' ' 23' ' ' HIS . 4.1 m-85 52.5 72.67 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.995 -1.002 . . . . 1.0 110.852 179.501 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 49' ' ' PRO . 5.1 p -142.41 159.64 41.83 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 116.004 -0.544 . . . . 1.0 109.679 -178.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.6 -149.15 24.32 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.728 -0.749 . . . . 1.0 112.261 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LEU . . . . . 0.593 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.5 tp -77.8 140.95 39.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.807 -0.697 . . . . 1.0 110.244 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . 0.491 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 13.9 pt20 -120.53 149.31 42.62 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 117.803 0.274 . . . . 1.0 110.663 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -128.49 129.88 46.71 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.622 -0.263 . . . . 1.0 111.276 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' PHE . . . . . 0.427 ' H ' ' NE2' ' A' ' 143' ' ' GLN . 67.6 t80 -82.66 123.52 29.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.506 0.67 . . . . 1.0 110.597 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -110.08 134.5 52.09 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.809 -1.087 . . . . 1.0 108.5 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 60' ' ' ARG . 37.8 ttp180 -130.03 151.68 50.31 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 59' ' ' ARG . 78.0 ttt-85 -34.66 125.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.167 -0.47 . . . . 1.0 111.769 -178.113 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLY . . . . . 0.478 ' H ' HG11 ' A' ' 38' ' ' VAL . . . 152.48 -175.29 31.16 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.221 -1.152 . . . . 1.0 110.221 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 49.5 p-10 -117.32 131.29 56.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.182 0.515 . . . . 1.0 111.106 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -125.27 115.14 19.91 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.102 -0.703 . . . . 1.0 109.102 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . 0.439 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -95.51 -5.06 43.72 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.764 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 90.6 m-20 -145.76 136.04 23.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.674 -0.861 . . . . 1.0 108.674 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' HIS . . . . . 0.475 ' C ' ' H ' ' A' ' 68' ' ' GLN . 6.0 p80 -56.06 -42.64 76.95 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.074 -0.65 . . . . 1.0 110.918 -178.817 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -50.17 -8.89 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.566 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLN . . . . . 0.475 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -85.05 -34.06 22.36 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.336 -0.546 . . . . 1.0 110.983 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' TRP . . . . . 0.4 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -91.91 20.5 5.66 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.32 -0.552 . . . . 1.0 110.873 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' MET . . . . . 0.4 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 43.0 mtt 81.22 12.25 0.76 Allowed 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 123.772 0.67 . . . . 1.0 109.665 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -55.67 97.02 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.962 -0.855 . . . . 1.0 110.962 179.174 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 26.2 mt -69.88 -36.23 75.29 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.22 -0.659 . . . . 1.0 109.22 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.515 ' C ' ' H ' ' A' ' 75' ' ' SER . 46.6 t -130.33 128.46 41.53 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.017 178.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -69.15 40.68 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.221 -0.445 . . . . 1.0 111.21 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.515 ' H ' ' C ' ' A' ' 73' ' ' SER . 66.2 m -115.2 123.31 48.55 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.154 -0.684 . . . . 1.0 109.154 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 61.8 t -152.43 104.61 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.435 -0.58 . . . . 1.0 109.435 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 85.3 mtm-85 -114.73 6.68 15.67 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.685 0.254 . . . . 1.0 111.685 -179.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -164.44 163.42 22.24 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.153 -0.619 . . . . 1.0 111.127 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 28.1 p -158.4 149.11 20.39 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.709 -0.678 . . . . 1.0 111.037 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -128.2 150.52 49.98 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.742 0.306 . . . . 1.0 110.208 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LEU . . . . . 0.443 ' HG ' ' CE2' ' A' ' 43' ' ' TRP . 4.3 tt -101.2 124.76 47.41 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.339 -0.986 . . . . 1.0 108.339 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ILE . . . . . 0.427 HG22 HD12 ' A' ' 82' ' ' ILE . 3.2 mt -86.03 114.33 56.56 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 116.1 -0.5 . . . . 1.0 110.577 -178.246 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -51.89 150.1 18.67 Favored 'Trans proline' 0 N--CA 1.498 1.772 0 C-N-CA 121.844 1.696 . . . . 1.0 112.274 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -50.44 157.08 0.76 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.849 -0.614 . . . . 1.0 109.545 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' SER . . . . . 0.572 ' HG ' ' H ' ' A' ' 130' ' ' SER . 0.4 OUTLIER -97.19 -61.76 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.105 0.409 . . . . 1.0 112.105 -179.053 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLY . . . . . 0.546 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . 74.64 -96.47 0.94 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 109.176 -1.57 . . . . 1.0 109.176 -178.264 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.8 m -83.85 140.76 31.8 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.379 -0.601 . . . . 1.0 109.379 177.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.572 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 1.9 m170 -129.69 107.69 9.62 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.068 0.395 . . . . 1.0 112.068 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 57.3 ttp180 -138.21 127.61 24.69 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.468 -0.567 . . . . 1.0 109.468 177.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.3 tt -145.85 145.11 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-O 120.758 0.313 . . . . 1.0 111.286 -179.45 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' ARG . . . . . 0.627 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.2 mtp180 -122.69 98.69 6.03 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.773 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.27 139.06 36.83 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.522 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' TYR . . . . . 0.441 ' CE1' ' CB ' ' A' ' 98' ' ' TYR . 78.7 m-85 -115.0 134.05 55.52 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.121 -0.491 . . . . 1.0 111.141 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' GLU . . . . . 0.558 ' OE1' ' CZ ' ' A' ' 118' ' ' PHE . 20.1 pt-20 -54.33 -41.3 68.88 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.496 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ARG . . . . . 0.49 ' O ' ' OG ' ' A' ' 123' ' ' SER . 9.9 mtt-85 -121.88 168.24 12.1 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.011 -0.541 . . . . 1.0 110.846 -178.063 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -45.75 154.56 0.21 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.448 0.642 . . . . 1.0 111.034 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.9 -96.83 0.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.984 -1.007 . . . . 1.0 109.432 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' TYR . . . . . 0.441 ' CB ' ' CE1' ' A' ' 93' ' ' TYR . 4.9 p90 -172.11 31.48 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 119.854 -0.739 . . . . 1.0 109.471 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 -83.41 39.02 0.64 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.158 -0.928 . . . . 1.0 112.173 -177.022 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -166.97 -161.16 15.45 Favored Glycine 0 CA--C 1.527 0.808 0 CA-C-N 115.585 -0.734 . . . . 1.0 111.403 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLN . . . . . 0.545 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 67.4 tp60 -65.01 146.78 54.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.071 0.463 . . . . 1.0 110.987 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' MET . . . . . 0.627 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 10.8 ttp -129.92 152.53 49.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.49 -0.777 . . . . 1.0 110.439 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ILE . . . . . 0.45 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.7 tt -145.01 137.54 21.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 108.459 -0.941 . . . . 1.0 108.459 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 78.0 tt0 -111.78 141.75 45.0 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.449 0.642 . . . . 1.0 110.737 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -127.44 148.88 50.3 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 114.868 -1.06 . . . . 1.0 110.533 -179.632 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.6 p -139.81 16.67 2.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.704 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.0 OUTLIER -149.41 -174.95 4.81 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.526 -0.47 . . . . 1.0 110.293 178.961 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 52.0 p-10 -74.33 141.49 45.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.335 -0.393 . . . . 1.0 111.165 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' CYS . . . . . 0.452 ' O ' ' OH ' ' A' ' 139' ' ' TYR . 0.8 OUTLIER -133.07 116.52 16.44 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.324 179.625 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' SER . . . . . 0.429 ' O ' ' OG ' ' A' ' 166' ' ' SER . 83.5 p -90.97 -21.64 21.21 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.921 0.391 . . . . 1.0 110.911 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 38.5 m -146.4 94.54 2.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.406 0.622 . . . . 1.0 109.867 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.59 -39.54 88.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.821 -1.081 . . . . 1.0 110.673 -178.467 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . 0.542 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 11.4 mp0 -49.09 -12.75 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.736 0.643 . . . . 1.0 112.736 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' A' ' 114' ' ' ASP . 61.6 t0 -88.87 -10.42 48.03 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.909 -0.774 . . . . 1.0 108.909 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -118.85 -39.52 2.95 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 114.22 1.193 . . . . 1.0 114.22 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' PHE . . . . . 0.623 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.08 135.2 53.4 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 122.523 1.154 . . . . 1.0 112.467 -178.898 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.13 -68.27 0.37 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.111 -0.949 . . . . 1.0 111.022 -177.788 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.59 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 65.9 m-85 -42.91 141.62 1.07 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.406 -0.816 . . . . 1.0 109.61 -179.788 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -101.15 5.7 42.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.928 0.394 . . . . 1.0 110.269 -179.353 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -134.46 139.13 45.29 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.461 0.648 . . . . 1.0 111.344 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 121' ' ' ILE . . . . . 0.4 ' O ' ' CB ' ' A' ' 162' ' ' ALA . 45.9 mm -119.5 123.39 71.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.853 -1.067 . . . . 1.0 108.895 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -115.08 15.72 17.11 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 111.9 0.333 . . . . 1.0 111.9 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 123' ' ' SER . . . . . 0.49 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 5.7 p 176.93 149.97 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.212 -0.662 . . . . 1.0 109.212 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.1 pp -159.97 156.54 27.3 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.569 -0.742 . . . . 1.0 109.856 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.21 109.31 13.25 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.194 -179.582 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 4.1 t -96.4 103.95 15.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 109.171 -0.677 . . . . 1.0 109.171 178.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 127' ' ' LEU . . . . . 0.44 ' H ' ' CD2' ' A' ' 127' ' ' LEU . 0.7 OUTLIER -74.03 -36.87 64.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.562 179.578 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 128' ' ' GLU . . . . . 0.409 ' O ' ' O ' ' A' ' 129' ' ' GLY . 21.4 pt-20 -151.55 168.58 24.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.734 -0.666 . . . . 1.0 111.007 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 129' ' ' GLY . . . . . 0.409 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 54.41 167.79 0.03 OUTLIER Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.746 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 130' ' ' SER . . . . . 0.572 ' H ' ' HG ' ' A' ' 85' ' ' SER . 70.5 m -113.99 145.06 42.08 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.15 -0.685 . . . . 1.0 109.15 178.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 131' ' ' TRP . . . . . 0.469 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 30.3 m95 -120.52 162.24 19.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.474 -0.785 . . . . 1.0 110.64 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 16.3 t -137.03 93.04 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.749 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 26.5 mt -66.09 146.15 55.0 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.21 -178.136 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 134' ' ' TYR . . . . . 0.583 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 60.1 m-85 -121.54 136.43 54.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.793 0.33 . . . . 1.0 111.071 178.779 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -48.39 -40.69 26.59 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.33 -0.395 . . . . 1.0 111.037 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 136' ' ' LEU . . . . . 0.417 ' C ' ' CD1' ' A' ' 136' ' ' LEU . 0.4 OUTLIER -133.13 176.57 8.39 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.273 0.559 . . . . 1.0 111.069 -179.46 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.8 p -80.62 169.7 17.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.488 -0.778 . . . . 1.0 111.628 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 42.9 t30 64.98 15.51 10.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.888 -1.051 . . . . 1.0 110.614 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 139' ' ' TYR . . . . . 0.452 ' OH ' ' O ' ' A' ' 109' ' ' CYS . 7.3 m-85 42.26 79.32 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 1.0 112.536 179.111 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 94.1 mtt-85 -147.39 35.45 0.88 Allowed 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.768 0.318 . . . . 1.0 110.934 178.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -147.11 -142.52 3.71 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.559 -0.616 . . . . 1.0 111.559 -178.72 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -77.1 167.1 22.37 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 110.119 -0.326 . . . . 1.0 110.119 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 143' ' ' GLN . . . . . 0.427 ' NE2' ' H ' ' A' ' 57' ' ' PHE . 1.8 pt20 -143.31 138.1 29.28 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.126 -178.878 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -128.99 123.05 31.39 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.065 0.393 . . . . 1.0 110.304 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 145' ' ' LEU . . . . . 0.493 ' HB2' ' SD ' ' A' ' 44' ' ' MET . 0.7 OUTLIER -78.74 126.97 31.44 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.435 -0.802 . . . . 1.0 112.345 -178.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 146' ' ' LEU . . . . . . . . . . . . . 40.0 mt -116.69 102.45 9.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.418 178.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 147' ' ' MET . . . . . 0.624 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -79.36 160.69 69.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 109.121 -0.696 . . . . 1.0 109.121 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -56.97 113.83 1.65 Allowed 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.888 1.726 . . . . 1.0 111.209 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.92 -153.91 15.95 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 110.539 -1.024 . . . . 1.0 110.539 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 150' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 53.6 p-10 -123.42 141.72 51.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.999 0.428 . . . . 1.0 110.614 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 151' ' ' TYR . . . . . 0.531 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.5 m-85 -133.17 129.32 37.65 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.952 -0.567 . . . . 1.0 109.837 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -118.27 -0.58 11.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.649 0.262 . . . . 1.0 110.331 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 153' ' ' ARG . . . . . 0.686 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.3 ptm180 -157.42 158.58 36.12 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.279 0.561 . . . . 1.0 110.36 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -74.16 -22.48 59.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 1.0 112.651 -177.552 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 155' ' ' GLN . . . . . 0.686 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.7 mt-30 -68.32 -18.84 64.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.48 -179.275 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 156' ' ' ASP . . . . . 0.531 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 58.6 t0 -54.17 -47.82 71.58 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.976 -0.289 . . . . 1.0 110.691 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 157' ' ' TRP . . . . . . . . . . . . . 24.3 p90 -92.44 21.17 5.51 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 178.206 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.1 74.32 0.31 Allowed Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.931 -0.868 . . . . 1.0 110.931 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -118.45 153.66 33.74 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.922 0.868 . . . . 1.0 111.677 -179.261 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -81.8 -17.24 48.25 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.749 -1.569 . . . . 1.0 110.141 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 161' ' ' ASN . . . . . 0.484 ' ND2' ' H ' ' A' ' 162' ' ' ALA . 2.9 t30 -168.51 -171.38 1.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.821 -0.352 . . . . 1.0 110.351 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 162' ' ' ALA . . . . . 0.484 ' H ' ' ND2' ' A' ' 161' ' ' ASN . . . -108.58 -4.95 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 1.0 110.896 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -50.93 116.15 1.85 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 120.631 0.253 . . . . 1.0 111.317 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 77.6 t -128.35 133.69 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.495 -0.557 . . . . 1.0 109.495 178.067 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 165' ' ' GLY . . . . . 0.408 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -110.38 -28.41 4.07 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.017 -0.433 . . . . 1.0 112.017 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 166' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 110' ' ' SER . 32.0 m -158.67 -168.56 2.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.731 0.3 . . . . 1.0 110.367 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.33 139.58 0.61 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.464 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 168' ' ' ARG . . . . . 0.583 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 8.8 ptp180 -129.68 154.2 47.38 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.675 -0.491 . . . . 1.0 109.675 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 169' ' ' ARG . . . . . 0.572 ' NH1' ' ND1' ' A' ' 88' ' ' HIS . 0.0 OUTLIER -88.46 145.08 25.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.933 -0.766 . . . . 1.0 108.933 178.742 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 57.3 t -77.26 84.74 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.069 0.462 . . . . 1.0 110.862 -178.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 1.3 mp -112.08 131.04 64.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.739 -0.664 . . . . 1.0 109.577 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -65.75 -35.09 79.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.809 -0.632 . . . . 1.0 110.917 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -61.19 -79.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.804 0.335 . . . . 1.0 110.539 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.065 -0.969 . . . . 1.0 110.694 179.794 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.627 0 N-CA-C 110.507 -1.037 . . . . 1.0 110.507 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -167.66 107.63 0.57 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.008 -0.277 . . . . 1.0 110.604 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.456 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.23 168.83 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.229 0.538 . . . . 1.0 111.206 -179.128 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' CE1' ' A' ' 7' ' ' TYR . 33.0 m -126.24 121.18 31.97 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 107.806 -1.183 . . . . 1.0 107.806 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.1 mt -106.59 134.72 49.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.008 -0.996 . . . . 1.0 110.117 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.476 ' CE1' HG22 ' A' ' 5' ' ' THR . 72.8 m-85 -117.18 128.25 54.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.631 -0.713 . . . . 1.0 111.461 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -53.05 -31.87 43.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.701 -0.681 . . . . 1.0 110.301 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -115.97 160.41 20.3 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.246 0.546 . . . . 1.0 110.774 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -63.76 -173.78 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 1.0 111.047 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.89 26.69 0.48 Allowed Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.765 -0.934 . . . . 1.0 110.765 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 50.29 70.41 0.51 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.147 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -133.69 -159.63 0.98 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.915 0.388 . . . . 1.0 110.378 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.16 -150.77 0.97 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.754 -0.938 . . . . 1.0 110.754 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -68.44 145.56 53.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.738 0.304 . . . . 1.0 110.822 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -135.59 151.84 50.67 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 121.288 0.566 . . . . 1.0 110.457 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -146.24 141.38 27.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.252 -0.886 . . . . 1.0 109.995 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 73.4 tt0 -110.22 121.24 44.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.317 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.57 127.05 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.973 0.416 . . . . 1.0 111.043 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 p -117.15 10.08 13.75 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.731 -0.668 . . . . 1.0 110.589 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.0 t -155.38 166.21 34.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.969 -0.56 . . . . 1.0 110.488 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -57.74 140.18 52.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.659 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.51 146.86 48.54 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.743 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.1 p -114.87 -14.98 11.89 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.787 -0.642 . . . . 1.0 112.17 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -150.87 111.08 4.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.216 0.532 . . . . 1.0 110.352 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 24.7 mt -111.43 0.96 16.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.304 -0.862 . . . . 1.0 110.278 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.607 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 20.4 mt-30 -51.65 -48.22 87.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.009 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 24.5 Cg_endo -57.22 -33.08 95.34 Favored 'Trans proline' 0 N--CA 1.491 1.37 0 C-N-CA 121.322 1.348 . . . . 1.0 112.239 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.17 -50.61 5.2 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.427 -0.509 . . . . 1.0 110.952 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.25 128.81 54.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.872 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.7 t -95.55 -8.2 35.77 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.842 -0.617 . . . . 1.0 111.631 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -145.0 -70.82 0.27 Allowed 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 112.427 0.528 . . . . 1.0 112.427 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.5 t 76.69 71.68 0.07 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 122.757 0.423 . . . . 1.0 110.325 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -92.76 3.0 56.44 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.609 -0.269 . . . . 1.0 111.378 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.2 p -156.64 158.78 37.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.937 0.399 . . . . 1.0 110.181 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -156.25 153.84 29.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 1.0 111.495 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.5 mtp180 -131.94 122.45 25.63 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 108.771 -0.825 . . . . 1.0 108.771 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.69 110.83 33.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.254 0.55 . . . . 1.0 109.96 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -73.77 -43.5 58.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.296 -0.865 . . . . 1.0 110.851 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 95.7 p -160.83 160.34 30.99 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.761 -0.829 . . . . 1.0 108.761 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.05 168.29 42.8 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 111.158 -0.777 . . . . 1.0 111.158 179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 171' ' ' ILE . 64.7 m -110.28 124.55 51.85 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.919 -0.771 . . . . 1.0 108.919 178.159 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 57.0 m95 -115.28 152.42 32.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.613 0.721 . . . . 1.0 111.616 -178.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.518 ' C ' HD12 ' A' ' 45' ' ' LEU . 2.1 ttt -127.72 133.92 49.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.713 -1.131 . . . . 1.0 109.021 177.32 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.518 HD12 ' C ' ' A' ' 44' ' ' MET . 8.9 mp -109.96 134.83 51.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.882 -1.054 . . . . 1.0 110.092 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -111.49 133.45 53.77 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.343 0.592 . . . . 1.0 111.378 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.569 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.3 pt-20 -60.4 -37.11 79.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.306 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -105.37 153.8 39.44 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.123 -0.944 . . . . 1.0 111.256 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.93 152.51 80.25 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.776 2.318 . . . . 1.0 112.818 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.448 ' C ' ' CD1' ' A' ' 51' ' ' TYR . 7.0 m120 60.71 32.54 20.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.237 -0.892 . . . . 1.0 110.955 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.448 ' CD1' ' C ' ' A' ' 50' ' ' ASN . 0.1 OUTLIER 46.6 65.07 1.29 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.171 -0.922 . . . . 1.0 109.65 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.7 m -123.2 17.44 9.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.435 -0.802 . . . . 1.0 111.798 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -142.05 -154.28 6.13 Favored Glycine 0 N--CA 1.46 0.289 0 C-N-CA 120.687 -0.768 . . . . 1.0 111.572 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.569 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.0 tp -63.48 152.44 38.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.338 -0.431 . . . . 1.0 109.88 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.422 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 9.7 pt20 -123.72 149.28 45.73 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.646 0.26 . . . . 1.0 111.298 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -125.99 122.9 37.22 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.16 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.411 ' C ' HD12 ' A' ' 58' ' ' LEU . 76.8 t80 -82.9 122.38 28.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.084 0.469 . . . . 1.0 110.139 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.411 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.6 mp -118.21 147.46 43.36 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.712 -0.676 . . . . 1.0 109.521 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' ' C ' ' A' ' 60' ' ' ARG . 5.3 ptm180 -136.39 161.82 34.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.723 -0.671 . . . . 1.0 109.897 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.404 ' C ' ' O ' ' A' ' 59' ' ' ARG . 62.3 ttp180 -38.49 124.73 1.32 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.766 0.317 . . . . 1.0 110.75 -178.068 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.6 -178.65 32.08 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.702 -0.959 . . . . 1.0 110.702 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -115.84 131.52 56.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.888 0.375 . . . . 1.0 110.491 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -125.09 113.4 17.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.419 -0.585 . . . . 1.0 109.419 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.48 -1.87 55.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.275 -0.421 . . . . 1.0 111.914 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -148.11 146.76 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.189 -1.041 . . . . 1.0 108.189 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.481 ' C ' ' H ' ' A' ' 68' ' ' GLN . 8.7 p-80 -66.13 -45.61 80.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.047 0.451 . . . . 1.0 111.296 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -49.5 -9.86 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.741 -0.663 . . . . 1.0 110.93 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.481 ' H ' ' C ' ' A' ' 66' ' ' HIS . 14.7 mm-40 -81.46 -37.38 28.09 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 120.481 -0.487 . . . . 1.0 111.007 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.453 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -87.89 18.82 3.88 Favored 'General case' 0 CA--C 1.509 -0.62 0 C-N-CA 120.323 -0.551 . . . . 1.0 111.244 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.55 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 63.8 mtp 80.52 19.16 0.54 Allowed 'General case' 0 CA--C 1.521 -0.138 0 O-C-N 123.929 0.768 . . . . 1.0 109.833 -178.505 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.697 0 N-CA-C 110.431 -1.067 . . . . 1.0 110.431 178.911 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 108.491 -0.929 . . . . 1.0 108.491 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -117.76 7.89 12.59 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 121.015 -0.274 . . . . 1.0 110.978 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.6 p -162.49 162.82 27.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 1.0 110.543 178.802 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 14.2 p -156.27 147.57 22.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.486 -0.779 . . . . 1.0 110.426 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -126.93 151.44 48.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.912 0.386 . . . . 1.0 110.241 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 17.8 tp -97.45 126.86 42.97 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 177.725 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 28.7 mt -83.34 113.8 48.87 Favored Pre-proline 0 CA--C 1.538 0.5 0 C-N-CA 120.807 -0.357 . . . . 1.0 111.337 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo . . . . . 0 N--CA 1.491 1.371 0 C-N-CA 121.811 1.674 . . . . 1.0 111.581 179.141 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 CA--C 1.524 -0.044 0 N-CA-C 109.923 -0.399 . . . . 1.0 109.923 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.652 ' NE2' HD11 ' A' ' 171' ' ' ILE . 12.6 m80 -128.19 97.15 4.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 121.104 -0.238 . . . . 1.0 111.258 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -131.59 136.41 47.76 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 120.631 -0.428 . . . . 1.0 110.647 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.514 HG22 ' CZ2' ' A' ' 131' ' ' TRP . 18.4 tt -148.21 141.53 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-O 120.895 0.379 . . . . 1.0 111.486 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -119.28 98.06 5.97 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.838 -0.619 . . . . 1.0 111.511 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.9 139.82 40.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.203 0.525 . . . . 1.0 110.171 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.587 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 55.1 m-85 -119.84 137.44 53.99 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.984 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.527 ' OE2' ' CD1' ' A' ' 118' ' ' PHE . 1.8 tm-20 -56.32 -66.52 0.42 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.722 -0.672 . . . . 1.0 111.446 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.441 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.2 mtp85 -97.25 167.83 10.79 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.272 0.558 . . . . 1.0 111.715 -177.89 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 . . . . . 0 N--CA 1.461 0.113 0 CA-C-N 115.229 -0.896 . . . . 1.0 111.558 179.587 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.777 0 N-CA-C 110.891 -0.883 . . . . 1.0 110.891 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -62.97 144.12 57.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 1.0 110.81 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.587 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 6.3 ttp -131.67 148.08 52.56 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 116.345 -0.389 . . . . 1.0 111.013 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.52 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.4 tt -141.14 140.93 31.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.484 0 N-CA-C 109.464 -0.569 . . . . 1.0 109.464 177.785 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.68 137.73 50.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.639 0.733 . . . . 1.0 110.895 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.55 155.68 37.15 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.422 -1.263 . . . . 1.0 110.222 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 16.7 p -143.07 25.98 1.71 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.018 -0.537 . . . . 1.0 110.344 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -166.5 -166.86 0.91 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.842 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -76.09 141.99 41.85 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.111 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.9 m -130.6 92.56 3.27 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.079 -0.51 . . . . 1.0 109.998 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.51 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.3 m -68.48 -32.12 71.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.7 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -133.55 93.32 3.12 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.325 0.583 . . . . 1.0 110.479 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.485 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.7 tp -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.232 -0.895 . . . . 1.0 110.363 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -47.73 -9.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.697 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.485 ' H ' ' C ' ' A' ' 112' ' ' LEU . 92.5 m-20 -96.4 -25.31 15.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.035 0.445 . . . . 1.0 110.407 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -108.28 -39.96 5.31 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.662 -0.699 . . . . 1.0 111.704 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.52 ' CD1' HG21 ' A' ' 103' ' ' ILE . 3.6 t80 -124.81 122.07 36.39 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.629 -0.508 . . . . 1.0 109.629 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 78.2 mtt-85 -60.69 -56.07 25.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.641 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.527 ' CD1' ' OE2' ' A' ' 94' ' ' GLU . 95.2 m-85 -46.73 140.04 4.85 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.945 -0.571 . . . . 1.0 109.668 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -101.5 15.02 30.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.028 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 120' ' ' GLU . 3.4 pm0 -151.51 148.66 28.31 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.833 -179.067 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.627 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.1 mm -123.71 125.58 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 109.547 -0.538 . . . . 1.0 109.547 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.557 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 16.3 m-70 -108.89 20.81 18.03 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.078 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.487 ' H ' HG22 ' A' ' 121' ' ' ILE . 2.4 p 167.44 150.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.515 -0.55 . . . . 1.0 109.515 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.457 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.1 pp -161.27 156.79 24.57 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.709 -0.678 . . . . 1.0 110.285 -178.731 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -122.1 112.03 17.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.499 -0.556 . . . . 1.0 109.499 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.483 HG22 HD12 ' A' ' 90' ' ' ILE . 23.9 t -98.58 105.81 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.207 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.838 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.73 -45.0 22.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.957 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 29.5 tp10 -156.67 157.52 35.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.61 -0.436 . . . . 1.0 111.477 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.432 ' O ' ' O ' ' A' ' 130' ' ' SER . . . 64.2 78.72 0.19 Allowed Glycine 0 C--N 1.333 0.378 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.365 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.432 ' O ' ' O ' ' A' ' 129' ' ' GLY . 4.2 m -32.28 151.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.915 0.388 . . . . 1.0 111.599 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.514 ' CZ2' HG22 ' A' ' 90' ' ' ILE . 46.9 m95 -122.03 168.21 12.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.387 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.36 99.5 2.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.526 -0.306 . . . . 1.0 110.428 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.436 HD23 ' HB3' ' A' ' 167' ' ' LEU . 14.9 mt -74.77 141.35 44.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.612 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -120.45 134.66 55.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.366 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -48.81 -45.03 39.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.289 -0.414 . . . . 1.0 110.79 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.775 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -126.96 169.04 13.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.261 0.553 . . . . 1.0 110.478 -178.475 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 18.4 m -75.48 176.32 7.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.303 -0.862 . . . . 1.0 111.303 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 58.21 21.37 8.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.507 -1.224 . . . . 1.0 109.801 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 35.48 78.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.606 -0.724 . . . . 1.0 111.735 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.775 ' C ' HD11 ' A' ' 136' ' ' LEU . 63.2 ttt180 -149.01 45.6 1.0 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.0 0.429 . . . . 1.0 110.298 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.512 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -157.42 -137.51 2.31 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.764 -0.935 . . . . 1.0 110.764 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.449 HH12 ' CG2' ' A' ' 160' ' ' THR . 82.1 mtp180 -78.85 163.26 25.46 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.958 -0.297 . . . . 1.0 110.224 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.55 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.36 136.17 29.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.987 -0.551 . . . . 1.0 110.877 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -128.23 140.4 51.92 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.134 -0.691 . . . . 1.0 109.134 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.52 ' C ' HD22 ' A' ' 146' ' ' LEU . 39.0 tp -96.01 126.38 41.21 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.725 0.774 . . . . 1.0 111.425 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.828 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.1 mm? -112.68 99.5 7.98 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 114.39 -1.277 . . . . 1.0 109.733 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.516 ' SD ' HD21 ' A' ' 145' ' ' LEU . 2.0 mpp? -73.94 167.68 33.17 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -62.91 116.43 3.55 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 121.56 1.506 . . . . 1.0 111.163 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 178.08 -158.01 22.58 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 111.021 -0.832 . . . . 1.0 111.021 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -124.78 115.69 21.11 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.081 0.467 . . . . 1.0 110.537 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 37.1 m-85 -107.1 129.47 54.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 1.0 109.878 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -113.15 -4.53 13.78 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.709 0.29 . . . . 1.0 110.604 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -156.38 166.35 33.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.365 0.603 . . . . 1.0 110.337 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -78.09 -20.1 52.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.016 -0.993 . . . . 1.0 112.249 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -69.6 -20.02 63.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.786 0.327 . . . . 1.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -50.42 -47.73 56.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.993 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.599 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 24.5 p90 -97.65 22.22 9.32 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.091 0.472 . . . . 1.0 110.35 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.19 74.32 0.31 Allowed Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.599 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -121.28 149.1 43.41 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.292 0.568 . . . . 1.0 110.593 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 160' ' ' THR . . . . . 0.449 ' CG2' HH12 ' A' ' 142' ' ' ARG . 11.6 t -77.37 -10.73 59.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.75 -1.114 . . . . 1.0 110.198 178.023 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -172.0 -165.49 0.36 Allowed 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.131 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.826 ' O ' HG23 ' A' ' 164' ' ' VAL . . . -111.7 -19.71 12.37 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.894 -0.593 . . . . 1.0 110.924 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.6 mtt180 -31.9 116.77 0.19 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.299 0.374 . . . . 1.0 111.881 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.826 HG23 ' O ' ' A' ' 162' ' ' ALA . 62.4 t -126.28 137.15 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-N 116.13 -0.486 . . . . 1.0 110.575 178.9 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -116.47 -34.57 1.29 Allowed Glycine 0 N--CA 1.465 0.581 0 N-CA-C 111.597 -0.601 . . . . 1.0 111.597 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.51 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -159.47 172.22 18.28 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 120.534 -0.466 . . . . 1.0 110.88 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.436 ' HB3' HD23 ' A' ' 133' ' ' LEU . 0.5 OUTLIER -157.32 142.48 17.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.539 -179.209 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -130.66 166.36 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.351 -0.981 . . . . 1.0 108.351 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -104.01 139.45 39.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.448 -0.796 . . . . 1.0 109.607 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.566 ' C ' HD12 ' A' ' 171' ' ' ILE . 19.0 t -81.48 121.22 34.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.849 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.652 HD11 ' NE2' ' A' ' 88' ' ' HIS . 1.6 mp . . . . . 0 N--CA 1.477 0.922 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.189 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.615 0 N-CA-C 110.459 -1.057 . . . . 1.0 110.459 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -172.81 103.31 0.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.124 -0.324 . . . . 1.0 110.124 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.38 166.78 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.089 0.471 . . . . 1.0 111.175 -178.418 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.452 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.5 m -124.62 121.19 34.03 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.86 -1.163 . . . . 1.0 107.86 177.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -106.19 133.72 50.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.874 -1.057 . . . . 1.0 110.244 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.452 ' CE1' HG22 ' A' ' 5' ' ' THR . 61.6 m-85 -115.97 125.94 53.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.351 -0.84 . . . . 1.0 111.219 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -53.75 -29.7 41.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.507 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -117.84 153.85 32.81 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.292 0.567 . . . . 1.0 110.675 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.422 ' C ' ' N ' ' A' ' 12' ' ' PHE . 16.3 ptt-85 -59.58 -176.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.827 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 46.1 22.53 0.9 Allowed Glycine 0 C--N 1.33 0.211 0 N-CA-C 110.552 -1.019 . . . . 1.0 110.552 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.537 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 10.6 m-85 54.14 67.85 0.94 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -129.92 -155.66 0.71 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.029 0.443 . . . . 1.0 110.468 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.14 -152.46 0.11 Allowed Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.984 -0.846 . . . . 1.0 110.984 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -68.98 146.53 52.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.787 0.327 . . . . 1.0 110.69 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -135.55 145.19 46.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.265 0.555 . . . . 1.0 110.444 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.4 t80 -140.26 142.26 35.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.31 -0.859 . . . . 1.0 110.213 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.545 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 41.1 tt0 -110.63 122.08 46.89 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.101 -0.499 . . . . 1.0 110.154 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.435 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -109.75 126.24 53.53 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.998 0.428 . . . . 1.0 110.67 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -117.32 13.96 14.65 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.624 -0.716 . . . . 1.0 110.357 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.9 m -157.91 167.87 28.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.582 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -58.67 140.13 55.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.577 -0.738 . . . . 1.0 111.549 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.435 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.16 145.31 45.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.868 -0.605 . . . . 1.0 110.821 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.2 p -112.64 -11.92 13.48 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.976 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -149.73 117.92 6.4 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.514 0.673 . . . . 1.0 110.172 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.8 mp -113.13 -2.44 14.15 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.096 -0.956 . . . . 1.0 110.246 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.629 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.1 mt-30 -58.15 -41.77 91.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.301 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.9 Cg_exo -58.79 -37.7 92.53 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.175 1.917 . . . . 1.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -97.22 -51.21 4.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.919 0.39 . . . . 1.0 111.327 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' A' ' 26' ' ' LEU . 6.9 mt -118.55 127.95 54.1 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.735 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -94.75 -8.39 37.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.937 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -147.5 -58.04 0.25 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.955 0.354 . . . . 1.0 111.955 -178.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t 63.08 74.83 0.42 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.755 0.312 . . . . 1.0 110.174 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.513 ' OD1' ' CE1' ' A' ' 66' ' ' HIS . 1.3 t30 -90.56 3.89 52.77 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.197 -0.456 . . . . 1.0 111.284 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.537 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -157.25 155.9 31.58 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 1.0 110.051 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 155.11 35.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 1.0 111.431 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -132.74 121.41 23.01 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 108.602 -0.888 . . . . 1.0 108.602 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.3 t -108.53 117.77 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 O-C-N 123.629 0.581 . . . . 1.0 109.905 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -78.84 -43.81 24.35 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.995 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.1 m -161.2 159.38 28.76 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.316 -0.624 . . . . 1.0 109.316 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.21 174.45 50.39 Favored Glycine 0 C--N 1.316 -0.55 0 N-CA-C 110.96 -0.856 . . . . 1.0 110.96 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 98.3 m -112.85 131.0 55.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.949 -0.76 . . . . 1.0 108.949 178.523 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.526 ' CE2' HD13 ' A' ' 81' ' ' LEU . 54.6 m95 -119.26 143.21 47.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.29 0.567 . . . . 1.0 111.438 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.544 ' C ' HD12 ' A' ' 45' ' ' LEU . 1.2 tpt -113.93 129.0 56.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.393 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.544 HD12 ' C ' ' A' ' 44' ' ' MET . 9.6 mp -108.15 127.57 53.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.995 -0.743 . . . . 1.0 108.995 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -106.85 133.41 51.55 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.687 0.756 . . . . 1.0 111.215 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.4 pt-20 -62.66 -36.7 83.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.828 -1.078 . . . . 1.0 110.296 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -106.59 151.68 40.49 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.244 -0.889 . . . . 1.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.1 154.14 74.91 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.575 2.183 . . . . 1.0 112.737 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.5 m120 59.47 34.8 22.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.967 -1.015 . . . . 1.0 110.721 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 23' ' ' HIS . 1.5 m-85 42.93 66.22 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.34 -0.846 . . . . 1.0 110.26 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.4 m -123.58 17.31 9.61 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.283 -0.871 . . . . 1.0 111.298 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.29 -155.12 6.37 Favored Glycine 0 N--CA 1.462 0.375 0 C-N-CA 120.693 -0.765 . . . . 1.0 111.553 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.58 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.4 tp -65.82 151.99 45.41 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.459 -0.371 . . . . 1.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -123.15 152.03 41.54 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.742 0.306 . . . . 1.0 111.624 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.402 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 27.1 m-85 -127.76 125.82 40.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.011 -0.541 . . . . 1.0 111.302 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -82.6 121.92 27.44 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.336 -0.393 . . . . 1.0 109.962 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.34 146.08 47.65 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.11 0.481 . . . . 1.0 110.311 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.467 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 42.5 mtp180 -134.69 160.42 38.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.494 -0.775 . . . . 1.0 110.283 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' A' ' 59' ' ' ARG . 9.7 ptm180 -34.02 127.32 0.42 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.829 -0.623 . . . . 1.0 111.272 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.63 -179.53 30.66 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.084 -0.807 . . . . 1.0 111.084 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.9 p-10 -116.36 125.19 51.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.161 0.505 . . . . 1.0 110.432 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -118.93 113.49 21.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.769 -0.651 . . . . 1.0 109.426 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.422 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.44 -3.31 53.35 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.669 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.422 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -148.36 141.63 25.13 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.628 -0.879 . . . . 1.0 108.628 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 34' ' ' ASN . 22.8 p-80 -62.52 -41.41 98.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.174 0.512 . . . . 1.0 110.689 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -51.98 -8.94 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.46 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -81.31 -34.93 31.6 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.116 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -92.78 15.65 14.15 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 120.813 -0.355 . . . . 1.0 110.515 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 58.7 mtt 72.55 30.55 1.88 Allowed 'General case' 0 CA--C 1.514 -0.433 0 O-C-N 124.31 1.006 . . . . 1.0 109.633 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.402 ' HA2' ' CE1' ' A' ' 56' ' ' TYR . . . . . . . . 0 CA--C 1.525 0.668 0 CA-C-O 118.786 -1.008 . . . . 1.0 112.834 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 C--O 1.232 0.152 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -122.91 4.78 9.38 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.703 0.287 . . . . 1.0 110.723 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.7 t -166.12 163.42 18.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.199 0.523 . . . . 1.0 110.822 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -155.89 146.63 22.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.433 -0.803 . . . . 1.0 109.945 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.519 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 3.1 ptm180 -126.99 151.51 48.48 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.526 HD13 ' CE2' ' A' ' 43' ' ' TRP . 27.5 tp -100.05 135.22 41.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.457 -0.942 . . . . 1.0 108.457 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 81' ' ' LEU . 3.5 mt -96.7 111.32 56.94 Favored Pre-proline 0 CA--C 1.543 0.711 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 N--CA 1.5 1.9 0 C-N-CA 121.901 1.734 . . . . 1.0 113.295 -179.598 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 87' ' ' SER . . . . . 0.405 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 3.8 m . . . . . 0 CA--C 1.521 -0.153 0 N-CA-C 109.744 -0.465 . . . . 1.0 109.744 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 6.3 m-70 -128.06 104.17 7.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.835 -0.166 . . . . 1.0 111.379 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -136.29 139.64 42.8 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.191 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.404 HD12 HG22 ' A' ' 126' ' ' VAL . 19.5 tt -149.6 141.81 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.735 0.302 . . . . 1.0 111.389 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -119.05 98.39 6.15 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.922 -0.581 . . . . 1.0 112.237 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.45 HD11 HD22 ' A' ' 167' ' ' LEU . 22.1 mt -79.88 142.91 34.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.538 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -125.41 137.68 54.01 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.822 -0.626 . . . . 1.0 111.923 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.505 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 2.3 tm-20 -56.08 -58.14 9.18 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.791 -0.64 . . . . 1.0 111.584 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -107.36 172.34 6.88 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.173 0.511 . . . . 1.0 111.128 -178.657 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.432 -0.804 . . . . 1.0 110.735 179.377 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.709 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -69.04 141.55 54.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.006 0.431 . . . . 1.0 110.872 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.515 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 154.36 48.22 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.661 -0.7 . . . . 1.0 111.058 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.6 tt -145.77 139.42 21.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 N-CA-C 109.33 -0.619 . . . . 1.0 109.33 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -113.39 144.73 42.29 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.681 0.753 . . . . 1.0 111.141 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.785 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 85.2 m-85 -130.61 156.3 45.1 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 114.692 -1.14 . . . . 1.0 110.934 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.0 p -143.66 31.57 1.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.477 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -170.85 -169.08 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.628 -0.429 . . . . 1.0 110.796 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 55.2 p-10 -82.68 149.29 27.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.353 179.268 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.63 101.1 4.38 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.334 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.444 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.1 p -69.14 -19.47 64.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.635 -0.426 . . . . 1.0 111.072 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 33.7 t -149.83 91.07 1.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.155 0.502 . . . . 1.0 109.989 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.785 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 13.6 tp -58.97 -39.68 82.47 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.32 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.654 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 14.4 mp0 -42.75 -14.01 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.971 0.36 . . . . 1.0 111.971 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.519 ' N ' ' O ' ' A' ' 112' ' ' LEU . 55.3 t0 -93.1 0.45 57.26 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.582 0.706 . . . . 1.0 110.401 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 112' ' ' LEU . 36.8 mmt180 -132.16 -39.13 1.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 1.0 113.266 -177.438 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.684 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.91 134.7 55.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 122.19 0.995 . . . . 1.0 110.96 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 118' ' ' PHE . 38.1 mmt180 -71.47 -69.97 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.064 -1.022 . . . . 1.0 110.433 -177.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.625 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -37.29 146.84 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.968 -0.56 . . . . 1.0 110.347 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 p-10 -105.24 11.19 33.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.767 0.318 . . . . 1.0 110.962 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -140.49 141.38 35.37 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.267 0.556 . . . . 1.0 111.173 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.651 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 39.1 mm -121.09 126.91 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-N 115.251 -0.886 . . . . 1.0 109.498 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.453 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.0 m-70 -118.56 26.74 9.37 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.141 -0.481 . . . . 1.0 111.69 -178.417 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' C ' ' A' ' 152' ' ' ARG . 3.8 m 165.21 151.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.449 . . . . 1.0 110.276 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.446 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.4 pp -163.79 158.12 19.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.681 -0.69 . . . . 1.0 110.78 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -123.14 117.97 26.59 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.505 -0.554 . . . . 1.0 109.505 178.77 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.404 HG22 HD12 ' A' ' 90' ' ' ILE . 23.2 t -101.92 105.01 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-N 116.235 -0.438 . . . . 1.0 110.109 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.874 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.83 -44.2 28.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.82 -0.627 . . . . 1.0 111.177 179.39 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.405 ' CG ' ' O ' ' A' ' 87' ' ' SER . 33.0 tp10 -157.72 150.25 22.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 120.695 -0.402 . . . . 1.0 111.277 -178.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.554 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.6 79.7 0.29 Allowed Glycine 0 C--O 1.229 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.0 112.322 177.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.424 ' O ' ' O ' ' A' ' 129' ' ' GLY . 45.3 t -31.6 148.38 0.01 OUTLIER 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.345 0.593 . . . . 1.0 111.242 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.554 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 41.7 m95 -124.3 163.07 22.44 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.096 -0.956 . . . . 1.0 111.289 -177.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.9 t -132.46 138.34 52.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 N-CA-C 108.754 -0.832 . . . . 1.0 108.754 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.502 ' HG ' HD11 ' A' ' 146' ' ' LEU . 43.4 mt -110.39 141.74 43.04 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.679 -0.489 . . . . 1.0 109.679 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -117.74 135.3 54.13 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.209 0.318 . . . . 1.0 110.896 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -48.35 -42.08 30.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.769 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -131.33 167.27 19.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.208 0.528 . . . . 1.0 110.181 -178.684 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.4 m -72.94 175.22 6.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.858 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 62.0 16.69 8.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.856 -1.065 . . . . 1.0 109.796 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 39.24 77.86 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.533 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.769 ' C ' HD11 ' A' ' 136' ' ' LEU . 73.5 mtp180 -146.57 41.18 1.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.723 0.297 . . . . 1.0 110.48 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.475 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -153.5 -142.8 3.54 Favored Glycine 0 N--CA 1.463 0.485 0 N-CA-C 111.31 -0.716 . . . . 1.0 111.31 -178.647 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -73.5 166.76 22.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 120.786 -0.366 . . . . 1.0 110.154 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -146.27 136.44 23.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.009 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -128.1 130.3 47.95 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 109.557 -0.535 . . . . 1.0 109.557 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 45.4 tp -85.51 126.95 34.25 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.342 0.591 . . . . 1.0 111.219 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.502 HD11 ' HG ' ' A' ' 133' ' ' LEU . 25.6 mt -114.75 106.5 14.28 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.156 -0.929 . . . . 1.0 109.819 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.59 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.7 160.81 65.97 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.291 -179.669 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.75 112.62 1.26 Allowed 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.302 2.001 . . . . 1.0 110.868 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.99 -152.55 12.35 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 110.538 -1.025 . . . . 1.0 110.538 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 49.0 p-10 -125.94 134.72 51.44 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.09 0.472 . . . . 1.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -124.83 124.62 42.48 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.924 -0.58 . . . . 1.0 109.638 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 152' ' ' ARG . . . . . 0.53 ' C ' ' OG ' ' A' ' 123' ' ' SER . 95.2 mtt-85 -112.97 1.8 15.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.626 0.25 . . . . 1.0 110.369 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -160.83 162.61 32.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.556 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.528 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -75.76 -24.06 56.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.138 -0.937 . . . . 1.0 112.314 -178.233 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.528 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 3.4 mt-30 -63.89 -20.18 65.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.282 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 156' ' ' ASP . . . . . 0.479 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 52.6 t0 -51.22 -49.31 61.32 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.365 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.726 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 26.1 p90 -96.58 19.05 12.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.026 0.441 . . . . 1.0 110.505 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.07 73.95 0.34 Allowed Glycine 0 CA--C 1.52 0.389 0 N-CA-C 111.227 -0.749 . . . . 1.0 111.227 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.726 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -116.45 141.92 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 1.0 111.337 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 160' ' ' THR . . . . . 0.457 HG23 ' N ' ' A' ' 161' ' ' ASN . 15.0 t -66.79 -38.68 87.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.5 -1.227 . . . . 1.0 110.238 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.457 ' N ' HG23 ' A' ' 160' ' ' THR . 78.3 m-20 -145.21 -172.51 3.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.019 0.438 . . . . 1.0 110.265 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.651 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.83 -2.06 18.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.822 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -53.99 118.13 3.76 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.001 0.429 . . . . 1.0 111.239 -178.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.87 131.23 72.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.463 -0.79 . . . . 1.0 109.49 178.08 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.31 -28.57 4.3 Favored Glycine 0 N--CA 1.465 0.605 0 N-CA-C 111.659 -0.576 . . . . 1.0 111.659 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 110' ' ' SER . 7.9 m -159.47 -172.3 3.66 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.938 -0.393 . . . . 1.0 109.938 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.659 HD21 HD13 ' A' ' 112' ' ' LEU . 2.3 pp -173.57 145.06 1.17 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.433 -0.507 . . . . 1.0 111.56 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.467 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 6.2 ptm180 -133.84 164.76 26.54 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.067 0.46 . . . . 1.0 110.285 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.443 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -98.33 147.03 25.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.581 -0.896 . . . . 1.0 108.581 178.45 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.782 ' C ' HD12 ' A' ' 171' ' ' ILE . 61.2 t -79.55 84.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.157 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.782 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.8 mp . . . . . 0 N--CA 1.465 0.291 0 N-CA-C 109.66 -0.496 . . . . 1.0 109.66 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.529 0 N-CA-C 110.523 -1.031 . . . . 1.0 110.523 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -171.88 106.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.996 -0.282 . . . . 1.0 110.724 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.73 170.36 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 121.129 0.49 . . . . 1.0 111.059 -178.786 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.5 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.6 m -127.41 120.41 28.38 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.226 -1.027 . . . . 1.0 108.226 177.202 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.4 mt -105.87 133.43 50.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.938 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.5 ' CE1' HG22 ' A' ' 5' ' ' THR . 58.2 m-85 -114.83 129.39 56.69 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.505 -0.771 . . . . 1.0 111.026 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.535 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.5 tt0 -56.03 -23.16 31.45 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.308 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -123.73 155.22 38.25 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.045 0.45 . . . . 1.0 110.465 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.84 -174.48 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.558 -0.746 . . . . 1.0 110.501 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.46 28.64 0.61 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 110.964 -0.855 . . . . 1.0 110.964 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.546 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 6.1 m-85 49.71 67.24 0.93 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.921 -0.4 . . . . 1.0 109.921 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -128.15 -160.83 1.05 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.953 0.406 . . . . 1.0 110.58 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.92 -151.74 0.73 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.535 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.1 mtm180 -69.3 148.95 49.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.705 0.288 . . . . 1.0 110.782 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -135.42 145.71 47.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.308 0.575 . . . . 1.0 110.284 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.9 t80 -140.89 141.95 34.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.127 -0.942 . . . . 1.0 109.809 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.558 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 66.7 tt0 -110.53 120.89 43.88 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.124 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -107.92 126.52 52.78 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.033 0.444 . . . . 1.0 110.747 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -117.58 12.23 14.01 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.55 -0.75 . . . . 1.0 110.385 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 35.5 p -156.94 167.09 31.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.191 0.52 . . . . 1.0 110.425 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 53.8 p-10 -58.1 142.56 46.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.555 -0.748 . . . . 1.0 111.684 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.75 147.17 44.48 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.904 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -115.45 -16.29 11.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.614 -0.721 . . . . 1.0 111.908 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -150.18 109.96 4.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 1.0 109.989 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 20.9 mt -108.43 2.36 22.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.388 -0.823 . . . . 1.0 110.41 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.615 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 10.3 mt-30 -56.89 -41.06 89.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.141 -0.482 . . . . 1.0 110.698 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.3 Cg_exo -59.34 -36.47 94.3 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.058 1.838 . . . . 1.0 111.999 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -94.21 -47.51 6.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.843 0.354 . . . . 1.0 111.24 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -120.09 127.79 52.86 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.338 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -91.26 -6.8 52.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.854 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.557 HH21 HD22 ' A' ' 34' ' ' ASN . 3.4 mmm-85 177.59 120.58 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t -102.09 111.35 23.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 1.0 110.498 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.557 HD22 HH21 ' A' ' 32' ' ' ARG . 89.6 m-20 -106.01 -3.72 21.34 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.247 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.546 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 3.8 t -157.11 155.64 31.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.801 0.334 . . . . 1.0 110.371 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.04 155.25 36.52 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.205 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -132.7 122.04 24.01 Favored 'General case' 0 C--O 1.217 -0.641 0 N-CA-C 108.794 -0.817 . . . . 1.0 108.794 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.67 116.32 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.29 0.567 . . . . 1.0 109.799 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.29 -43.97 31.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.335 -0.848 . . . . 1.0 110.979 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.4 t -161.89 152.79 17.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 109.226 -0.657 . . . . 1.0 109.226 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.82 176.38 49.33 Favored Glycine 0 C--N 1.317 -0.501 0 N-CA-C 111.07 -0.812 . . . . 1.0 111.07 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.1 m -113.02 139.68 48.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 178.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.446 ' CE2' HD13 ' A' ' 81' ' ' LEU . 55.3 m95 -128.18 138.88 52.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.225 0.536 . . . . 1.0 111.268 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.536 ' C ' HD12 ' A' ' 45' ' ' LEU . 1.0 OUTLIER -107.43 127.19 53.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.357 -0.838 . . . . 1.0 109.282 178.501 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.536 HD12 ' C ' ' A' ' 44' ' ' MET . 10.2 mp -108.65 129.84 55.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.536 -0.756 . . . . 1.0 109.297 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -112.23 131.65 55.37 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.631 0.729 . . . . 1.0 111.094 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.642 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.9 pt-20 -58.88 -35.42 72.96 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.067 -0.97 . . . . 1.0 111.072 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -108.57 154.22 41.72 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.689 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -66.05 159.12 50.9 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.843 2.362 . . . . 1.0 112.866 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 62.94 43.3 6.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.917 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 44.2 72.74 0.18 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.836 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.0 m -141.2 157.77 44.8 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.743 -0.466 . . . . 1.0 109.743 -178.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.36 -146.84 21.16 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.78 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.642 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.7 tp -79.72 144.02 34.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.971 -0.614 . . . . 1.0 110.282 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -120.73 150.7 40.57 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.45 0.167 . . . . 1.0 110.872 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -126.73 126.26 43.18 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-O 120.83 0.348 . . . . 1.0 111.318 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -82.94 122.74 28.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.955 -0.566 . . . . 1.0 109.495 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.6 mp -121.19 146.21 47.02 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.066 -0.516 . . . . 1.0 110.189 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.55 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 36.9 mtp180 -134.09 159.19 41.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.277 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.6 ptm180 -35.09 125.67 0.57 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.804 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 -178.64 32.92 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.683 -0.967 . . . . 1.0 110.683 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 42.2 p-10 -116.4 126.99 54.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.02 0.438 . . . . 1.0 110.608 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -121.43 113.94 20.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.815 -0.63 . . . . 1.0 109.43 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.5 -2.83 53.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.637 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -147.95 140.77 24.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.835 -0.802 . . . . 1.0 108.835 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.474 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.8 p-80 -62.13 -42.03 98.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.06 0.457 . . . . 1.0 110.799 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -52.16 -8.63 0.08 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.606 -0.725 . . . . 1.0 110.665 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.474 ' H ' ' C ' ' A' ' 66' ' ' HIS . 16.9 mm-40 -83.58 -36.06 24.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.552 -0.459 . . . . 1.0 111.363 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.458 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.85 15.93 10.35 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.709 -0.396 . . . . 1.0 111.265 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.495 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 44.3 mtt 84.0 14.22 0.3 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 124.175 0.922 . . . . 1.0 109.574 -178.254 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.711 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.188 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.471 0.606 0 CA-C-O 120.782 0.325 . . . . 1.0 110.785 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -104.45 4.95 33.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.648 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 p -163.17 162.56 25.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.263 0.554 . . . . 1.0 110.61 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.0 p -157.46 148.45 21.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 1.0 110.058 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.599 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 4.3 ptm180 -127.93 149.86 50.14 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.75 0.31 . . . . 1.0 110.397 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.446 HD13 ' CE2' ' A' ' 43' ' ' TRP . 20.9 tp -99.08 129.11 45.33 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.253 -1.017 . . . . 1.0 108.253 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.416 ' N ' HD12 ' A' ' 81' ' ' LEU . 4.5 mt -90.89 114.17 60.52 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 109.893 -0.41 . . . . 1.0 109.893 -179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo . . . . . 0 N--CA 1.5 1.911 0 C-N-CA 121.97 1.78 . . . . 1.0 113.215 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.231 0.122 0 N-CA-C 109.664 -0.495 . . . . 1.0 109.664 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -129.78 119.26 23.12 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.706 -0.225 . . . . 1.0 110.96 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -147.86 133.78 19.13 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.522 HD12 HG22 ' A' ' 126' ' ' VAL . 17.6 tt -147.51 146.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.962 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -125.71 103.69 7.96 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 123.389 0.43 . . . . 1.0 111.511 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.21 149.1 25.33 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.157 0.503 . . . . 1.0 111.839 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -125.44 138.92 54.02 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.823 -0.626 . . . . 1.0 112.396 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.469 ' N ' ' CD ' ' A' ' 94' ' ' GLU . 1.2 mm-40 -57.19 -55.25 37.22 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.803 -0.635 . . . . 1.0 111.2 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.424 ' O ' ' OG ' ' A' ' 123' ' ' SER . 75.7 mtp180 -109.68 173.24 6.42 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.238 -178.106 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 . . . . . 0 C--N 1.332 -0.188 0 CA-C-N 115.61 -0.723 . . . . 1.0 111.27 179.657 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.603 0 N-CA-C 110.874 -0.891 . . . . 1.0 110.874 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.525 ' NE2' ' H ' ' A' ' 102' ' ' MET . 53.9 tp60 -56.34 156.43 5.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.231 0.538 . . . . 1.0 110.617 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.525 ' H ' ' NE2' ' A' ' 101' ' ' GLN . 0.4 OUTLIER -127.4 146.06 50.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.954 -0.566 . . . . 1.0 110.651 -179.752 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.6 tt -141.8 140.49 30.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -114.31 143.6 44.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.573 0.701 . . . . 1.0 110.949 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.753 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 86.1 m-85 -130.37 154.38 47.75 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 114.781 -1.1 . . . . 1.0 110.739 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.61 11.23 1.65 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 1.0 111.151 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.964 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.5 pt-20 -160.79 79.11 0.62 Allowed 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 119.221 -0.419 . . . . 1.0 109.918 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.964 ' O ' ' O ' ' A' ' 107' ' ' GLU . 55.5 p30 18.77 167.96 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 122.434 1.112 . . . . 1.0 113.634 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 10.5 t -148.0 109.7 4.45 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 120.737 -1.227 . . . . 1.0 110.505 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.437 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.53 -18.58 64.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.309 -0.405 . . . . 1.0 110.9 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.423 ' SG ' ' O ' ' A' ' 110' ' ' SER . 85.1 m -151.84 88.7 1.42 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 1.0 109.819 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.753 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 11.9 tp -61.01 -41.49 96.64 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.163 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.765 ' NE2' ' H ' ' A' ' 113' ' ' GLN . 3.8 mp0 -43.16 -10.29 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.285 -0.416 . . . . 1.0 112.113 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.564 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.7 t0 -95.13 -22.83 17.61 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 1.0 110.434 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.511 ' N ' ' O ' ' A' ' 112' ' ' LEU . 34.5 mmt180 -107.06 -38.67 5.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.136 0.791 . . . . 1.0 113.136 -178.657 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.66 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -119.11 138.58 52.8 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 122.035 0.922 . . . . 1.0 110.811 -179.828 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 118' ' ' PHE . 32.1 mmt180 -72.21 -73.67 0.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.11 -0.994 . . . . 1.0 110.447 -177.551 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.616 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 98.1 m-85 -33.23 143.22 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.485 0 O-C-N 123.588 0.555 . . . . 1.0 110.515 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -103.07 6.49 38.66 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.079 0.466 . . . . 1.0 110.853 -178.152 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -137.68 141.59 41.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.753 -0.658 . . . . 1.0 111.017 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 41.8 mm -121.19 116.94 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.258 -0.883 . . . . 1.0 109.582 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.438 ' O ' ' CB ' ' A' ' 123' ' ' SER . 37.7 m-70 -109.44 29.97 7.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.581 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.8 p 163.33 149.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.095 0.474 . . . . 1.0 110.078 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.9 pp -163.3 157.52 20.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.338 -178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -124.91 119.62 29.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.792 0.33 . . . . 1.0 110.161 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.522 HG22 HD12 ' A' ' 90' ' ' ILE . 44.3 t -103.17 104.01 15.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.918 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -77.91 -40.76 38.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.658 -0.701 . . . . 1.0 111.331 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -137.21 146.37 44.77 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.102 0.477 . . . . 1.0 111.26 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.55 -171.39 2.36 Favored Glycine 0 CA--C 1.519 0.327 0 N-CA-C 111.177 -0.769 . . . . 1.0 111.177 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.3 m -119.37 157.12 28.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.318 0.58 . . . . 1.0 109.877 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -129.98 162.27 29.05 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.452 -0.795 . . . . 1.0 110.753 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 47.0 t -132.32 138.34 52.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 N-CA-C 109.181 -0.674 . . . . 1.0 109.181 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.5 ' HG ' HD11 ' A' ' 146' ' ' LEU . 39.3 mt -110.75 143.18 41.66 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.793 -0.447 . . . . 1.0 109.793 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -117.97 133.35 56.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.756 0.312 . . . . 1.0 110.904 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 -47.41 -30.38 3.28 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.943 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.5 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -140.27 177.13 8.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 1.0 110.493 -179.677 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 137' ' ' SER . . . . . 0.464 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -83.37 172.29 12.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.637 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 138' ' ' ASN . . . . . 0.464 ' N ' ' OG ' ' A' ' 137' ' ' SER . 21.3 m-20 64.24 19.21 11.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.17 -0.923 . . . . 1.0 110.078 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 35.59 78.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.706 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.404 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 65.2 ttt180 -147.38 36.79 0.91 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.185 0.516 . . . . 1.0 110.388 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.459 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -149.25 -141.77 3.49 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 111.163 -0.775 . . . . 1.0 111.163 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.25 164.89 25.98 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.058 -0.349 . . . . 1.0 110.058 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.495 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.99 137.59 29.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.791 -179.681 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -127.56 124.2 37.61 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.558 -0.534 . . . . 1.0 109.558 178.13 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.7 tp -81.0 127.22 32.33 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.806 -0.634 . . . . 1.0 111.048 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.5 HD11 ' HG ' ' A' ' 133' ' ' LEU . 23.1 mt -115.32 105.09 12.46 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.643 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.599 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.8 mtm -80.76 159.84 68.07 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.383 -0.372 . . . . 1.0 110.105 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -56.06 115.99 2.86 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.27 1.98 . . . . 1.0 110.966 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 174.75 -151.29 12.22 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 110.513 -1.035 . . . . 1.0 110.513 -179.112 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.44 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 42.2 p-10 -128.55 131.92 48.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.977 0.417 . . . . 1.0 110.954 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 14.6 m-85 -122.14 127.97 50.72 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.019 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -115.52 -1.1 12.86 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.719 0.295 . . . . 1.0 110.692 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -156.96 163.1 39.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.305 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.564 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.96 -22.34 56.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.055 -0.975 . . . . 1.0 111.827 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.539 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.42 -21.47 66.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.249 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -49.75 -47.32 50.87 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.909 -178.447 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.664 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 30.5 p90 -102.48 17.57 23.3 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.175 0.512 . . . . 1.0 109.95 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.57 74.17 0.32 Allowed Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.467 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.664 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.58 -171.24 2.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.35 0.595 . . . . 1.0 110.907 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.58 -35.58 3.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.985 -1.007 . . . . 1.0 112.277 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.601 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 25.3 t-20 -145.67 -27.4 0.45 Allowed 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 111.696 0.258 . . . . 1.0 111.696 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 96.92 0.38 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 124.36 1.038 . . . . 1.0 110.736 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -66.55 116.07 7.12 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.139 -178.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 60.5 t -118.8 128.79 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.198 -0.91 . . . . 1.0 110.415 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -104.65 -26.02 6.65 Favored Glycine 0 N--CA 1.464 0.53 0 N-CA-C 111.393 -0.683 . . . . 1.0 111.393 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 110' ' ' SER . 4.6 m -159.44 -173.69 4.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.787 -0.365 . . . . 1.0 110.03 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.521 HD21 HD13 ' A' ' 112' ' ' LEU . 2.5 pp -171.51 144.32 1.9 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.521 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.55 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 4.9 ptm180 -135.8 164.04 28.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.4 0.619 . . . . 1.0 109.908 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.878 HH11 ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.48 150.02 21.08 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.008 -0.997 . . . . 1.0 109.171 178.329 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.811 ' C ' HD12 ' A' ' 171' ' ' ILE . 44.6 t -82.95 83.59 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.189 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.811 HD12 ' C ' ' A' ' 170' ' ' VAL . 2.0 mp . . . . . 0 N--CA 1.465 0.296 0 CA-C-N 116.104 -0.498 . . . . 1.0 109.978 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.499 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.524 0.616 0 N-CA-C 110.599 -1.0 . . . . 1.0 110.599 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -172.02 112.7 0.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 121.145 -0.222 . . . . 1.0 110.79 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.541 HG22 HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -120.07 173.91 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.31 0 O-C-N 123.174 0.296 . . . . 1.0 111.057 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.509 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.4 m -131.36 120.62 23.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.299 -1.0 . . . . 1.0 108.299 177.164 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -105.12 132.64 51.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.898 -1.046 . . . . 1.0 110.027 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.509 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.2 m-85 -114.89 129.4 56.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.241 -0.89 . . . . 1.0 111.354 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.534 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 80.9 tt0 -55.45 -26.73 43.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.197 -0.911 . . . . 1.0 110.389 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -122.86 154.71 37.92 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.027 0.441 . . . . 1.0 110.209 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 6.5 ptp85 -58.32 -173.92 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.541 -0.754 . . . . 1.0 110.257 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.53 27.24 0.48 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.555 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.8 m-85 49.91 67.45 0.9 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.074 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -127.19 -160.16 0.98 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.991 0.424 . . . . 1.0 110.485 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.61 -149.08 0.75 Allowed Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.882 -0.887 . . . . 1.0 110.882 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.534 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 89.8 mtm-85 -72.49 149.8 43.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.682 0.277 . . . . 1.0 110.78 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -137.48 148.8 46.34 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.279 0.562 . . . . 1.0 110.35 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.525 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.9 t80 -141.86 142.18 33.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.924 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.525 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 77.0 tt0 -110.8 122.56 48.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.121 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.33 126.59 54.38 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.707 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.6 p -118.85 11.47 12.62 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.501 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.2 p -156.1 168.8 26.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.055 -0.52 . . . . 1.0 110.536 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -59.51 138.52 57.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.68 -0.691 . . . . 1.0 111.392 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.08 143.64 48.15 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.224 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.438 HG22 ' CE2' ' A' ' 51' ' ' TYR . 27.6 p -111.35 -18.59 12.87 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.793 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -148.14 110.07 4.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 1.0 110.405 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -108.11 1.0 21.98 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.179 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.569 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 47.1 mt-30 -53.34 -48.21 93.38 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.632 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 21.0 Cg_endo -56.86 -35.24 98.19 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.255 1.303 . . . . 1.0 112.881 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -91.36 -46.9 7.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.244 0.545 . . . . 1.0 110.945 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 mt -119.84 128.18 53.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.329 -0.851 . . . . 1.0 111.469 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -91.0 -15.54 29.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.351 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 59.7 ttm-85 -176.13 120.08 0.16 Allowed 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.706 -0.85 . . . . 1.0 108.706 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.7 t -99.53 109.91 22.4 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.348 -0.241 . . . . 1.0 110.348 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -103.37 -3.29 25.71 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.435 -0.348 . . . . 1.0 110.228 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.555 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.1 t -157.84 156.36 31.3 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.192 -0.299 . . . . 1.0 110.192 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.13 155.36 36.59 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.224 -0.444 . . . . 1.0 110.719 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.3 mtp85 -133.89 122.02 22.56 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.791 -0.818 . . . . 1.0 108.791 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.541 HG13 HG22 ' A' ' 4' ' ' ILE . 22.3 t -107.19 117.55 53.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.27 0.557 . . . . 1.0 110.333 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -78.77 -43.45 25.49 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.064 -0.971 . . . . 1.0 110.874 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.8 t -162.96 162.02 25.9 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.424 -0.584 . . . . 1.0 109.424 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.67 177.17 48.7 Favored Glycine 0 C--N 1.315 -0.637 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.7 m -114.24 132.58 56.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.645 -0.502 . . . . 1.0 109.645 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.648 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 53.4 m95 -120.27 146.49 46.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.898 -0.592 . . . . 1.0 110.661 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.557 ' C ' HD12 ' A' ' 45' ' ' LEU . 22.0 tpp -120.49 131.18 54.6 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.549 -0.751 . . . . 1.0 109.212 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.557 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -109.58 131.27 55.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.664 -0.698 . . . . 1.0 109.838 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.41 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 87.9 m-85 -111.69 133.09 54.16 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.579 0.704 . . . . 1.0 111.687 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -57.65 -36.89 72.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.125 -0.943 . . . . 1.0 111.389 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.7 mt-30 -108.11 153.25 41.91 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.635 -178.771 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -63.6 159.43 40.88 Favored 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.458 2.106 . . . . 1.0 112.172 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 62.53 36.9 13.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.254 -0.884 . . . . 1.0 111.332 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.438 ' CE2' HG22 ' A' ' 24' ' ' THR . 3.2 m-85 50.77 75.96 0.17 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.057 -0.974 . . . . 1.0 111.071 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.3 m -144.07 152.97 41.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.105 0.479 . . . . 1.0 110.244 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.84 -148.16 21.53 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.038 -0.601 . . . . 1.0 111.801 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.629 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.1 tp -75.49 143.58 42.49 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.038 -0.581 . . . . 1.0 110.262 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -120.84 150.79 40.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.482 0.182 . . . . 1.0 110.591 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 26.1 m-85 -124.99 124.12 41.32 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-O 120.841 0.353 . . . . 1.0 110.585 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -83.1 123.07 29.16 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.068 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.0 mp -119.37 144.07 47.08 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.415 -0.812 . . . . 1.0 110.03 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -132.4 158.91 40.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.121 -0.945 . . . . 1.0 110.141 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.7 ttp85 -37.09 125.32 0.94 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.997 -0.547 . . . . 1.0 110.763 -178.75 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.58 -179.97 32.01 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.53 -1.028 . . . . 1.0 110.53 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -114.14 136.23 53.16 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.897 0.379 . . . . 1.0 110.19 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -130.37 112.9 13.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 1.0 109.616 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.83 -3.85 55.59 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.033 -0.531 . . . . 1.0 111.411 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.428 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 78.9 m-20 -147.6 135.7 21.36 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.13 -0.693 . . . . 1.0 109.13 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.471 ' C ' ' H ' ' A' ' 68' ' ' GLN . 11.7 p-80 -56.34 -41.06 75.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.045 0.45 . . . . 1.0 111.057 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -54.52 -6.96 0.13 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.785 -0.643 . . . . 1.0 110.617 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.471 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -82.89 -34.43 26.67 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.152 -0.619 . . . . 1.0 111.606 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.404 ' O ' ' HB2' ' A' ' 70' ' ' MET . 2.3 p90 -94.51 15.68 17.3 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.404 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 70.2 mtp 76.18 27.89 0.85 Allowed 'General case' 0 C--O 1.224 -0.252 0 O-C-N 124.341 1.025 . . . . 1.0 109.679 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.851 0 C-N-CA 119.974 -1.108 . . . . 1.0 112.073 -179.125 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.454 -0.272 0 N-CA-C 109.212 -0.662 . . . . 1.0 109.212 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -122.2 13.42 10.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.247 -0.433 . . . . 1.0 110.829 -178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.4 p -163.63 162.8 24.43 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.171 0.51 . . . . 1.0 110.644 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -157.55 148.9 21.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.604 -0.726 . . . . 1.0 110.327 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.611 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 2.1 ptm180 -128.23 150.38 50.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.761 -0.459 . . . . 1.0 109.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.724 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -101.43 124.14 46.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.088 -1.079 . . . . 1.0 108.088 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.724 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.0 mt -85.65 115.75 62.83 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 109.796 -0.446 . . . . 1.0 109.796 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo . . . . . 0 N--CA 1.501 1.969 0 C-N-CA 122.34 2.027 . . . . 1.0 113.021 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.231 0.115 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.611 ' NE2' HD11 ' A' ' 171' ' ' ILE . 15.5 m80 -132.3 120.12 21.68 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.486 -0.325 . . . . 1.0 110.914 -179.599 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -145.45 135.3 23.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.838 -0.345 . . . . 1.0 110.178 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.492 HD12 HG22 ' A' ' 126' ' ' VAL . 18.0 tt -148.27 144.86 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.047 -0.261 . . . . 1.0 110.582 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -124.42 99.92 6.43 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.563 0.54 . . . . 1.0 111.471 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.15 152.36 27.8 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.638 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -129.57 137.84 50.96 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.448 -0.796 . . . . 1.0 111.79 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -54.8 -56.85 14.87 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.362 -0.835 . . . . 1.0 110.978 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.596 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 78.0 mtp180 -105.57 173.87 6.12 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 110.107 -0.331 . . . . 1.0 110.107 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 . . . . . 0 CA--C 1.511 -0.537 0 CA-C-N 115.829 -0.623 . . . . 1.0 110.163 179.085 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.445 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.501 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 56.5 tp60 -68.62 145.48 53.89 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.461 0.648 . . . . 1.0 111.26 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.491 ' SD ' ' O ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 151.0 51.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 1.0 111.187 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.429 HG21 ' CD1' ' A' ' 116' ' ' PHE . 9.4 tt -145.15 139.16 22.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -112.38 143.72 43.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.381 0.61 . . . . 1.0 110.578 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.49 ' CD1' ' SG ' ' A' ' 109' ' ' CYS . 88.6 m-85 -129.18 154.81 46.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.514 -1.221 . . . . 1.0 110.522 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.0 p -143.79 9.61 1.55 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.329 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.934 ' O ' ' O ' ' A' ' 108' ' ' ASP . 8.1 pt-20 -160.25 78.33 0.65 Allowed 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 118.851 -0.595 . . . . 1.0 109.424 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.934 ' O ' ' O ' ' A' ' 107' ' ' GLU . 12.9 p-10 22.44 167.7 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 122.491 1.139 . . . . 1.0 113.278 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.49 ' SG ' ' CD1' ' A' ' 105' ' ' PHE . 9.8 m -146.95 106.42 3.92 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 120.342 -1.474 . . . . 1.0 109.548 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.422 ' O ' ' OG ' ' A' ' 166' ' ' SER . 80.9 p -67.46 -22.53 65.49 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.395 -0.522 . . . . 1.0 110.675 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 72.0 m -143.96 95.57 2.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.246 0.546 . . . . 1.0 110.554 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.1 tp -63.62 -44.54 93.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.416 -0.811 . . . . 1.0 110.373 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.582 ' NE2' ' OD1' ' A' ' 119' ' ' ASN . 29.6 mm100 -47.2 -9.15 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.245 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.513 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.1 m-20 -96.8 -24.99 15.65 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.988 0.423 . . . . 1.0 110.381 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.0 mmt-85 -109.41 -36.69 5.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.849 -0.614 . . . . 1.0 111.682 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.5 ' HB2' HD11 ' A' ' 112' ' ' LEU . 3.7 t80 -125.53 120.67 31.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.146 0.498 . . . . 1.0 109.902 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -60.36 -60.06 4.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.488 -0.778 . . . . 1.0 110.942 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -40.39 137.84 1.01 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.803 -0.443 . . . . 1.0 109.803 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 119' ' ' ASN . . . . . 0.582 ' OD1' ' NE2' ' A' ' 113' ' ' GLN . 62.9 m-20 -101.94 2.38 37.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.097 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -135.13 137.88 43.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.227 0.537 . . . . 1.0 110.555 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.555 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.0 mm -120.99 122.2 67.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.025 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -112.31 21.85 15.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.413 -0.812 . . . . 1.0 111.046 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.499 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.8 p 169.29 153.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.064 0.459 . . . . 1.0 109.937 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.428 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.7 pp -165.33 158.31 16.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.523 -0.762 . . . . 1.0 110.079 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -125.09 119.08 27.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.361 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.492 HG22 HD12 ' A' ' 90' ' ' ILE . 29.6 t -102.95 104.92 17.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 115.925 -0.58 . . . . 1.0 109.785 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.899 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.82 -41.14 30.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.516 -0.766 . . . . 1.0 111.315 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -140.59 147.11 38.91 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.511 -0.476 . . . . 1.0 110.745 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 60.51 -175.46 4.56 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.079 -0.809 . . . . 1.0 111.079 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.1 m -117.91 153.15 34.06 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.406 -0.59 . . . . 1.0 109.406 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -126.42 159.39 33.43 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.562 -0.744 . . . . 1.0 110.73 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 41.4 t -130.67 136.44 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.28 -0.637 . . . . 1.0 109.28 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.543 ' HG ' HD11 ' A' ' 146' ' ' LEU . 37.3 mt -107.82 141.42 39.42 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 110.219 -0.289 . . . . 1.0 110.219 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -117.58 134.35 54.97 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.268 0.355 . . . . 1.0 110.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -45.74 -50.75 13.52 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.57 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.72 166.06 16.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.288 0.566 . . . . 1.0 110.279 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.1 m -68.6 177.04 2.62 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.101 -0.954 . . . . 1.0 110.936 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 12.2 m120 58.76 22.16 9.75 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.356 -1.293 . . . . 1.0 110.057 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 36.36 76.94 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.435 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -146.41 41.2 1.14 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.252 0.548 . . . . 1.0 110.166 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.52 -146.64 4.38 Favored Glycine 0 N--CA 1.462 0.386 0 N-CA-C 111.618 -0.593 . . . . 1.0 111.618 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 85.1 mtt85 -69.94 168.39 15.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.86 135.16 21.76 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 123.851 0.719 . . . . 1.0 110.89 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 144' ' ' TYR . . . . . 0.413 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 7.1 m-85 -127.25 137.92 52.98 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.604 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.7 OUTLIER -91.5 126.23 36.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.937 0.399 . . . . 1.0 110.565 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.604 ' N ' HD23 ' A' ' 145' ' ' LEU . 24.0 mt -114.93 102.73 10.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.522 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.611 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -81.62 161.92 59.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 116.374 -0.375 . . . . 1.0 110.708 -178.937 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.61 119.15 5.95 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 121.41 1.406 . . . . 1.0 111.522 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.73 -152.42 19.45 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.344 -1.102 . . . . 1.0 110.344 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -127.15 136.4 52.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.77 0.319 . . . . 1.0 110.352 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.513 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 27.6 m-85 -126.6 129.01 47.71 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.172 -0.467 . . . . 1.0 109.766 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -116.33 -3.1 11.97 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.882 0.373 . . . . 1.0 110.291 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -156.19 159.16 38.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.518 0.675 . . . . 1.0 110.191 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.474 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.8 p90 -74.68 -20.87 59.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.562 -1.199 . . . . 1.0 112.286 -177.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -68.44 -19.48 64.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.252 -0.431 . . . . 1.0 111.09 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 156' ' ' ASP . . . . . 0.513 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 54.4 t0 -51.5 -50.13 60.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.101 -0.5 . . . . 1.0 110.914 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.71 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 14.4 p90 -94.43 21.5 7.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.041 0.448 . . . . 1.0 110.443 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.68 75.18 0.23 Allowed Glycine 0 CA--C 1.519 0.343 0 N-CA-C 111.148 -0.781 . . . . 1.0 111.148 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.71 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.82 147.91 42.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.124 0.488 . . . . 1.0 110.03 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 160' ' ' THR . . . . . 0.404 ' O ' ' CG ' ' A' ' 161' ' ' ASN . 15.1 t -76.49 -20.51 56.89 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.003 -0.998 . . . . 1.0 109.91 177.904 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.404 ' CG ' ' O ' ' A' ' 160' ' ' THR . 73.7 m-20 -162.3 -171.04 2.66 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.5 -0.48 . . . . 1.0 110.497 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.82 -10.81 15.1 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.569 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -47.28 117.03 1.59 Allowed 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 120.614 0.245 . . . . 1.0 111.266 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 162' ' ' ALA . 55.8 t -131.14 124.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.76 177.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -100.05 -24.62 9.58 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 111.464 -0.654 . . . . 1.0 111.464 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 110' ' ' SER . 6.0 m -159.82 -171.0 3.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.006 -0.368 . . . . 1.0 110.006 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 pp -172.54 142.17 1.22 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.945 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -132.93 162.66 31.04 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.861 -0.422 . . . . 1.0 109.861 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.496 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -95.49 154.3 17.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.542 -0.754 . . . . 1.0 109.63 178.522 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.733 ' C ' HD12 ' A' ' 171' ' ' ILE . 49.4 t -88.25 88.62 2.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 O-C-N 122.105 -0.372 . . . . 1.0 111.944 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.733 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.8 mp . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 121.137 0.494 . . . . 1.0 109.88 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.512 0 N-CA-C 110.818 -0.913 . . . . 1.0 110.818 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -173.78 98.92 0.11 Allowed 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.829 -0.348 . . . . 1.0 110.571 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.02 164.48 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-O 120.781 0.324 . . . . 1.0 110.487 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.501 HG22 ' CE1' ' A' ' 7' ' ' TYR . 32.9 m -124.17 119.94 30.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.919 -1.141 . . . . 1.0 107.919 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.0 mt -104.17 133.88 48.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.799 -1.091 . . . . 1.0 109.776 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.501 ' CE1' HG22 ' A' ' 5' ' ' THR . 66.4 m-85 -116.12 126.5 53.8 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.383 -0.826 . . . . 1.0 111.067 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.532 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 79.2 tt0 -52.74 -33.63 49.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.657 -0.701 . . . . 1.0 110.289 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -113.35 161.29 17.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.245 0.545 . . . . 1.0 110.655 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.415 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 14.6 ptt-85 -65.22 -175.94 0.26 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.271 -0.877 . . . . 1.0 110.673 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.61 26.29 1.04 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 110.662 -0.975 . . . . 1.0 110.662 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 50.53 70.05 0.56 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.346 -0.427 . . . . 1.0 110.102 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -133.43 -159.78 0.99 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.914 0.388 . . . . 1.0 110.319 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.28 -152.1 0.82 Allowed Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.731 -0.947 . . . . 1.0 110.731 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.532 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 91.1 mtm-85 -68.83 146.01 53.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.673 0.273 . . . . 1.0 110.998 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -136.64 153.79 50.82 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 121.223 0.535 . . . . 1.0 110.688 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 8.2 t80 -147.4 141.78 26.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.253 -0.885 . . . . 1.0 110.086 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.453 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.2 tt0 -110.21 124.72 52.1 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.571 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -114.42 126.53 55.08 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.337 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t -117.28 9.89 13.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.877 -0.601 . . . . 1.0 110.189 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.3 m -154.4 166.37 33.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.892 -0.594 . . . . 1.0 110.563 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -59.25 138.67 57.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.5 -0.773 . . . . 1.0 111.576 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.28 142.21 48.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.412 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.515 ' O ' ' OG ' ' A' ' 78' ' ' SER . 21.0 p -109.82 -10.07 14.78 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.66 -0.7 . . . . 1.0 112.274 -178.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -156.88 114.4 3.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.291 0.567 . . . . 1.0 110.09 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -116.93 1.26 12.63 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.512 -0.767 . . . . 1.0 110.75 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.6 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 4.4 mt-30 -52.93 -43.24 93.7 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.31 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.6 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 37.6 Cg_exo -58.62 -33.51 98.23 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.063 1.842 . . . . 1.0 111.616 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -95.5 -53.1 3.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 120.734 -0.386 . . . . 1.0 110.754 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 mt -116.81 127.61 54.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 1.0 110.804 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 t -94.74 -7.12 41.47 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.862 -0.608 . . . . 1.0 112.148 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.419 ' CD ' HD21 ' A' ' 34' ' ' ASN . 35.8 ttm180 -151.83 -55.29 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.229 0.455 . . . . 1.0 112.229 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.9 t 62.34 80.03 0.24 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 1.0 110.975 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.419 HD21 ' CD ' ' A' ' 32' ' ' ARG . 94.7 m-20 -94.64 3.44 55.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.733 -0.212 . . . . 1.0 111.551 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 p -157.33 159.09 37.14 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.839 -0.345 . . . . 1.0 110.419 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.15 155.24 33.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 1.0 111.512 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.452 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 26.4 mtp85 -134.89 124.48 25.08 Favored 'General case' 0 C--O 1.211 -0.96 0 N-CA-C 108.801 -0.815 . . . . 1.0 108.801 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.1 t -108.92 134.48 50.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.06 -0.719 . . . . 1.0 109.06 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.25 -43.39 8.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 1.0 110.241 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 p -159.58 156.52 28.16 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.735 -0.839 . . . . 1.0 108.735 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.46 174.18 50.21 Favored Glycine 0 C--N 1.316 -0.547 0 N-CA-C 110.959 -0.856 . . . . 1.0 110.959 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.6 m -111.74 142.55 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.415 -0.587 . . . . 1.0 109.415 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.449 ' CE2' HD13 ' A' ' 81' ' ' LEU . 54.6 m95 -131.06 150.47 52.13 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.45 0.643 . . . . 1.0 111.254 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.598 ' C ' HD23 ' A' ' 45' ' ' LEU . 37.6 ttm -128.47 133.26 48.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.964 -1.016 . . . . 1.0 108.908 178.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.598 HD23 ' C ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -109.92 137.6 47.47 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 -179.405 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.418 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 40.9 m-85 -110.95 132.01 54.57 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.628 0.728 . . . . 1.0 110.277 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -59.36 -35.09 73.25 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.184 -0.916 . . . . 1.0 110.962 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.7 mt-30 -110.44 152.43 43.31 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.602 -178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.425 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 40.0 Cg_endo -63.05 157.09 50.91 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.592 2.195 . . . . 1.0 113.133 178.806 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 64.33 35.95 9.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.3 -0.864 . . . . 1.0 111.268 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.418 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.5 m-85 51.89 76.28 0.18 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.01 -0.996 . . . . 1.0 111.119 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.5 m -144.98 154.87 43.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.015 0.436 . . . . 1.0 109.976 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.88 -149.79 22.56 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.97 -0.633 . . . . 1.0 112.143 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.609 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.3 tp -75.24 142.74 43.34 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.023 -0.589 . . . . 1.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 2.9 pt20 -121.1 151.92 39.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -128.77 125.89 38.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.294 -0.412 . . . . 1.0 110.881 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.41 ' C ' HD12 ' A' ' 58' ' ' LEU . 58.2 t80 -84.52 122.69 29.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.986 0.422 . . . . 1.0 110.471 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.41 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.6 mp -117.25 146.1 43.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.329 0.585 . . . . 1.0 110.06 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' C ' ' A' ' 60' ' ' ARG . 40.1 mtp180 -131.76 160.82 34.43 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.374 -0.83 . . . . 1.0 109.896 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.5 ttt180 -37.25 125.51 0.99 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.769 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.7 -178.42 33.14 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.508 -1.037 . . . . 1.0 110.508 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.452 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 70.9 m-20 -117.77 124.63 48.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.902 0.382 . . . . 1.0 110.533 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -117.26 113.27 21.93 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.196 -0.668 . . . . 1.0 109.196 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.413 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.91 -2.89 55.43 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.707 -179.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.413 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.4 m-20 -147.98 139.23 23.48 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.576 -0.898 . . . . 1.0 108.576 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 68' ' ' GLN . 12.2 p-80 -59.24 -43.52 92.39 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.599 -0.44 . . . . 1.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -50.77 -9.46 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.86 -0.609 . . . . 1.0 111.12 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.453 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.1 mm-40 -82.36 -35.57 27.66 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.265 -0.574 . . . . 1.0 111.15 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.455 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.53 17.79 7.02 Favored 'General case' 0 CA--C 1.507 -0.673 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.534 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 37.6 mtt 80.37 16.47 0.69 Allowed 'General case' 0 CA--C 1.521 -0.152 0 O-C-N 124.013 0.82 . . . . 1.0 109.94 -178.568 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.337 0.624 0 N-CA-C 110.576 -1.009 . . . . 1.0 110.576 178.837 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.52 -0.204 0 N-CA-C 109.301 -0.629 . . . . 1.0 109.301 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.425 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.7 mtm-85 -124.34 5.09 8.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.372 -0.376 . . . . 1.0 111.628 -178.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.515 ' OG ' ' O ' ' A' ' 24' ' ' THR . 30.7 m -165.06 162.23 20.21 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.238 0.542 . . . . 1.0 111.202 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.1 p -154.42 146.72 23.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.285 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.439 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 4.5 ptm180 -128.42 150.58 50.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.415 -0.357 . . . . 1.0 110.192 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.449 HD13 ' CE2' ' A' ' 43' ' ' TRP . 20.7 tp -99.58 134.57 42.28 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.046 -1.094 . . . . 1.0 108.046 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.445 ' H ' HD12 ' A' ' 81' ' ' LEU . 6.4 mt -94.82 131.33 30.7 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.737 -0.468 . . . . 1.0 109.737 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 N--CA 1.498 1.759 0 C-N-CA 122.159 1.906 . . . . 1.0 113.158 -178.715 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.461 0.121 0 N-CA-C 109.869 -0.419 . . . . 1.0 109.869 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.591 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 8.2 m80 -134.09 119.79 19.36 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.52 -0.309 . . . . 1.0 111.013 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -142.24 134.01 27.0 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.617 -0.433 . . . . 1.0 110.398 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.482 HD12 HG22 ' A' ' 126' ' ' VAL . 18.5 tt -145.52 140.5 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.83 0.347 . . . . 1.0 110.769 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.546 ' NH2' ' SD ' ' A' ' 102' ' ' MET . 77.0 mtp85 -120.14 98.03 5.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.164 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -79.17 140.89 37.63 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.126 0.489 . . . . 1.0 110.998 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -118.21 134.9 54.61 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-N 115.359 -0.837 . . . . 1.0 111.141 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -55.18 -59.18 5.13 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.688 179.378 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.48 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.3 mtt85 -98.68 162.93 12.86 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.44 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.677 0.751 . . . . 1.0 111.017 178.075 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.413 0 N-CA-C 110.835 -0.906 . . . . 1.0 110.835 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.417 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 9.4 tp-100 -65.7 143.85 57.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 1.0 110.926 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.546 ' SD ' ' NH2' ' A' ' 91' ' ' ARG . 2.1 ptm -129.82 152.06 49.72 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.673 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.9 tt -144.38 140.81 24.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.504 -0.554 . . . . 1.0 109.504 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' GLU . . . . . 0.503 ' OE1' ' NH1' ' A' ' 91' ' ' ARG . 80.6 tt0 -115.04 146.81 40.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.637 0.732 . . . . 1.0 111.398 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.471 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 83.4 m-85 -132.17 155.58 47.94 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 114.647 -1.16 . . . . 1.0 110.737 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.8 p -144.04 15.84 1.72 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.526 -0.761 . . . . 1.0 110.314 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.2 pm0 -151.54 -172.97 4.37 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.602 -0.439 . . . . 1.0 110.286 178.497 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 66.4 t0 -74.76 140.17 43.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.771 0.319 . . . . 1.0 110.865 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.518 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.9 m -133.71 91.38 2.83 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.56 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -64.68 -27.28 68.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.37 -0.377 . . . . 1.0 111.082 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.4 t -137.79 95.66 3.09 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.285 0.564 . . . . 1.0 110.429 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -60.62 -41.24 94.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.156 -0.929 . . . . 1.0 110.423 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.602 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 3.2 mp0 -47.83 -13.37 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.895 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' A' ' 112' ' ' LEU . 82.3 m-20 -91.46 1.41 57.15 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.767 0.794 . . . . 1.0 109.714 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.1 mmt-85 -131.02 -40.11 1.18 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.09 -1.413 . . . . 1.0 113.613 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.654 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.61 137.29 54.39 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 122.29 1.043 . . . . 1.0 111.471 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 118' ' ' PHE . 29.4 mmt180 -69.83 -69.19 0.36 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 121.47 -0.768 . . . . 1.0 111.137 -177.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.601 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 81.3 m-85 -37.86 145.73 0.07 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.313 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -104.21 9.18 36.22 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.77 0.319 . . . . 1.0 111.028 -178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -138.49 140.22 39.11 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.147 0.498 . . . . 1.0 111.204 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.734 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.8 mm -120.96 124.04 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 115.33 -0.85 . . . . 1.0 109.25 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -112.8 21.26 15.7 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.733 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.5 p 169.77 153.7 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.067 0.461 . . . . 1.0 109.959 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.5 pp -164.2 158.21 18.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.568 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -126.25 115.11 19.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.659 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.482 HG22 HD12 ' A' ' 90' ' ' ILE . 21.5 t -98.72 104.84 16.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 109.458 -0.571 . . . . 1.0 109.458 178.809 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.865 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.86 -39.59 42.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 1.0 111.262 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -146.65 148.83 32.46 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.848 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 66.47 175.13 6.35 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.772 -0.931 . . . . 1.0 110.772 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 m -116.83 150.54 38.21 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.058 -0.719 . . . . 1.0 109.058 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.416 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 43.8 m95 -124.09 167.38 14.3 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.638 -178.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 39.9 t -138.42 105.63 3.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.558 -0.292 . . . . 1.0 110.331 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 13.3 mt -78.62 142.78 36.97 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.068 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -121.55 136.69 54.93 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.711 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -47.88 -46.8 31.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.519 -0.309 . . . . 1.0 110.412 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -127.8 165.27 20.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.421 0.629 . . . . 1.0 110.343 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 55.6 m -69.92 -179.11 1.74 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.96 -1.018 . . . . 1.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 138' ' ' ASN . . . . . 0.45 ' CB ' HH21 ' A' ' 140' ' ' ARG . 15.4 m120 55.92 19.6 3.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.555 -1.202 . . . . 1.0 109.466 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.569 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 17.4 m-85 37.67 77.22 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.593 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.45 HH21 ' CB ' ' A' ' 138' ' ' ASN . 76.9 mtm180 -145.22 41.98 1.28 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.029 0.442 . . . . 1.0 110.637 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -154.5 -145.78 4.25 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 111.397 -0.681 . . . . 1.0 111.397 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.28 164.31 25.95 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.835 -0.432 . . . . 1.0 109.835 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.534 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.43 137.47 30.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.395 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -129.9 139.74 51.08 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.086 -0.709 . . . . 1.0 109.086 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.53 ' C ' HD22 ' A' ' 146' ' ' LEU . 43.1 tp -93.18 125.76 37.94 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.494 0.664 . . . . 1.0 111.959 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.814 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.4 mm? -112.42 98.39 7.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.751 -1.113 . . . . 1.0 108.758 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.516 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -75.8 164.18 62.19 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 109.9 -0.407 . . . . 1.0 109.9 -179.203 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -58.68 118.62 5.53 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 C-N-CA 120.665 0.91 . . . . 1.0 110.445 178.561 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 171.7 -155.58 24.28 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.59 -1.004 . . . . 1.0 110.59 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -125.56 135.07 51.84 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.805 0.336 . . . . 1.0 110.766 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.487 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.8 m-85 -125.26 130.56 52.3 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.161 -0.472 . . . . 1.0 109.849 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -115.81 -2.74 12.31 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.828 0.347 . . . . 1.0 110.087 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -156.78 159.91 38.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.579 0.704 . . . . 1.0 110.088 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.407 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 7.7 p90 -73.68 -19.85 60.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.639 -1.164 . . . . 1.0 112.201 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.32 -19.6 63.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.368 -0.378 . . . . 1.0 111.402 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -51.33 -47.82 62.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.944 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 27.2 p90 -95.82 22.67 7.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.954 0.406 . . . . 1.0 110.654 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.56 74.4 0.29 Allowed Glycine 0 CA--C 1.52 0.384 0 N-CA-C 111.248 -0.741 . . . . 1.0 111.248 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.644 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.06 148.31 43.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.525 0.678 . . . . 1.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 160' ' ' THR . . . . . 0.459 HG22 ' H ' ' A' ' 160' ' ' THR . 0.0 OUTLIER -75.77 -25.67 56.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.277 -1.329 . . . . 1.0 109.874 177.7 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -158.15 -171.19 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.042 0.449 . . . . 1.0 110.508 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.734 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -107.59 -18.17 13.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.693 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -37.71 118.88 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.85 0.357 . . . . 1.0 111.866 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 162' ' ' ALA . 18.9 t -122.36 159.38 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 115.858 -0.61 . . . . 1.0 109.65 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.484 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -136.72 -34.88 0.21 Allowed Glycine 0 N--CA 1.462 0.4 0 N-CA-C 111.207 -0.757 . . . . 1.0 111.207 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.4 p -158.11 -174.06 4.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.847 0.356 . . . . 1.0 110.109 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -169.53 137.56 1.81 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.143 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.569 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 12.4 ptp180 -133.17 154.45 50.61 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.605 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -84.84 152.35 23.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.962 -0.563 . . . . 1.0 109.653 178.428 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.829 ' C ' HD12 ' A' ' 171' ' ' ILE . 47.3 t -88.01 83.13 2.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.262 -0.426 . . . . 1.0 111.559 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.829 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.0 mp . . . . . 0 N--CA 1.465 0.303 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.336 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.525 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 110.602 -0.999 . . . . 1.0 110.602 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -169.67 138.63 1.89 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.29 -0.263 . . . . 1.0 110.29 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -147.03 168.77 4.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.337 -0.392 . . . . 1.0 110.786 179.474 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.1 m -128.39 120.67 27.41 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.325 -0.991 . . . . 1.0 108.325 175.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.25 132.77 50.15 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.318 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.49 ' CE1' HG22 ' A' ' 5' ' ' THR . 60.7 m-85 -115.35 125.9 53.77 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.331 -0.849 . . . . 1.0 110.883 -178.669 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -53.96 -27.37 30.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.613 -0.721 . . . . 1.0 110.633 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -119.48 154.57 33.58 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.119 0.485 . . . . 1.0 110.142 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 12' ' ' PHE . 32.4 ptt85 -59.39 -172.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.515 -0.766 . . . . 1.0 110.266 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.65 25.49 0.2 Allowed Glycine 0 N--CA 1.461 0.304 0 N-CA-C 111.008 -0.837 . . . . 1.0 111.008 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 7.8 m-85 51.69 69.01 0.71 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.062 -0.348 . . . . 1.0 110.062 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -131.17 -158.83 0.92 Allowed 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.008 0.432 . . . . 1.0 110.635 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.57 -151.96 0.43 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.875 -0.89 . . . . 1.0 110.875 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -68.97 146.81 52.43 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.961 -0.296 . . . . 1.0 110.621 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -136.48 150.29 48.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.221 0.534 . . . . 1.0 110.196 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -143.78 142.09 30.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.396 -0.82 . . . . 1.0 110.089 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.7 tt0 -110.48 122.18 47.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.958 -0.564 . . . . 1.0 110.313 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.22 127.91 55.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.456 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 79.4 p -118.66 12.99 13.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.407 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 54.9 m -158.63 172.71 17.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.543 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 46.8 p-10 -62.3 137.49 58.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.572 -0.74 . . . . 1.0 111.279 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.82 149.17 52.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.783 -0.644 . . . . 1.0 110.093 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 p -119.46 -18.4 8.51 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.26 -0.882 . . . . 1.0 112.196 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -143.54 109.52 5.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.994 0.426 . . . . 1.0 110.074 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.406 ' O ' ' N ' ' A' ' 30' ' ' LEU . 19.8 mt -116.17 -5.57 11.88 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.735 -0.666 . . . . 1.0 110.421 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.623 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -45.33 -52.45 21.69 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.889 -0.596 . . . . 1.0 109.92 178.631 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.623 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.3 Cg_endo -54.19 -30.29 60.54 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 C-N-CA 121.97 1.78 . . . . 1.0 111.767 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.529 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -96.27 -55.14 3.04 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.843 0.354 . . . . 1.0 110.273 -178.832 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.4 mt -117.4 125.28 50.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.867 -0.606 . . . . 1.0 110.274 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -93.59 -9.77 36.97 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.825 -0.625 . . . . 1.0 111.752 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.476 ' CD ' HD21 ' A' ' 34' ' ' ASN . 43.5 ttm180 -147.32 -63.71 0.28 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.737 -178.228 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 51.8 t 71.01 83.61 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.31 0.381 . . . . 1.0 110.06 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.476 HD21 ' CD ' ' A' ' 32' ' ' ARG . 92.1 m-20 -97.29 5.74 49.47 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.945 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.553 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 2.0 t -160.32 158.05 29.07 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.67 -0.412 . . . . 1.0 109.978 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.99 155.37 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.048 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.6 mtp85 -133.54 121.66 22.44 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 108.506 -0.924 . . . . 1.0 108.506 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -107.51 117.78 53.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.397 0.618 . . . . 1.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -77.24 -43.64 32.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.91 -1.041 . . . . 1.0 110.508 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.4 t -163.38 162.89 25.16 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.31 176.33 48.58 Favored Glycine 0 C--N 1.317 -0.508 0 N-CA-C 110.982 -0.847 . . . . 1.0 110.982 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.4 m -112.09 126.29 55.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.571 -0.529 . . . . 1.0 109.571 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.667 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 50.8 m95 -115.31 149.28 38.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.856 -0.611 . . . . 1.0 111.091 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.695 ' C ' HD23 ' A' ' 45' ' ' LEU . 2.1 ttt -128.46 133.27 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.408 -0.814 . . . . 1.0 109.592 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.695 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -110.84 140.33 45.38 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.761 -178.804 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.401 ' CD1' ' N ' ' A' ' 46' ' ' TYR . 27.5 m-85 -113.48 132.38 55.68 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.269 0.556 . . . . 1.0 110.898 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.572 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.2 pt-20 -60.34 -36.19 77.41 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.539 -0.755 . . . . 1.0 110.263 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -100.87 151.53 37.63 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.286 -0.87 . . . . 1.0 110.038 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -55.32 149.77 44.44 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 121.792 1.662 . . . . 1.0 110.689 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.602 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.5 m-20 71.24 -116.88 0.08 Allowed 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.572 -0.899 . . . . 1.0 108.572 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -151.74 70.92 0.96 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.778 -0.646 . . . . 1.0 109.884 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -138.08 15.4 2.84 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.82 0.343 . . . . 1.0 110.903 -178.271 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.8 -176.66 14.5 Favored Glycine 0 C--N 1.321 -0.285 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.572 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.5 tp -51.75 150.0 4.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -123.87 153.39 41.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.911 0.386 . . . . 1.0 110.877 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -132.46 125.9 31.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.159 178.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.403 ' C ' HD12 ' A' ' 58' ' ' LEU . 52.8 t80 -83.9 124.02 30.55 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.255 -0.429 . . . . 1.0 110.414 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.403 HD12 ' C ' ' A' ' 57' ' ' PHE . 7.3 mp -121.15 146.86 46.32 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.351 0.596 . . . . 1.0 110.383 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.402 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtp180 -132.67 160.41 36.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.108 -0.951 . . . . 1.0 110.562 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 59' ' ' ARG . 79.6 ttt-85 -38.47 125.04 1.34 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.617 -0.719 . . . . 1.0 110.441 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.59 -179.73 32.2 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.382 -1.087 . . . . 1.0 110.382 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -114.63 131.8 56.59 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.866 0.365 . . . . 1.0 110.297 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.11 113.34 17.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.049 -0.523 . . . . 1.0 109.851 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.32 -4.18 56.09 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.416 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 72.1 m-20 -147.43 141.99 26.53 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.502 ' C ' ' H ' ' A' ' 68' ' ' GLN . 15.5 p-80 -62.12 -41.75 98.55 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.466 . . . . 1.0 111.215 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -53.73 -6.51 0.08 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.702 -0.681 . . . . 1.0 110.363 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.502 ' H ' ' C ' ' A' ' 66' ' ' HIS . 19.4 mm-40 -83.66 -34.86 24.92 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.613 -0.435 . . . . 1.0 111.354 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.489 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -94.13 18.21 11.19 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.668 -0.413 . . . . 1.0 110.901 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.626 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 4.2 mtt 80.03 17.23 0.72 Allowed 'General case' 0 C--N 1.338 0.096 0 O-C-N 123.593 0.558 . . . . 1.0 110.774 -178.2 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.855 0 N-CA-C 110.097 -1.201 . . . . 1.0 110.097 178.878 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -115.65 4.2 14.06 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 120.667 0.27 . . . . 1.0 111.514 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.7 p -162.84 160.93 25.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.058 0.456 . . . . 1.0 110.584 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.77 148.29 22.43 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.577 -0.738 . . . . 1.0 110.605 -178.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.592 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.5 ptm180 -128.18 150.03 50.18 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 110.027 -0.361 . . . . 1.0 110.027 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.77 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.6 tt -101.8 124.27 47.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.887 -0.783 . . . . 1.0 108.887 178.51 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.77 ' N ' HD23 ' A' ' 81' ' ' LEU . 6.4 mt -85.34 116.09 64.07 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 115.99 -0.55 . . . . 1.0 109.974 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo . . . . . 0 N--CA 1.498 1.761 0 C-N-CA 122.364 2.043 . . . . 1.0 113.107 179.882 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 CA--C 1.52 -0.199 0 N-CA-C 109.712 -0.477 . . . . 1.0 109.712 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 6.6 m-70 -134.91 120.01 18.74 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 121.116 -0.233 . . . . 1.0 110.932 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -146.55 133.57 20.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.3 tt -147.2 150.53 14.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.605 -0.271 . . . . 1.0 110.494 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -126.5 98.11 5.29 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.947 -0.57 . . . . 1.0 111.697 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.11 129.81 38.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.537 . . . . 1.0 110.136 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.571 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 46.1 m-85 -107.68 136.53 47.28 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.363 -0.835 . . . . 1.0 110.944 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.528 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.91 -69.45 0.16 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.832 -0.622 . . . . 1.0 111.761 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 33.2 mtt-85 -96.85 176.44 5.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.744 -0.662 . . . . 1.0 110.892 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 59.1 mp0 . . . . . 0 CA--C 1.509 -0.598 0 CA-C-N 115.391 -0.822 . . . . 1.0 109.445 179.985 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -58.42 148.58 27.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.037 -0.357 . . . . 1.0 110.037 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.571 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 7.9 ttp -131.63 152.42 50.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.995 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.475 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.1 tt -146.92 141.67 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.171 -0.678 . . . . 1.0 109.171 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -111.29 141.55 44.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.406 0.622 . . . . 1.0 110.466 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.86 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 79.7 m-85 -129.42 153.53 47.84 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 114.714 -1.13 . . . . 1.0 110.42 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -141.66 29.9 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.641 -0.708 . . . . 1.0 110.738 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -170.94 -167.81 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.461 -0.495 . . . . 1.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.438 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 55.3 p-10 -76.83 144.83 38.82 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.69 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 6.2 m -135.02 89.43 2.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.997 -0.547 . . . . 1.0 109.779 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.1 m -64.46 -36.35 83.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.834 0.349 . . . . 1.0 111.454 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.0 m -131.65 84.96 2.21 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.426 0.631 . . . . 1.0 110.323 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.86 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.4 tp -59.27 -38.95 81.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.097 -0.956 . . . . 1.0 110.019 -178.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.648 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.5 mp0 -43.45 -9.64 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.281 -0.418 . . . . 1.0 111.511 178.652 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.587 ' N ' ' O ' ' A' ' 112' ' ' LEU . 87.2 m-20 -93.89 -21.94 18.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.982 0.42 . . . . 1.0 110.86 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.4 mmt180 -110.11 -38.65 5.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.974 -0.557 . . . . 1.0 112.383 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.729 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -118.95 137.28 53.6 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.756 1.265 . . . . 1.0 111.142 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 118' ' ' PHE . 84.5 mmt-85 -73.78 -74.32 0.19 Allowed 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.275 -1.516 . . . . 1.0 110.364 -178.531 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.686 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 91.5 m-85 -31.53 143.65 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 123.499 0.499 . . . . 1.0 110.598 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -104.73 11.69 33.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 1.0 110.726 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -140.0 139.38 36.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.237 0.541 . . . . 1.0 110.902 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.675 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 44.4 mm -120.41 123.46 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.369 -0.832 . . . . 1.0 109.51 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.447 ' O ' ' CB ' ' A' ' 123' ' ' SER . 20.4 m-70 -110.8 22.25 15.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.516 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.591 ' C ' HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER 165.2 157.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.921 -0.312 . . . . 1.0 110.479 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.699 ' N ' HD13 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -158.91 164.01 36.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.184 179.745 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -130.46 103.4 6.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.284 -0.636 . . . . 1.0 109.284 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.519 HG13 ' H ' ' A' ' 149' ' ' GLY . 0.6 OUTLIER -101.4 110.42 28.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.7 -0.852 . . . . 1.0 108.7 179.234 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.955 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.3 OUTLIER -81.66 -39.22 24.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.419 -0.809 . . . . 1.0 111.249 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.484 ' O ' ' O ' ' A' ' 129' ' ' GLY . 43.6 mm-40 -121.53 160.34 24.46 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.372 0.606 . . . . 1.0 111.039 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 34.62 -159.4 0.01 OUTLIER Glycine 0 CA--C 1.53 1.016 0 CA-C-N 114.191 -1.368 . . . . 1.0 110.993 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 1.7 t -120.26 -175.93 3.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.994 0.426 . . . . 1.0 109.891 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 130' ' ' SER . 75.0 m95 -150.71 168.97 22.75 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.269 -178.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 57.5 t -137.42 131.44 44.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.534 -0.543 . . . . 1.0 109.534 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.07 143.0 33.86 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 110.205 -0.295 . . . . 1.0 110.205 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 134' ' ' TYR . . . . . 0.526 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 14.2 m-85 -119.17 133.22 55.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.445 -0.343 . . . . 1.0 110.088 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.421 ' OE2' ' O ' ' A' ' 135' ' ' GLU . 4.3 tm-20 -50.89 -29.86 13.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.088 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -139.79 176.7 8.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.119 0.485 . . . . 1.0 110.107 -179.523 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.2 m -82.8 171.76 13.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.329 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 10.1 m120 64.78 18.33 11.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.114 -0.948 . . . . 1.0 110.247 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.455 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 3.2 m-85 37.39 79.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.663 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 50.4 ttm-85 -148.55 37.51 0.83 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.968 0.414 . . . . 1.0 110.422 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -149.36 -144.33 3.93 Favored Glycine 0 CA--C 1.521 0.442 0 N-CA-C 111.333 -0.707 . . . . 1.0 111.333 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -73.01 159.06 34.25 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.077 -0.342 . . . . 1.0 110.077 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.626 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 88.6 mt-30 -138.81 134.6 33.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.007 -0.542 . . . . 1.0 111.047 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -129.65 140.72 51.08 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.291 -0.633 . . . . 1.0 109.291 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.53 ' C ' HD22 ' A' ' 146' ' ' LEU . 43.1 tp -95.95 128.37 42.78 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.725 0.641 . . . . 1.0 110.588 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.862 HD22 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -113.45 96.92 6.14 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.971 -1.013 . . . . 1.0 109.764 179.73 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.592 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.6 OUTLIER -68.89 154.57 94.77 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 114.89 -1.05 . . . . 1.0 110.235 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 148' ' ' PRO . . . . . 0.452 ' HA ' HG13 ' A' ' 126' ' ' VAL . 18.5 Cg_endo -56.55 112.97 1.25 Allowed 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.233 1.955 . . . . 1.0 111.372 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.519 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 176.06 -150.83 10.98 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.421 -1.072 . . . . 1.0 110.421 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -128.66 125.76 38.74 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.298 -0.451 . . . . 1.0 111.175 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.551 ' CD1' ' CD2' ' A' ' 124' ' ' LEU . 3.8 m-85 -117.66 128.38 54.86 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.315 -0.624 . . . . 1.0 109.315 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -107.47 -5.22 17.76 Favored 'General case' 0 CA--C 1.518 -0.25 0 O-C-N 123.685 0.616 . . . . 1.0 110.797 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -154.13 172.22 17.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.688 -0.687 . . . . 1.0 110.545 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.443 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 26.6 p90 -85.21 -21.82 28.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.097 -0.956 . . . . 1.0 112.495 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -64.53 -23.29 67.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.006 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 156' ' ' ASP . . . . . 0.505 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.3 t0 -44.2 -54.33 5.74 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.946 0.403 . . . . 1.0 111.068 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.671 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 28.7 p90 -92.67 24.13 3.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.753 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 50.39 75.23 0.22 Allowed Glycine 0 CA--C 1.52 0.383 0 N-CA-C 111.217 -0.753 . . . . 1.0 111.217 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.671 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.65 145.67 46.26 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.884 -0.413 . . . . 1.0 109.884 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.7 t -76.23 -10.73 59.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.92 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.503 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 30.2 t-20 -171.95 -164.53 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.449 -0.5 . . . . 1.0 110.156 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.871 ' O ' HG23 ' A' ' 164' ' ' VAL . . . -112.13 -16.42 13.03 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 116.37 -0.377 . . . . 1.0 110.328 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.437 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.7 mtt180 -30.12 116.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.285 0.365 . . . . 1.0 111.751 -178.407 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.871 HG23 ' O ' ' A' ' 162' ' ' ALA . 57.6 t -126.43 162.9 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.135 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.609 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -146.07 -34.85 0.06 OUTLIER Glycine 0 CA--C 1.516 0.133 0 N-CA-C 111.604 -0.598 . . . . 1.0 111.604 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 11.6 p -160.19 173.0 16.4 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 120.932 0.396 . . . . 1.0 110.753 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.614 HD21 HD13 ' A' ' 112' ' ' LEU . 1.1 pt? -158.59 154.19 26.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 1.0 112.186 -179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.526 ' NE ' ' OH ' ' A' ' 134' ' ' TYR . 17.0 ptp180 -145.35 153.49 41.29 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.409 -0.517 . . . . 1.0 110.441 178.766 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.441 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -82.04 149.14 28.25 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.43 -0.581 . . . . 1.0 109.43 177.805 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.795 ' C ' HD12 ' A' ' 171' ' ' ILE . 25.9 m -81.73 78.12 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.373 0.606 . . . . 1.0 112.416 -178.412 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.795 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.9 mp . . . . . 0 C--N 1.329 -0.285 0 O-C-N 121.834 -0.541 . . . . 1.0 110.181 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.541 0 N-CA-C 110.456 -1.057 . . . . 1.0 110.456 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LYS . . . . . 0.553 ' NZ ' ' OE2' ' A' ' 18' ' ' GLU . 59.5 tttm -173.18 102.16 0.13 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.534 0.206 . . . . 1.0 110.66 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.409 HD13 ' O ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER -119.6 169.87 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.853 -178.385 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.489 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.6 m -129.37 123.27 31.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.41 -0.959 . . . . 1.0 108.41 177.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.6 mt -107.83 133.09 52.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.941 -1.027 . . . . 1.0 110.184 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.489 ' CE1' HG22 ' A' ' 5' ' ' THR . 47.9 m-85 -115.36 126.22 54.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.346 -0.843 . . . . 1.0 111.111 -178.846 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -52.9 -32.96 48.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.626 -0.715 . . . . 1.0 110.664 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -115.42 150.0 37.11 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.304 0.574 . . . . 1.0 110.481 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' C ' ' N ' ' A' ' 12' ' ' PHE . 20.1 ptt-85 -54.93 -173.32 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.613 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.32 23.22 0.26 Allowed Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.427 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.3 m-85 52.78 68.24 0.86 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.482 -0.359 . . . . 1.0 110.287 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -130.41 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.0 0.429 . . . . 1.0 110.516 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.82 -150.76 0.25 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.943 -0.863 . . . . 1.0 110.943 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -69.71 146.9 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.804 0.335 . . . . 1.0 110.622 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -136.26 144.14 44.64 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.279 0.561 . . . . 1.0 110.433 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.556 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.2 t80 -137.81 141.52 40.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.309 -0.86 . . . . 1.0 109.893 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.556 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 17.2 tt0 -111.22 122.17 47.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.368 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.8 126.3 53.64 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.627 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -117.99 13.33 13.92 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.745 -0.662 . . . . 1.0 110.377 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.0 m -158.21 168.18 27.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.647 -178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.34 140.64 53.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.534 -0.757 . . . . 1.0 111.211 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.88 153.1 49.59 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.534 -0.757 . . . . 1.0 110.601 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.7 p -120.88 -11.46 8.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.437 -0.801 . . . . 1.0 112.4 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -150.15 116.44 5.72 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.42 0.629 . . . . 1.0 110.897 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.426 ' O ' ' N ' ' A' ' 30' ' ' LEU . 6.5 mp -110.4 -3.11 16.29 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.483 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.589 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 35.8 mt-30 -52.95 -51.23 76.52 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.948 -0.301 . . . . 1.0 110.597 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.589 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 17.1 Cg_endo -54.76 -35.93 89.23 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 121.274 1.316 . . . . 1.0 112.292 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -94.81 -51.31 4.75 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 120.177 -0.609 . . . . 1.0 111.001 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.426 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.2 mt -118.19 127.61 53.91 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.618 -0.719 . . . . 1.0 110.824 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.3 t -94.24 -10.41 33.03 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.76 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -145.7 -58.79 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.749 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 41.0 t 62.58 80.73 0.22 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -96.57 4.78 51.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.573 -0.285 . . . . 1.0 111.245 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.6 p -155.88 157.6 36.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.864 0.364 . . . . 1.0 110.368 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.71 154.71 34.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.967 -178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -134.79 123.32 23.4 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.732 -0.84 . . . . 1.0 108.732 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.4 t -108.75 133.5 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -96.74 -41.48 8.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.367 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.8 p -160.85 157.28 26.4 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.99 176.28 49.38 Favored Glycine 0 C--N 1.315 -0.583 0 N-CA-C 110.924 -0.87 . . . . 1.0 110.924 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.9 m -112.55 147.19 37.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.403 ' CE2' HD13 ' A' ' 81' ' ' LEU . 51.8 m95 -132.46 151.28 51.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 1.0 110.776 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.563 ' C ' HD12 ' A' ' 45' ' ' LEU . 13.9 tpp -124.19 129.01 50.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.133 -1.062 . . . . 1.0 108.133 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.564 HD23 HG21 ' A' ' 76' ' ' VAL . 10.4 mp -109.81 131.46 55.04 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.101 -0.499 . . . . 1.0 109.858 -179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -109.19 129.52 55.49 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.899 0.38 . . . . 1.0 111.927 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 19.7 pt-20 -53.61 -32.32 50.68 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.418 -0.81 . . . . 1.0 111.097 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.758 ' CG ' ' H ' ' A' ' 53' ' ' GLY . 20.0 pt20 -113.83 156.72 43.4 Favored Pre-proline 0 CA--C 1.514 -0.404 0 N-CA-C 109.442 -0.577 . . . . 1.0 109.442 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -56.39 147.39 68.28 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 121.127 1.218 . . . . 1.0 111.968 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.527 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER 82.88 -124.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.279 -1.328 . . . . 1.0 109.588 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.3 m-85 -150.12 75.05 1.23 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.052 179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.459 ' CB ' ' NE2' ' A' ' 48' ' ' GLN . 0.4 OUTLIER -134.78 -56.52 0.83 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 112.455 0.539 . . . . 1.0 112.455 -178.01 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.758 ' H ' ' CG ' ' A' ' 48' ' ' GLN . . . -61.97 -163.05 0.26 Allowed Glycine 0 C--N 1.314 -0.677 0 C-N-CA 120.07 -1.062 . . . . 1.0 111.305 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.497 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.7 tp -59.02 147.61 33.94 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.908 -0.646 . . . . 1.0 110.143 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -121.34 149.8 42.4 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.994 0.184 . . . . 1.0 110.864 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.45 ' O ' ' SD ' ' A' ' 44' ' ' MET . 22.0 m-85 -126.51 127.1 44.81 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.151 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.467 ' C ' HD22 ' A' ' 58' ' ' LEU . 55.9 t80 -81.71 121.63 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.558 0.694 . . . . 1.0 109.692 -179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 ' C ' ' A' ' 57' ' ' PHE . 4.0 mm? -111.87 132.57 54.63 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 114.769 -1.105 . . . . 1.0 109.77 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.7 ttp180 -127.96 156.03 43.32 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.287 -0.869 . . . . 1.0 109.746 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' A' ' 59' ' ' ARG . 36.9 ptt180 -37.35 126.87 1.05 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.763 -0.653 . . . . 1.0 111.454 -178.376 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.9 -178.3 30.09 Favored Glycine 0 CA--C 1.521 0.459 0 N-CA-C 111.166 -0.773 . . . . 1.0 111.166 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.0 p-10 -116.43 127.48 54.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.094 0.474 . . . . 1.0 110.335 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -121.47 113.27 19.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.272 -0.64 . . . . 1.0 109.272 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.432 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.49 -4.6 53.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.381 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 81.9 m-20 -147.89 133.53 18.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.137 -0.69 . . . . 1.0 109.137 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.5 ' C ' ' H ' ' A' ' 68' ' ' GLN . 16.1 p-80 -56.17 -40.97 74.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 1.0 111.127 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLN . . . . . 0.431 ' HG3' ' CE1' ' A' ' 66' ' ' HIS . 93.5 mt-30 -51.93 -8.36 0.07 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.537 179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.2 mm-40 -84.39 -32.93 23.91 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.838 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -96.57 17.94 15.22 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 121.021 -0.272 . . . . 1.0 111.43 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.436 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 41.1 mtt 82.9 9.86 0.62 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 123.941 0.775 . . . . 1.0 109.815 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.406 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.343 0.964 0 C-N-CA 120.306 -0.949 . . . . 1.0 111.218 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.564 HG21 HD23 ' A' ' 45' ' ' LEU . 1.4 p . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 120.671 0.272 . . . . 1.0 111.044 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 26' ' ' LEU . 89.8 mtm180 -110.68 9.43 22.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.271 -0.422 . . . . 1.0 110.692 -177.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.4 p -160.46 159.27 30.67 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.497 0.665 . . . . 1.0 110.968 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.9 p -154.66 146.49 23.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.081 -0.963 . . . . 1.0 110.356 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -127.67 146.4 50.57 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.795 0.331 . . . . 1.0 110.108 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.403 HD13 ' CE2' ' A' ' 43' ' ' TRP . 21.9 tp -94.44 126.76 39.91 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.451 -0.944 . . . . 1.0 108.451 178.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mt -91.32 114.94 63.35 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 109.222 -0.658 . . . . 1.0 109.222 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 N--CA 1.499 1.824 0 C-N-CA 122.087 1.858 . . . . 1.0 113.479 -179.837 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 CA--C 1.523 -0.076 0 CA-C-O 120.903 0.382 . . . . 1.0 110.157 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.1 m-70 -137.26 112.2 8.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.803 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.466 ' HE ' HD23 ' A' ' 127' ' ' LEU . 61.4 ttp180 -140.18 135.02 31.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.699 0.285 . . . . 1.0 110.27 178.667 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.9 tt -148.93 145.76 17.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.929 -0.309 . . . . 1.0 110.813 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -126.14 97.37 5.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.73 -0.668 . . . . 1.0 111.352 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.95 142.57 39.98 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.166 0.508 . . . . 1.0 111.187 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -117.59 134.8 54.48 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.367 -0.833 . . . . 1.0 110.86 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.437 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.2 tm-20 -53.45 -61.79 2.07 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.568 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.442 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.4 mtp85 -100.33 170.48 8.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.364 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.713 -0.676 . . . . 1.0 110.43 179.067 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.689 0 N-CA-C 111.083 -0.807 . . . . 1.0 111.083 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.78 145.11 53.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.815 0.34 . . . . 1.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.2 ptm -131.41 157.24 43.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.262 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.7 tt -148.98 142.85 18.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 109.989 -0.374 . . . . 1.0 109.989 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -113.62 142.41 46.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.447 0.642 . . . . 1.0 110.84 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -129.5 156.66 43.78 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 114.556 -1.202 . . . . 1.0 110.331 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.6 p -143.61 26.06 1.61 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.586 -0.734 . . . . 1.0 110.636 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -167.74 -166.82 0.78 Allowed 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.627 -0.429 . . . . 1.0 110.37 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 54.2 p-10 -77.11 143.92 38.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.792 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.2 m -133.16 92.85 3.08 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.949 -0.569 . . . . 1.0 109.793 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.421 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.0 OUTLIER -67.2 -27.69 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.469 -0.332 . . . . 1.0 111.323 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 13.6 m -136.84 96.45 3.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.25 0.548 . . . . 1.0 110.863 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.519 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.4 tp -64.58 -44.25 91.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.346 -0.843 . . . . 1.0 110.44 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -47.87 -7.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.348 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.519 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.7 m-20 -96.21 -25.45 15.81 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.061 0.458 . . . . 1.0 110.318 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -108.78 -35.41 6.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.648 -0.705 . . . . 1.0 111.463 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.466 ' HB2' HD11 ' A' ' 112' ' ' LEU . 4.2 t80 -126.12 121.09 31.86 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.001 0.429 . . . . 1.0 109.898 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.3 mtt-85 -60.11 -65.92 0.6 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.225 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.437 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 94.0 m-85 -39.5 142.35 0.29 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -104.18 2.85 32.27 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.715 0.293 . . . . 1.0 111.345 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -131.72 137.4 48.23 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.241 0.543 . . . . 1.0 111.221 -178.073 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.68 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.5 mm -122.75 126.08 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.101 -0.954 . . . . 1.0 109.502 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 23.3 m-70 -113.64 18.13 17.74 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.105 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.0 p 173.84 153.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.987 0.422 . . . . 1.0 110.288 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.471 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.1 pp -162.75 156.71 20.68 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.443 -178.349 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -127.96 108.74 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.88 -0.6 . . . . 1.0 109.846 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.478 HG13 ' H ' ' A' ' 149' ' ' GLY . 0.7 OUTLIER -102.84 110.9 30.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.773 -0.825 . . . . 1.0 108.773 178.92 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.918 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -80.09 -39.25 30.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.033 -0.985 . . . . 1.0 111.158 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.512 ' O ' ' O ' ' A' ' 129' ' ' GLY . 66.3 mm-40 -137.6 169.15 18.27 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-O 121.853 0.835 . . . . 1.0 110.74 -179.011 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.83 177.58 0.01 OUTLIER Glycine 0 C--N 1.311 -0.853 0 CA-C-N 113.622 -1.626 . . . . 1.0 110.828 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -118.64 148.05 43.13 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.261 -0.644 . . . . 1.0 109.261 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.473 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 27.5 m95 -120.17 166.48 13.39 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.479 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.0 p -141.46 98.0 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.889 179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.419 HD23 ' HB3' ' A' ' 167' ' ' LEU . 10.7 mt -66.78 141.1 57.84 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.418 -0.513 . . . . 1.0 111.299 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -117.75 131.65 56.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.636 . . . . 1.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -45.3 -49.76 12.47 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.432 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.784 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -123.82 170.48 10.51 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.206 0.527 . . . . 1.0 110.179 -178.45 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.5 p -75.43 174.79 9.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.236 -0.893 . . . . 1.0 110.898 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 60.01 16.63 6.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.467 -1.242 . . . . 1.0 110.037 -179.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 40.06 78.01 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.718 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.784 ' C ' HD11 ' A' ' 136' ' ' LEU . 96.4 mtt180 -146.58 44.85 1.21 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.73 0.3 . . . . 1.0 110.551 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.521 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -158.39 -139.42 2.69 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 111.187 -0.765 . . . . 1.0 111.187 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -78.19 169.04 18.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.024 0.44 . . . . 1.0 109.942 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.432 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -147.83 139.21 23.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.757 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.7 m-85 -129.07 139.71 51.89 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.363 -0.977 . . . . 1.0 108.363 177.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.635 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -94.35 126.17 39.44 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.056 0.455 . . . . 1.0 110.743 -178.498 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.842 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.4 mm? -112.26 101.82 10.02 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.635 -0.711 . . . . 1.0 109.237 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.584 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.98 159.37 68.59 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.645 -0.707 . . . . 1.0 109.729 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -54.29 120.76 8.52 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.276 1.984 . . . . 1.0 111.844 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.478 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 166.3 -159.09 32.3 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 110.734 -0.947 . . . . 1.0 110.734 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.487 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 67.8 t0 -119.47 135.21 54.86 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.192 -0.504 . . . . 1.0 110.645 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.487 ' N ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 m-85 -126.55 128.45 46.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.017 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -115.4 -5.53 12.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.991 0.424 . . . . 1.0 110.332 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -154.25 161.13 42.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.843 -0.617 . . . . 1.0 110.436 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.419 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -76.18 -20.32 57.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.898 -1.047 . . . . 1.0 112.443 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -68.97 -18.69 64.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.981 0.419 . . . . 1.0 111.021 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -51.06 -49.04 61.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.973 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.716 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 16.0 p90 -97.29 21.86 9.46 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.244 -0.434 . . . . 1.0 110.568 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.05 74.83 0.26 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.009 -0.836 . . . . 1.0 111.009 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.716 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.94 149.24 41.23 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 121.034 0.445 . . . . 1.0 110.211 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -80.39 -10.5 59.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.014 178.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.525 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 5.6 t-20 -172.22 -170.52 0.74 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.456 -0.498 . . . . 1.0 110.406 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.68 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.72 -13.31 14.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.493 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -43.35 121.31 2.18 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.51 0.671 . . . . 1.0 111.504 -178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 162' ' ' ALA . 38.5 t -133.08 131.85 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.422 -0.808 . . . . 1.0 109.876 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.65 -29.29 3.93 Favored Glycine 0 N--CA 1.464 0.529 0 N-CA-C 111.477 -0.649 . . . . 1.0 111.477 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 110' ' ' SER . 21.0 m -162.98 174.42 12.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.905 0.383 . . . . 1.0 110.988 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.419 ' HB3' HD23 ' A' ' 133' ' ' LEU . 0.4 OUTLIER -154.79 139.72 17.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 1.0 111.015 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.555 ' O ' HG12 ' A' ' 132' ' ' VAL . 2.0 ttm180 -129.28 144.81 51.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.59 0.71 . . . . 1.0 109.485 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.811 ' CD ' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -79.27 150.43 31.54 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.314 -1.312 . . . . 1.0 109.083 178.803 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.468 ' C ' HD12 ' A' ' 171' ' ' ILE . 58.3 t -90.21 81.23 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.927 0.394 . . . . 1.0 111.375 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.468 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.1 mp . . . . . 0 C--N 1.329 -0.301 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.516 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.525 0.711 0 N-CA-C 110.534 -1.027 . . . . 1.0 110.534 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -171.11 111.32 0.35 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.107 -0.237 . . . . 1.0 110.734 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.441 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 171.18 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.173 0.511 . . . . 1.0 111.493 -178.854 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.46 HG22 ' CE1' ' A' ' 7' ' ' TYR . 31.0 m -128.16 120.34 27.11 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 177.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.5 mt -105.25 133.33 50.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.085 -0.961 . . . . 1.0 110.305 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.46 ' CE1' HG22 ' A' ' 5' ' ' THR . 73.5 m-85 -115.29 130.44 56.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.304 -178.429 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.453 ' O ' ' O ' ' A' ' 32' ' ' ARG . 84.0 tt0 -55.18 -24.22 25.82 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.643 -0.708 . . . . 1.0 110.244 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -124.94 161.81 25.83 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.302 0.572 . . . . 1.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 19.4 ptt180 -65.62 -173.81 0.17 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.47 -0.786 . . . . 1.0 111.048 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.8 25.25 0.57 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.815 -0.914 . . . . 1.0 110.815 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 51.6 67.85 0.89 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.648 -0.276 . . . . 1.0 110.312 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -129.64 -156.8 0.78 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.961 0.41 . . . . 1.0 110.523 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.43 -149.73 0.41 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -71.71 148.26 46.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.717 0.294 . . . . 1.0 110.577 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 7.8 p80 -135.98 149.72 48.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.391 0.615 . . . . 1.0 110.299 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.3 t80 -144.13 141.86 30.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.196 -0.911 . . . . 1.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.557 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.1 tt0 -110.57 121.38 45.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.467 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 t -108.85 126.01 52.6 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.943 0.401 . . . . 1.0 110.734 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 84.4 p -117.75 12.58 13.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.723 -0.672 . . . . 1.0 110.529 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -156.46 172.49 18.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.654 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -62.18 138.85 58.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.574 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.59 143.23 47.23 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.328 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.423 HG22 ' CE2' ' A' ' 51' ' ' TYR . 19.0 p -111.21 -17.41 13.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.774 -0.648 . . . . 1.0 112.067 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -150.53 112.16 4.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.145 0.498 . . . . 1.0 110.208 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.0 mt -108.84 2.39 21.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 46.0 mt-30 -52.05 -51.57 70.06 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.214 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.3 Cg_endo -55.96 -34.97 93.62 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.509 1.473 . . . . 1.0 112.789 -178.722 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -91.27 -45.91 8.35 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.183 0.516 . . . . 1.0 110.807 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.7 mt -122.66 129.06 51.42 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.509 -0.768 . . . . 1.0 111.305 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -92.4 -14.67 28.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 8' ' ' GLU . 62.2 ttp180 -176.47 119.69 0.14 Allowed 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 108.745 -0.835 . . . . 1.0 108.745 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -99.2 112.97 25.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.677 0.275 . . . . 1.0 110.598 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -105.0 -4.44 22.04 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.598 0.237 . . . . 1.0 110.473 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.6 p -157.1 157.78 35.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.91 0.386 . . . . 1.0 110.552 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 154.79 34.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.069 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -132.81 122.06 23.9 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 108.783 -0.821 . . . . 1.0 108.783 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.18 115.89 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.276 0.56 . . . . 1.0 110.028 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -77.58 -42.18 36.14 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.936 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.5 t -163.6 159.86 22.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 109.223 -0.658 . . . . 1.0 109.223 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.17 177.5 50.91 Favored Glycine 0 C--N 1.315 -0.623 0 N-CA-C 111.057 -0.817 . . . . 1.0 111.057 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.5 m -112.62 141.27 46.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.344 -0.613 . . . . 1.0 109.344 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.613 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 55.0 m95 -130.37 141.01 50.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.145 0.497 . . . . 1.0 110.903 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.549 ' C ' HD12 ' A' ' 45' ' ' LEU . 12.6 tpp -114.86 130.81 56.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.55 -0.75 . . . . 1.0 109.457 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.549 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -109.34 130.25 55.5 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.796 -0.638 . . . . 1.0 109.448 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.426 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 90.2 m-85 -109.71 133.42 53.15 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.429 0.633 . . . . 1.0 111.671 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.625 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.55 -35.57 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.259 -0.882 . . . . 1.0 111.402 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.8 mt-30 -109.42 152.83 42.92 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.562 -179.009 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.439 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 35.0 Cg_endo -63.59 158.68 44.58 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.446 2.097 . . . . 1.0 112.493 178.393 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 63.84 37.03 9.97 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.937 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.426 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.2 m-85 50.06 76.12 0.15 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.306 -0.861 . . . . 1.0 111.108 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.6 m -144.04 153.12 41.87 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.009 0.433 . . . . 1.0 110.313 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 -148.63 21.77 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.053 -0.594 . . . . 1.0 111.88 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.625 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.8 tp -75.58 143.74 42.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.368 -0.416 . . . . 1.0 110.59 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.573 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.6 OUTLIER -120.18 153.25 36.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.581 0.229 . . . . 1.0 110.486 179.543 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.425 ' O ' ' SD ' ' A' ' 44' ' ' MET . 29.6 m-85 -126.45 124.63 40.58 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.932 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -83.8 122.51 28.77 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.178 0.513 . . . . 1.0 110.146 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 mp -119.85 145.36 46.73 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.636 -0.711 . . . . 1.0 109.973 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.642 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 68.4 mtm180 -132.26 158.57 41.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.541 -0.754 . . . . 1.0 109.949 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.413 ' C ' ' O ' ' A' ' 59' ' ' ARG . 61.6 ttp180 -36.1 126.48 0.75 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.032 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.61 -178.89 32.83 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.501 -1.039 . . . . 1.0 110.501 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -115.31 129.46 56.61 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.008 0.432 . . . . 1.0 110.154 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -123.53 113.04 18.2 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.996 -0.547 . . . . 1.0 109.538 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.89 -3.75 54.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.249 -0.432 . . . . 1.0 111.654 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -146.6 137.22 23.94 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.971 -0.751 . . . . 1.0 108.971 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.446 ' C ' ' H ' ' A' ' 68' ' ' GLN . 9.9 p-80 -57.98 -41.64 83.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 1.0 110.694 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.63 -8.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.807 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 66' ' ' HIS . 22.8 mm-40 -81.57 -34.09 31.25 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.647 -0.421 . . . . 1.0 111.317 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.41 ' O ' ' HB2' ' A' ' 70' ' ' MET . 2.5 p90 -94.75 17.41 13.58 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.871 -0.331 . . . . 1.0 110.86 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.41 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 58.2 mtt 72.71 28.99 2.04 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 124.209 0.943 . . . . 1.0 110.128 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.401 ' HA2' ' CE1' ' A' ' 56' ' ' TYR . . . . . . . . 0 N--CA 1.444 -0.822 0 C-N-CA 120.667 -0.777 . . . . 1.0 111.599 -179.188 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 108.981 -0.748 . . . . 1.0 108.981 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.439 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.3 mtm-85 -123.23 12.29 9.51 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.003 -0.544 . . . . 1.0 111.468 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.1 p -163.38 163.13 25.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.182 0.515 . . . . 1.0 110.592 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.4 p -157.58 148.37 21.19 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.489 -0.778 . . . . 1.0 110.546 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -128.08 150.18 50.07 Favored 'General case' 0 CA--C 1.513 -0.442 0 N-CA-C 109.844 -0.428 . . . . 1.0 109.844 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.713 HD23 ' N ' ' A' ' 82' ' ' ILE . 3.7 tt -101.69 121.71 42.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.825 -1.176 . . . . 1.0 107.825 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.713 ' N ' HD23 ' A' ' 81' ' ' LEU . 7.2 mt -86.08 120.41 72.45 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.011 -178.911 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo . . . . . 0 N--CA 1.496 1.655 0 C-N-CA 121.598 1.532 . . . . 1.0 113.077 -179.844 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.7 p . . . . . 0 CA--C 1.515 -0.378 0 N-CA-C 109.881 -0.414 . . . . 1.0 109.881 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -127.58 102.48 6.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.895 0.332 . . . . 1.0 111.895 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 57.1 mtt180 -136.06 138.21 41.9 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.669 -0.413 . . . . 1.0 110.598 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.429 HD12 HG22 ' A' ' 126' ' ' VAL . 19.3 tt -148.44 144.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-N 116.483 -0.326 . . . . 1.0 110.847 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -122.87 97.91 5.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.367 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.47 139.8 39.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.449 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -120.17 135.76 54.86 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.892 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.51 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.42 -62.36 1.77 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.817 -0.629 . . . . 1.0 111.239 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 34.7 mtt-85 -99.18 165.25 11.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.278 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 . . . . . 0 CA--C 1.511 -0.551 0 CA-C-N 115.648 -0.705 . . . . 1.0 110.06 178.806 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.321 0 N-CA-C 110.393 -1.083 . . . . 1.0 110.393 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -66.2 140.23 58.16 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.535 -0.466 . . . . 1.0 110.235 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.8 ptm -132.26 154.19 49.89 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.122 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tt -148.16 140.6 18.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.436 -0.579 . . . . 1.0 109.436 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.53 143.04 44.37 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.717 0.77 . . . . 1.0 110.68 -179.095 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.832 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 88.0 m-85 -129.38 154.25 47.09 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 114.764 -1.107 . . . . 1.0 110.472 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.24 22.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.541 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.61 -170.66 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.625 -0.43 . . . . 1.0 110.552 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 54.5 p-10 -77.91 144.15 37.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.741 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.8 m -137.0 93.1 2.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.09 -31.21 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.034 0.445 . . . . 1.0 111.086 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.7 m -136.82 90.3 2.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.408 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.832 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.9 tp -60.48 -39.84 89.13 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.19 -178.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.627 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.1 mp0 -43.69 -9.19 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.147 -0.479 . . . . 1.0 112.268 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.8 t0 -94.69 -22.07 18.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.163 0.506 . . . . 1.0 110.215 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 112' ' ' LEU . 82.5 mmt-85 -107.93 -37.14 6.17 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.446 -0.797 . . . . 1.0 112.821 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.664 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.67 136.84 54.73 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 122.51 1.148 . . . . 1.0 110.752 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.444 ' O ' ' C ' ' A' ' 118' ' ' PHE . 71.1 mtp180 -72.55 -71.46 0.29 Allowed 'General case' 0 C--N 1.315 -0.933 0 O-C-N 120.718 -1.239 . . . . 1.0 110.684 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.608 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.1 m-85 -34.61 146.4 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.631 . . . . 1.0 110.31 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -105.14 8.02 33.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.796 0.332 . . . . 1.0 110.713 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -139.02 142.27 38.28 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.238 0.542 . . . . 1.0 110.816 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.71 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.5 mm -121.3 123.2 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 115.566 -0.743 . . . . 1.0 109.267 178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.404 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 19.6 m-70 -112.14 24.54 12.49 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.501 -0.318 . . . . 1.0 111.634 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 1.6 p 166.28 150.54 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.074 0.464 . . . . 1.0 109.94 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.477 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 0.9 OUTLIER -161.29 156.94 24.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.286 -178.78 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -122.76 115.7 22.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.429 HG22 HD12 ' A' ' 90' ' ' ILE . 24.4 t -100.56 105.18 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.111 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.885 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.21 -44.39 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 1.0 110.774 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -159.1 158.56 33.18 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.747 0.308 . . . . 1.0 110.861 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.54 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.16 73.84 0.68 Allowed Glycine 0 CA--C 1.508 -0.348 0 C-N-CA 121.45 -0.405 . . . . 1.0 112.38 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 129' ' ' GLY . 8.1 t -31.87 146.78 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.899 0.381 . . . . 1.0 110.596 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.54 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 30.8 m95 -122.1 169.23 11.07 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.075 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.3 p -141.47 96.86 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 121.017 0.437 . . . . 1.0 110.756 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.4 mt -68.04 142.01 56.01 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.04 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -118.15 130.75 56.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.785 -0.643 . . . . 1.0 109.98 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -44.25 -48.61 9.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.999 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.68 175.28 6.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.442 0.639 . . . . 1.0 110.57 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.8 m -81.45 172.35 13.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.522 -0.763 . . . . 1.0 110.817 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 63.0 t30 64.04 17.24 10.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 37.01 78.88 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.952 -0.567 . . . . 1.0 111.665 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.43 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 49.6 ttp180 -148.52 39.7 0.9 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.12 0.486 . . . . 1.0 110.302 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.448 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -152.83 -137.67 2.57 Favored Glycine 0 N--CA 1.465 0.571 0 N-CA-C 111.157 -0.777 . . . . 1.0 111.157 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -80.27 167.81 19.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.102 0.477 . . . . 1.0 110.308 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.573 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -146.58 141.97 27.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.544 -0.753 . . . . 1.0 111.11 -179.08 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 144' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 9.0 m-85 -130.76 142.27 50.4 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.341 -0.985 . . . . 1.0 108.341 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.57 ' C ' HD22 ' A' ' 146' ' ' LEU . 46.2 tp -94.84 124.2 38.74 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.169 0.509 . . . . 1.0 111.329 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.846 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.7 88.94 2.96 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.529 -0.76 . . . . 1.0 108.951 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 4.5 mtm -70.82 162.66 70.39 Favored Pre-proline 0 CA--C 1.531 0.246 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.22 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.23 116.69 3.22 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 121.621 1.547 . . . . 1.0 111.221 178.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.88 -157.46 22.61 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 110.698 -0.961 . . . . 1.0 110.698 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -128.04 114.52 17.18 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.04 0.447 . . . . 1.0 110.519 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 31.2 m-85 -106.01 130.69 53.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 1.0 109.954 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -116.12 -0.69 12.63 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.792 0.329 . . . . 1.0 110.491 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -158.97 165.7 33.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.362 0.601 . . . . 1.0 110.484 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.413 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -77.19 -23.14 51.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.295 -0.866 . . . . 1.0 112.615 -178.384 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -67.53 -20.36 65.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.447 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -49.97 -48.72 52.06 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.381 -0.372 . . . . 1.0 110.808 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.679 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 23.1 p90 -96.6 20.96 9.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.09 -0.504 . . . . 1.0 110.573 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.59 74.78 0.27 Allowed Glycine 0 CA--C 1.521 0.446 0 N-CA-C 111.204 -0.758 . . . . 1.0 111.204 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.679 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.1 148.53 42.94 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.257 0.551 . . . . 1.0 110.377 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.6 t -77.76 -10.86 59.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.969 -1.014 . . . . 1.0 110.356 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.518 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 32.6 t-20 -171.76 -169.02 0.64 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.45 -0.5 . . . . 1.0 110.366 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.71 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -109.12 -8.69 15.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.625 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -44.3 116.25 0.99 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.891 0.377 . . . . 1.0 111.772 -178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 162' ' ' ALA . 36.8 t -128.31 131.25 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.814 -0.63 . . . . 1.0 109.677 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -108.65 -28.42 4.55 Favored Glycine 0 N--CA 1.463 0.443 0 N-CA-C 111.694 -0.562 . . . . 1.0 111.694 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.8 p -160.74 -168.58 2.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.704 0.288 . . . . 1.0 110.514 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.604 HD21 HD13 ' A' ' 112' ' ' LEU . 1.8 pp -173.06 137.1 0.69 Allowed 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.532 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.642 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 1.3 ttm180 -131.04 149.77 52.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.559 0.695 . . . . 1.0 109.706 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.598 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -81.87 155.97 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.951 -1.022 . . . . 1.0 109.953 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.685 ' C ' HD12 ' A' ' 171' ' ' ILE . 45.9 t -93.29 79.39 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.879 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.685 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.5 mp . . . . . 0 N--CA 1.464 0.256 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.654 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -174.1 101.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.925 -0.31 . . . . 1.0 110.56 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.404 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -120.2 168.78 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 CA-C-N 116.47 -0.332 . . . . 1.0 110.533 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.486 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.6 m -127.44 122.17 32.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 176.401 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.7 mt -104.79 132.7 50.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.328 -0.851 . . . . 1.0 110.438 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.486 ' CE1' HG22 ' A' ' 5' ' ' THR . 49.8 m-85 -114.82 126.87 55.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.373 -0.83 . . . . 1.0 110.863 -178.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.512 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.2 tt0 -54.49 -32.23 57.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.597 -0.728 . . . . 1.0 110.72 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -115.22 152.16 33.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.217 0.532 . . . . 1.0 110.262 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 12' ' ' PHE . 19.3 ptt-85 -56.83 -171.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.393 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.63 23.97 0.07 OUTLIER Glycine 0 N--CA 1.46 0.292 0 N-CA-C 111.135 -0.786 . . . . 1.0 111.135 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 10' ' ' ARG . 11.8 m-85 52.64 69.02 0.74 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.47 -0.365 . . . . 1.0 110.213 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -129.76 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.917 0.389 . . . . 1.0 110.473 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.33 -151.22 0.11 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.03 -0.828 . . . . 1.0 111.03 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.512 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.6 mtm180 -68.73 146.61 52.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.771 0.32 . . . . 1.0 110.755 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -136.49 143.88 44.04 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.155 0.502 . . . . 1.0 110.261 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE1' ' O ' ' A' ' 18' ' ' GLU . 11.3 t80 -137.39 141.52 41.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.293 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.445 ' O ' ' CE1' ' A' ' 17' ' ' TYR . 19.5 tt0 -110.33 127.84 55.25 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.403 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -115.45 127.11 55.1 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.607 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -118.41 10.31 12.67 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.894 -0.594 . . . . 1.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.0 m -156.45 169.97 23.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 1.0 110.745 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -59.42 137.49 57.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.947 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.58 150.1 51.64 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.774 -0.648 . . . . 1.0 109.924 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.5 p -119.65 -16.8 8.77 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.524 -0.762 . . . . 1.0 112.131 -178.746 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.491 ' OD1' ' NE2' ' A' ' 27' ' ' GLN . 15.2 t30 -144.75 111.04 5.56 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.912 0.387 . . . . 1.0 110.188 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.1 mt -117.73 -5.72 11.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.866 -0.606 . . . . 1.0 110.58 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.64 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -45.1 -53.13 17.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.263 179.202 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.64 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 12.8 Cg_endo -54.17 -29.99 58.94 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 C-N-CA 122.078 1.852 . . . . 1.0 111.96 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -95.17 -51.44 4.62 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 120.751 -0.38 . . . . 1.0 110.43 -178.738 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.6 126.8 52.07 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.5 t -95.89 -11.61 26.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.909 -0.587 . . . . 1.0 111.491 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -142.22 -53.12 0.42 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.612 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' CYS . . . . . 0.464 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 20.3 t 55.97 67.84 0.95 Allowed 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 1.0 109.885 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -89.05 4.54 47.99 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.161 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.2 p -154.85 157.63 38.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.088 -0.338 . . . . 1.0 110.088 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.56 155.51 36.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.858 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.4 mtp85 -135.21 122.77 22.06 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.802 -0.814 . . . . 1.0 108.802 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.5 t -108.26 133.11 54.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.153 0.501 . . . . 1.0 110.133 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.64 -39.5 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.419 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 96.3 p -162.96 155.72 19.03 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 176.06 49.7 Favored Glycine 0 CA--C 1.522 0.474 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.0 m -111.26 147.53 34.86 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.706 -0.479 . . . . 1.0 109.706 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.47 ' CE2' HD13 ' A' ' 81' ' ' LEU . 56.5 m95 -132.1 150.86 52.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.81 -0.632 . . . . 1.0 111.246 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.627 ' C ' HD23 ' A' ' 45' ' ' LEU . 21.4 tpp -127.38 129.58 47.84 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.881 -0.785 . . . . 1.0 108.881 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.627 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -110.15 137.82 47.37 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.105 -0.498 . . . . 1.0 109.757 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -112.73 129.95 56.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.955 0.407 . . . . 1.0 110.554 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 3.2 pt-20 -54.55 -33.93 60.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.791 -0.64 . . . . 1.0 110.295 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -105.7 154.32 39.35 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.174 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -55.43 150.37 42.47 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.23 1.954 . . . . 1.0 111.212 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.57 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.4 m-20 78.61 -120.2 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 124.035 0.834 . . . . 1.0 109.103 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.57 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 13.1 m-85 -141.98 79.06 1.65 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.665 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.9 t -152.73 166.22 32.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.825 -0.435 . . . . 1.0 109.825 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.15 -150.07 31.66 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.289 -0.725 . . . . 1.0 111.289 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.631 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.5 tp -78.73 142.78 36.77 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.255 -0.276 . . . . 1.0 110.255 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.15 150.41 41.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.297 -0.26 . . . . 1.0 110.297 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.503 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.1 m-85 -127.5 127.04 43.34 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.389 -0.369 . . . . 1.0 110.732 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.488 ' C ' HD22 ' A' ' 58' ' ' LEU . 41.8 t80 -82.83 122.96 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.392 0.615 . . . . 1.0 109.719 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.488 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.2 mm? -109.71 136.09 49.6 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.136 -0.938 . . . . 1.0 110.343 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 60' ' ' ARG . 38.5 mtm-85 -127.0 149.14 50.03 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.15 -0.932 . . . . 1.0 109.856 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 59' ' ' ARG . 27.4 ptt180 -34.44 126.93 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.985 -0.552 . . . . 1.0 111.389 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 153.36 -177.38 30.97 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.637 -0.985 . . . . 1.0 110.637 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -115.31 130.81 57.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.869 0.366 . . . . 1.0 110.195 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.89 112.11 16.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 1.0 109.536 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.437 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -89.59 -4.45 57.84 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.827 -0.624 . . . . 1.0 110.991 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 83.2 m-20 -147.3 148.44 31.41 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.723 -0.473 . . . . 1.0 109.723 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.536 ' C ' ' H ' ' A' ' 68' ' ' GLN . 24.9 p80 -67.66 -42.53 82.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.019 0.437 . . . . 1.0 111.338 -179.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -50.79 -8.58 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.734 -0.666 . . . . 1.0 110.519 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.536 ' H ' ' C ' ' A' ' 66' ' ' HIS . 24.9 mm-40 -82.42 -33.35 28.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.355 -0.384 . . . . 1.0 111.256 -177.61 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.518 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -98.1 21.72 10.41 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 119.27 -0.395 . . . . 1.0 110.907 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.455 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 57.6 mtp 80.46 10.48 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.58 0.55 . . . . 1.0 110.256 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.42 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.339 0.704 0 N-CA-C 111.096 -0.801 . . . . 1.0 111.096 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.469 0.488 0 N-CA-C 109.884 -0.413 . . . . 1.0 109.884 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -122.68 7.62 9.44 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.553 -0.294 . . . . 1.0 111.092 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.434 ' HB3' ' H ' ' A' ' 50' ' ' ASN . 9.7 p -163.76 161.78 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.428 . . . . 1.0 110.653 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.7 p -154.81 146.05 22.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.026 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.2 ptm180 -127.61 146.66 50.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.102 -0.333 . . . . 1.0 110.102 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.47 HD13 ' CE2' ' A' ' 43' ' ' TRP . 29.8 tp -96.19 130.0 43.37 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.494 -0.558 . . . . 1.0 109.494 178.166 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.403 ' H ' HD12 ' A' ' 81' ' ' LEU . 3.2 mt -92.05 114.56 62.5 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.017 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo . . . . . 0 N--CA 1.497 1.678 0 C-N-CA 122.439 2.093 . . . . 1.0 112.776 179.892 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 CA--C 1.522 -0.118 0 N-CA-C 109.787 -0.449 . . . . 1.0 109.787 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.474 ' CD2' HD11 ' A' ' 171' ' ' ILE . 9.6 m80 -132.43 121.78 23.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.548 -0.296 . . . . 1.0 111.032 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -147.92 136.59 21.77 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 1.0 110.288 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 126' ' ' VAL . 20.6 tt -150.94 149.92 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.517 -0.311 . . . . 1.0 110.535 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -130.09 100.55 5.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.389 0.614 . . . . 1.0 111.445 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.2 mt -77.44 139.43 39.66 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.645 -0.707 . . . . 1.0 110.301 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.603 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 54.6 m-85 -115.27 139.28 50.1 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.603 0.716 . . . . 1.0 111.138 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.509 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.6 OUTLIER -59.27 -63.54 1.27 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.395 -0.821 . . . . 1.0 111.512 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.5 mmm-85 -96.07 174.09 7.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.113 0.482 . . . . 1.0 110.955 -178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 115.547 -0.751 . . . . 1.0 110.988 -179.714 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.323 0 N-CA-C 111.527 -0.629 . . . . 1.0 111.527 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -61.4 146.6 47.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.374 . . . . 1.0 110.398 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.603 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 5.9 ttp -133.36 149.1 51.87 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.82 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.458 HG21 ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -141.19 142.46 29.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 109.8 -0.444 . . . . 1.0 109.8 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -112.38 136.71 51.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.417 0.627 . . . . 1.0 110.647 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.55 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 82.3 m-85 -122.41 156.13 34.65 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.844 -1.071 . . . . 1.0 110.256 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -142.82 13.03 1.88 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.396 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -156.33 -168.69 2.8 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 120.616 -0.434 . . . . 1.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -76.63 145.16 39.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.42 . . . . 1.0 110.801 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.453 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 13.5 m -133.47 93.2 3.11 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.04 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 78.2 p -67.75 -28.29 67.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.319 -0.401 . . . . 1.0 111.247 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.2 t -138.26 97.05 3.29 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.328 0.585 . . . . 1.0 111.174 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.55 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 3.5 mt -63.82 -40.49 96.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.172 -0.922 . . . . 1.0 110.505 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.452 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 25.9 mm-40 -46.21 -11.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.896 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 112' ' ' LEU . 38.5 t70 -96.21 -25.83 15.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.804 0.335 . . . . 1.0 110.547 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.3 mmt180 -110.31 -41.05 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 1.0 111.546 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.489 ' CB ' HD22 ' A' ' 112' ' ' LEU . 5.1 t80 -122.41 116.68 24.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.15 0.5 . . . . 1.0 110.408 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 118' ' ' PHE . 23.5 mmm180 -56.67 -67.81 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.444 -0.798 . . . . 1.0 111.16 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.509 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 80.0 m-85 -38.08 139.98 0.31 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.51 -0.313 . . . . 1.0 110.304 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 119' ' ' ASN . . . . . 0.452 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 81.2 m-20 -100.43 2.84 42.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.914 -178.662 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -132.76 142.27 48.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.191 0.52 . . . . 1.0 111.151 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.8 mm -122.92 120.64 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 CA-C-N 115.518 -0.765 . . . . 1.0 109.52 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.456 ' O ' ' CB ' ' A' ' 123' ' ' SER . 30.7 m-70 -110.94 28.48 8.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 1.0 111.514 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.456 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.7 t 162.27 151.06 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 120.986 0.422 . . . . 1.0 110.695 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.439 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.3 pp -163.73 158.79 20.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.573 -0.74 . . . . 1.0 110.371 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 125' ' ' ASN . . . . . 0.518 HD22 HD11 ' A' ' 127' ' ' LEU . 3.2 t30 -126.33 119.1 26.49 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.848 -0.427 . . . . 1.0 109.848 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.411 HG22 HD12 ' A' ' 90' ' ' ILE . 26.5 t -100.9 105.42 17.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 109.722 -0.473 . . . . 1.0 109.722 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.931 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.69 -41.67 30.53 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.634 -0.712 . . . . 1.0 111.263 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -140.34 146.29 38.26 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.976 0.417 . . . . 1.0 110.87 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 61.21 -175.39 5.46 Favored Glycine 0 CA--C 1.518 0.242 0 N-CA-C 111.183 -0.767 . . . . 1.0 111.183 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.4 t -117.65 154.38 31.7 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.655 -0.498 . . . . 1.0 109.655 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.3 m95 -127.64 160.21 32.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.808 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 65.7 t -132.26 135.38 58.17 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 N-CA-C 109.659 -0.497 . . . . 1.0 109.659 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.517 ' HG ' HD11 ' A' ' 146' ' ' LEU . 23.5 mt -107.77 143.29 36.52 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.238 -0.282 . . . . 1.0 110.238 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -118.79 133.07 56.1 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.755 0.312 . . . . 1.0 110.629 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -43.27 -52.23 5.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.958 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.592 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -121.99 172.3 8.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.176 0.513 . . . . 1.0 110.181 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.7 m -75.56 170.05 16.9 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.529 -0.76 . . . . 1.0 110.918 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 62.0 t30 66.37 16.94 10.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.279 -0.873 . . . . 1.0 109.982 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.478 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 1.4 m-85 38.55 80.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 1.0 111.679 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.53 ' C ' HD11 ' A' ' 136' ' ' LEU . 51.3 ttp180 -149.48 42.11 0.89 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.983 0.421 . . . . 1.0 109.904 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.44 -135.11 2.17 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 111.309 -0.716 . . . . 1.0 111.309 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -82.98 168.54 16.9 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.962 -0.384 . . . . 1.0 109.962 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.38 137.82 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.116 -0.493 . . . . 1.0 110.919 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -128.22 132.11 48.8 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.162 -0.681 . . . . 1.0 109.162 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.8 OUTLIER -87.53 126.65 35.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.083 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.623 ' N ' HD23 ' A' ' 145' ' ' LEU . 21.8 mt -115.43 99.9 7.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.993 -0.549 . . . . 1.0 109.599 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.451 ' HE2' HD22 ' A' ' 145' ' ' LEU . 5.2 mtm -81.94 156.77 69.66 Favored Pre-proline 0 C--N 1.327 -0.373 0 C-N-CA 120.704 -0.398 . . . . 1.0 110.604 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.39 120.33 3.13 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 C-N-CA 122.081 1.854 . . . . 1.0 111.569 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.54 -154.81 24.9 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.431 -1.068 . . . . 1.0 110.431 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -127.02 135.98 51.59 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.835 0.35 . . . . 1.0 110.458 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.518 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 11.9 m-85 -126.87 130.97 51.21 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.754 -0.461 . . . . 1.0 109.754 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -119.39 -0.37 10.94 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.747 0.308 . . . . 1.0 110.589 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -158.15 163.11 37.9 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 121.173 0.511 . . . . 1.0 109.947 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.627 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -76.19 -18.48 59.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.354 -0.839 . . . . 1.0 111.918 -178.436 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.572 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -67.62 -21.68 65.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 1.0 110.712 -179.028 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -50.27 -48.42 54.86 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.614 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.731 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 21.7 p90 -102.27 19.41 18.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 1.0 110.562 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 76.67 0.16 Allowed Glycine 0 CA--C 1.52 0.354 0 N-CA-C 111.272 -0.731 . . . . 1.0 111.272 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.731 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -94.12 -169.75 2.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.037 0.446 . . . . 1.0 110.115 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 1.2 t -123.49 -36.31 2.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.542 -0.754 . . . . 1.0 111.776 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.659 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 25.7 t-20 -145.64 -24.1 0.47 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 1.0 111.61 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 93.23 0.8 0.09 Allowed 'General case' 0 N--CA 1.465 0.305 0 O-C-N 124.031 0.832 . . . . 1.0 110.68 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -67.98 116.07 8.22 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.849 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.2 125.28 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.115 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -102.07 -24.59 8.41 Favored Glycine 0 N--CA 1.464 0.503 0 N-CA-C 111.507 -0.637 . . . . 1.0 111.507 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.9 p -161.51 171.21 18.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.88 0.371 . . . . 1.0 110.68 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.73 148.5 24.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.98 -0.555 . . . . 1.0 111.617 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.478 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 15.4 ptp180 -138.17 154.2 49.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.363 . . . . 1.0 110.094 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -86.66 155.94 20.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.043 -0.526 . . . . 1.0 110.053 178.035 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.07 85.62 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 1.0 111.191 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.474 HD11 ' CD2' ' A' ' 88' ' ' HIS . 3.5 mp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.034 -0.53 . . . . 1.0 110.436 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.532 0 N-CA-C 110.694 -0.963 . . . . 1.0 110.694 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.9 tttt -172.91 106.24 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.891 -0.324 . . . . 1.0 110.321 179.134 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.26 168.48 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 116.468 -0.333 . . . . 1.0 110.595 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.491 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.0 m -127.63 121.72 31.23 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 177.191 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.8 mt -105.67 132.97 51.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.047 -0.979 . . . . 1.0 110.262 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.491 ' CE1' HG22 ' A' ' 5' ' ' THR . 49.9 m-85 -115.06 127.26 55.51 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.307 -0.86 . . . . 1.0 110.909 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.426 ' OE1' ' OD1' ' A' ' 9' ' ' ASP . 6.9 tm-20 -53.94 -32.86 55.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.557 -0.747 . . . . 1.0 110.588 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . 0.426 ' OD1' ' OE1' ' A' ' 8' ' ' GLU . 90.4 m-20 -115.74 152.14 33.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.292 0.568 . . . . 1.0 110.292 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.44 ' C ' ' N ' ' A' ' 12' ' ' PHE . 32.5 ptt85 -57.04 -172.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.494 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.81 22.65 0.3 Allowed Glycine 0 CA--C 1.517 0.207 0 N-CA-C 110.918 -0.873 . . . . 1.0 110.918 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.44 ' N ' ' C ' ' A' ' 10' ' ' ARG . 10.3 m-85 53.23 67.37 1.01 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.26 -0.274 . . . . 1.0 110.26 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' A' ' 12' ' ' PHE . 10.9 mm100 -129.8 -158.65 0.9 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.138 0.494 . . . . 1.0 110.594 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.67 -149.97 0.67 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -70.83 147.13 49.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.681 0.277 . . . . 1.0 110.701 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.6 p80 -136.49 146.6 46.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.187 0.518 . . . . 1.0 110.299 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -139.63 141.43 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.383 -0.826 . . . . 1.0 109.978 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 62.1 tt0 -111.07 122.92 49.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.336 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.6 126.83 54.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.464 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.3 p -117.43 10.29 13.55 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.345 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.8 m -156.88 169.02 25.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.732 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.8 139.68 56.03 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.639 -0.709 . . . . 1.0 111.244 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.61 155.33 49.3 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.64 -0.709 . . . . 1.0 110.409 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -123.66 -15.03 7.14 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.382 -0.826 . . . . 1.0 112.326 -179.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -138.08 112.97 9.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.954 0.406 . . . . 1.0 110.408 -178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 mp -115.95 -9.74 11.73 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.063 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.613 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -48.61 -52.53 43.84 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.46 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 16.8 Cg_endo -55.39 -33.69 86.46 Favored 'Trans proline' 0 C--N 1.316 -1.181 0 C-N-CA 121.848 1.699 . . . . 1.0 112.103 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -95.0 -49.43 5.55 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 120.388 -0.525 . . . . 1.0 110.68 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 mt -121.66 126.32 48.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.668 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 t -95.01 -12.85 25.92 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.909 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -143.39 -51.17 0.34 Allowed 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 116.167 -0.469 . . . . 1.0 111.737 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.5 t 56.88 78.5 0.22 Allowed 'General case' 0 C--N 1.314 -0.955 0 O-C-N 122.134 -0.354 . . . . 1.0 110.099 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 -95.19 5.69 51.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.294 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.6 p -158.13 158.32 34.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 1.0 110.254 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.79 154.3 32.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.942 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.9 mtp85 -133.05 121.95 23.45 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.598 -0.89 . . . . 1.0 108.598 178.847 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.8 133.19 53.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.627 -0.509 . . . . 1.0 109.627 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.59 -43.94 7.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.744 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.2 t -160.82 154.09 21.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.95 177.59 50.99 Favored Glycine 0 C--N 1.317 -0.5 0 N-CA-C 111.194 -0.762 . . . . 1.0 111.194 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.1 m -112.16 134.05 53.93 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.589 -0.522 . . . . 1.0 109.589 178.565 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.45 ' CE2' HD13 ' A' ' 81' ' ' LEU . 58.4 m95 -121.96 142.41 50.33 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.017 -0.538 . . . . 1.0 111.179 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.69 ' C ' HD23 ' A' ' 45' ' ' LEU . 10.4 tpp -120.15 130.29 54.53 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.546 -0.752 . . . . 1.0 109.172 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.69 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -111.49 138.96 47.33 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.084 -0.507 . . . . 1.0 109.808 -178.823 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -111.58 130.99 55.57 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.322 0.582 . . . . 1.0 110.979 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 54' ' ' LEU . 16.0 pt-20 -55.39 -30.7 60.88 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.12 -0.945 . . . . 1.0 110.532 -178.812 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.437 ' NE2' ' HB3' ' A' ' 52' ' ' SER . 19.1 pt20 -114.87 156.29 45.25 Favored Pre-proline 0 N--CA 1.465 0.297 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -52.94 152.38 17.96 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 121.753 1.635 . . . . 1.0 111.911 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.548 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.5 m-20 70.32 -120.48 0.11 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.747 -1.115 . . . . 1.0 109.313 -178.448 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER -153.64 76.28 1.08 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.648 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.437 ' HB3' ' NE2' ' A' ' 48' ' ' GLN . 30.7 t -143.29 16.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.541 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -133.11 -168.93 12.05 Favored Glycine 0 N--CA 1.464 0.549 0 N-CA-C 111.33 -0.708 . . . . 1.0 111.33 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' A' ' 54' ' ' LEU . 48.4 tp -55.34 145.54 21.82 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 109.522 -0.547 . . . . 1.0 109.522 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -122.33 152.49 40.07 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.903 0.383 . . . . 1.0 110.624 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.48 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.0 m-85 -130.52 125.92 35.52 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.945 -0.57 . . . . 1.0 110.731 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -84.15 123.93 30.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.885 -0.598 . . . . 1.0 110.26 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.0 mp -121.26 145.91 47.37 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.582 -0.735 . . . . 1.0 110.686 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.406 ' O ' ' C ' ' A' ' 60' ' ' ARG . 43.8 mtp180 -132.51 158.66 41.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.293 179.616 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 59' ' ' ARG . 40.5 ptt180 -35.14 127.56 0.54 Allowed 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.701 -0.681 . . . . 1.0 111.116 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.79 -178.3 30.0 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 110.873 -0.891 . . . . 1.0 110.873 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.442 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.5 p-10 -116.92 128.01 54.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.08 0.467 . . . . 1.0 110.435 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -120.46 112.72 19.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 1.0 109.6 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.86 -3.71 57.15 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.283 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -148.28 141.34 24.93 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.49 -0.559 . . . . 1.0 109.49 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.494 ' C ' ' H ' ' A' ' 68' ' ' GLN . 25.6 p-80 -62.57 -40.1 95.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.096 0.474 . . . . 1.0 111.166 -179.099 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -54.56 -6.78 0.12 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.355 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -84.5 -34.65 23.31 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.779 -0.368 . . . . 1.0 111.363 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -95.1 18.42 12.21 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 119.225 -0.417 . . . . 1.0 111.063 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 39.9 mtt 82.37 12.92 0.54 Allowed 'General case' 0 N--CA 1.463 0.225 0 O-C-N 123.884 0.74 . . . . 1.0 110.128 -178.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.416 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.343 0.926 0 C-N-CA 120.526 -0.845 . . . . 1.0 111.311 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.471 0.575 0 N-CA-C 110.362 -0.236 . . . . 1.0 110.362 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -126.09 8.51 7.33 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.742 0.306 . . . . 1.0 110.928 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 p -163.45 161.21 24.14 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.144 0.497 . . . . 1.0 110.789 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 27.4 p -154.75 146.98 23.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.456 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.7 ptm180 -127.84 148.01 50.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.224 -0.288 . . . . 1.0 110.224 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.45 HD13 ' CE2' ' A' ' 43' ' ' TRP . 19.9 tp -98.64 127.3 44.52 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.858 -0.793 . . . . 1.0 108.858 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.436 ' N ' HD12 ' A' ' 81' ' ' LEU . 2.8 mt -93.16 120.49 66.8 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.189 -0.459 . . . . 1.0 109.827 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo . . . . . 0 N--CA 1.495 1.591 0 C-N-CA 122.145 1.897 . . . . 1.0 112.884 179.671 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.462 0.135 0 N-CA-C 109.752 -0.462 . . . . 1.0 109.752 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.773 ' CD2' HD11 ' A' ' 171' ' ' ILE . 5.8 m-70 -132.52 128.43 37.3 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.887 0.375 . . . . 1.0 110.926 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -155.1 133.91 12.11 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.679 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.567 HD12 HG22 ' A' ' 126' ' ' VAL . 16.6 tt -146.21 150.12 15.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.442 -0.344 . . . . 1.0 110.754 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.4 98.28 5.0 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.25 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.24 137.63 38.22 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.326 0.584 . . . . 1.0 111.43 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.45 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 56.9 m-85 -111.93 134.42 53.49 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 115.11 -0.95 . . . . 1.0 110.841 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.466 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.9 tm-20 -52.98 -56.93 12.35 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.511 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -104.1 171.5 7.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.564 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.63 -0.714 . . . . 1.0 110.311 179.088 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.762 0 N-CA-C 111.407 -0.677 . . . . 1.0 111.407 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -58.31 146.83 32.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.988 -0.375 . . . . 1.0 109.988 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.47 ' HG2' ' N ' ' A' ' 103' ' ' ILE . 11.7 ttp -131.54 153.06 50.22 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.897 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.483 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.9 tt -146.51 142.12 20.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.5 -0.556 . . . . 1.0 109.5 177.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -112.54 143.41 43.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.47 0.653 . . . . 1.0 110.427 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -129.52 156.96 43.31 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 114.814 -1.084 . . . . 1.0 110.567 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.6 p -143.73 15.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.433 -0.803 . . . . 1.0 110.592 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.413 ' C ' ' NE ' ' A' ' 169' ' ' ARG . 16.8 pt-20 -156.6 -168.55 2.73 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.202 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.631 ' N ' ' NE ' ' A' ' 169' ' ' ARG . 49.1 p30 -79.87 147.98 31.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.805 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.408 ' O ' ' OG ' ' A' ' 166' ' ' SER . 2.2 t -138.03 93.95 2.83 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.013 -0.54 . . . . 1.0 109.996 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.3 p -65.04 -22.28 66.96 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.809 -0.357 . . . . 1.0 111.209 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 16.4 t -140.56 94.23 2.71 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.311 0.577 . . . . 1.0 110.618 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.534 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.0 tp -62.62 -43.5 98.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.342 -0.845 . . . . 1.0 110.299 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.449 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 22.5 mp0 -48.93 -7.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.925 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.534 ' H ' ' C ' ' A' ' 112' ' ' LEU . 45.7 t0 -94.88 -26.49 16.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.945 0.402 . . . . 1.0 110.346 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.8 mmt180 -108.31 -34.46 6.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.191 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.483 ' CD1' HG21 ' A' ' 103' ' ' ILE . 5.3 t80 -124.23 118.48 26.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.12 0.486 . . . . 1.0 109.871 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -54.51 -67.62 0.25 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.529 -0.76 . . . . 1.0 111.12 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.466 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 92.6 m-85 -40.14 141.66 0.45 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.233 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -102.22 2.32 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.809 0.338 . . . . 1.0 111.35 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -130.24 138.86 50.76 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.219 0.533 . . . . 1.0 111.045 -178.146 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.717 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 37.4 mm -122.2 125.9 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 CA-C-N 115.303 -0.862 . . . . 1.0 109.358 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.5 m-70 -114.06 17.57 17.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.473 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.584 ' C ' HD13 ' A' ' 124' ' ' LEU . 3.2 m 170.5 156.08 0.06 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.997 0.427 . . . . 1.0 110.965 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.684 HD11 ' CZ3' ' A' ' 157' ' ' TRP . 0.0 OUTLIER -160.11 162.08 33.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.818 179.466 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -125.57 112.31 16.04 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.045 -0.724 . . . . 1.0 109.045 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.567 HG22 HD12 ' A' ' 90' ' ' ILE . 40.4 t -101.72 103.95 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.634 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.932 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.55 -37.45 36.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.75 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 129' ' ' GLY . 31.1 tp10 -138.87 158.34 44.39 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.875 0.369 . . . . 1.0 110.416 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.433 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.08 -173.2 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 111.078 -0.809 . . . . 1.0 111.078 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.497 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.7 OUTLIER -115.71 176.18 5.2 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.384 -0.598 . . . . 1.0 109.384 179.545 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.497 ' CD1' ' C ' ' A' ' 130' ' ' SER . 67.3 m95 -147.12 161.1 41.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.694 -0.684 . . . . 1.0 110.346 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 60.1 t -132.05 134.01 60.13 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 116.058 -0.519 . . . . 1.0 109.771 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.48 143.53 37.32 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 134' ' ' TYR . . . . . 0.536 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 13.6 m-85 -119.43 131.9 55.72 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.041 0.448 . . . . 1.0 110.306 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -47.69 -23.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.945 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.479 HD12 ' C ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -147.75 179.67 7.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.061 0.458 . . . . 1.0 110.199 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.5 p -84.8 170.58 13.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.023 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 66.01 16.37 10.44 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.049 -0.978 . . . . 1.0 110.262 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.545 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 5.1 m-85 40.37 78.66 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.801 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 90.9 mtt-85 -147.94 37.38 0.87 Allowed 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 120.905 0.383 . . . . 1.0 110.658 179.345 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.456 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -148.3 -145.64 4.19 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.428 -0.669 . . . . 1.0 111.428 -178.407 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -74.34 157.45 35.72 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 110.18 -0.304 . . . . 1.0 110.18 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.472 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 66.1 mt-30 -133.75 133.66 42.02 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.538 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -128.5 133.3 48.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.305 -0.628 . . . . 1.0 109.305 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.618 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.6 OUTLIER -91.54 128.72 37.48 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.363 0.602 . . . . 1.0 110.587 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.639 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.34 90.55 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.194 -0.912 . . . . 1.0 109.103 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -68.86 150.72 97.54 Favored Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 114.857 -1.065 . . . . 1.0 111.097 -178.657 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -44.93 119.22 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 C-N-CA 121.404 1.403 . . . . 1.0 111.298 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 166.2 -151.0 19.02 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.405 -1.078 . . . . 1.0 110.405 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -136.01 125.54 25.19 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.676 0.274 . . . . 1.0 110.614 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 3.1 m-85 -116.43 129.41 56.21 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.325 -0.62 . . . . 1.0 109.325 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 152' ' ' ARG . . . . . 0.411 ' C ' ' OG ' ' A' ' 123' ' ' SER . 72.9 mtm-85 -107.24 -1.54 21.69 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.02 0.438 . . . . 1.0 110.432 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -156.99 163.03 39.56 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.474 0.654 . . . . 1.0 110.867 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.542 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 9.1 p90 -78.28 -21.08 50.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.905 -1.043 . . . . 1.0 112.565 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -68.8 -20.03 64.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.93 -0.577 . . . . 1.0 111.167 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -51.96 -48.42 64.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.86 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.708 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 16.8 p90 -95.77 20.92 9.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.84 75.76 0.2 Allowed Glycine 0 CA--C 1.521 0.429 0 N-CA-C 111.212 -0.755 . . . . 1.0 111.212 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.708 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.85 149.24 41.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.086 0.469 . . . . 1.0 110.146 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 13.4 t -76.93 -21.3 55.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.254 -0.884 . . . . 1.0 110.207 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -163.33 -170.1 2.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.879 0.371 . . . . 1.0 110.492 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.717 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.91 -7.12 15.5 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.102 -0.499 . . . . 1.0 110.577 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -49.23 119.56 3.39 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.067 0.461 . . . . 1.0 111.121 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.9 t -135.05 121.25 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.372 -0.831 . . . . 1.0 109.382 177.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.438 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -100.54 -23.09 10.48 Favored Glycine 0 N--CA 1.467 0.717 0 N-CA-C 111.716 -0.554 . . . . 1.0 111.716 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.537 ' OG ' ' N ' ' A' ' 167' ' ' LEU . 5.2 t -156.77 179.94 8.8 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.266 -0.573 . . . . 1.0 110.314 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.537 ' N ' ' OG ' ' A' ' 166' ' ' SER . 1.5 pp -166.29 142.65 4.92 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.002 -0.544 . . . . 1.0 111.165 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.545 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 13.4 ptp180 -136.15 152.57 50.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.836 0.351 . . . . 1.0 110.123 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.631 ' NE ' ' N ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -81.01 159.16 24.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.193 -0.669 . . . . 1.0 109.193 177.792 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 170' ' ' VAL . 27.1 m -92.41 66.14 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.791 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.773 HD11 ' CD2' ' A' ' 88' ' ' HIS . 19.5 mt . . . . . 0 C--N 1.327 -0.389 0 CA-C-O 121.441 0.639 . . . . 1.0 110.948 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.369 0 N-CA-C 110.726 -0.95 . . . . 1.0 110.726 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -174.77 100.4 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.673 -0.411 . . . . 1.0 110.24 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.99 164.8 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 CA-C-N 116.264 -0.426 . . . . 1.0 110.278 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.522 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.8 m -124.16 118.6 27.25 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.29 -1.004 . . . . 1.0 108.29 177.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.8 mt -102.79 133.14 48.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.853 -1.067 . . . . 1.0 109.853 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.522 ' CE1' HG22 ' A' ' 5' ' ' THR . 66.0 m-85 -115.92 126.1 53.45 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.499 -0.773 . . . . 1.0 111.005 -178.575 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.533 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 82.0 tt0 -53.51 -31.57 46.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.608 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -115.16 153.67 30.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.283 0.564 . . . . 1.0 110.439 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.42 ' C ' ' N ' ' A' ' 12' ' ' PHE . 4.4 ptm180 -58.63 -173.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.609 -0.723 . . . . 1.0 110.265 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.47 26.84 0.25 Allowed Glycine 0 N--CA 1.462 0.388 0 N-CA-C 110.956 -0.858 . . . . 1.0 110.956 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.5 m-85 50.28 70.94 0.45 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.362 -0.419 . . . . 1.0 110.279 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -132.0 -158.81 0.92 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.92 0.391 . . . . 1.0 110.532 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.89 -151.93 0.3 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.533 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 89.0 mtm180 -68.77 146.57 52.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 1.0 110.768 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.3 p-80 -136.03 152.66 51.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.247 0.546 . . . . 1.0 110.377 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.531 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -146.69 141.51 26.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.494 -0.776 . . . . 1.0 110.294 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.531 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.0 tt0 -110.2 123.1 49.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.057 -0.52 . . . . 1.0 110.177 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.423 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.1 t -112.69 126.92 55.92 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.86 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -117.49 10.85 13.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.353 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.0 p -154.34 165.95 34.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.61 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.437 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 47.1 p-10 -58.32 141.65 50.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.549 -0.75 . . . . 1.0 111.446 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.423 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -136.19 146.22 46.59 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.389 -0.823 . . . . 1.0 110.484 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.6 p -112.78 -16.17 12.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.738 -0.664 . . . . 1.0 111.651 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -151.03 117.48 5.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.271 0.558 . . . . 1.0 110.667 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.4 mt -118.24 -0.41 11.54 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.283 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.608 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 45.6 mt-30 -46.39 -53.44 23.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.795 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.608 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.4 Cg_endo -54.35 -30.35 62.45 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.842 1.695 . . . . 1.0 111.977 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.433 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -96.27 -54.32 3.32 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.586 -0.446 . . . . 1.0 110.664 -179.062 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -117.74 126.95 53.4 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.756 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.2 t -95.28 -9.45 33.07 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.746 -0.661 . . . . 1.0 111.499 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 94.4 mtm-85 -146.36 -59.56 0.3 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t 64.8 76.37 0.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 1.0 110.004 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -92.55 3.78 54.85 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.999 -0.546 . . . . 1.0 111.383 -178.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.0 p -158.67 158.76 34.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.818 0.342 . . . . 1.0 110.274 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.92 155.73 34.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.995 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -134.67 123.62 24.01 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 108.96 -0.756 . . . . 1.0 108.96 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.06 132.66 56.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.364 -0.606 . . . . 1.0 109.364 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -93.92 -43.59 8.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.627 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.7 t -160.99 151.84 18.46 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.269 -0.423 . . . . 1.0 109.874 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.26 175.78 47.58 Favored Glycine 0 C--N 1.319 -0.405 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.4 m -113.02 137.52 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.509 -0.552 . . . . 1.0 109.509 178.403 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.448 ' CE2' HD13 ' A' ' 81' ' ' LEU . 46.8 m95 -124.02 155.98 37.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.242 0.544 . . . . 1.0 110.904 -178.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.424 ' C ' HD23 ' A' ' 45' ' ' LEU . 1.4 tpt -127.78 129.1 46.47 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.694 -0.854 . . . . 1.0 108.694 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.424 HD23 ' C ' ' A' ' 44' ' ' MET . 2.7 mt -108.69 130.33 55.35 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.451 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 73.3 m-85 -108.26 131.61 54.53 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.665 0.745 . . . . 1.0 110.758 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 4.7 pt-20 -59.25 -35.11 73.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.711 -1.131 . . . . 1.0 110.347 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.3 mt-30 -111.0 153.41 43.85 Favored Pre-proline 0 N--CA 1.462 0.146 0 CA-C-N 116.446 -0.343 . . . . 1.0 110.49 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.93 159.17 43.44 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.443 2.095 . . . . 1.0 112.623 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 62.64 39.21 11.53 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.731 -0.668 . . . . 1.0 111.023 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.451 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 5.2 m-85 48.17 74.22 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 1.0 110.746 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.8 m -141.5 153.15 44.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.063 0.459 . . . . 1.0 110.168 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.42 -147.26 19.95 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.91 -0.662 . . . . 1.0 111.675 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.629 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 37.2 tp -80.31 146.0 31.82 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.388 -0.406 . . . . 1.0 110.647 -179.309 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.429 ' NE2' ' H ' ' A' ' 145' ' ' LEU . 12.1 pt20 -121.78 150.86 41.26 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.839 0.352 . . . . 1.0 110.537 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.425 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 24.7 m-85 -127.53 132.54 49.9 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.236 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.491 ' C ' HD22 ' A' ' 58' ' ' LEU . 57.5 t80 -80.77 118.3 22.18 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.576 0.703 . . . . 1.0 109.961 -178.728 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.491 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.5 mm? -111.71 133.89 53.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.131 -0.94 . . . . 1.0 109.704 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.4 ptt85 -133.65 162.12 32.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.441 -0.799 . . . . 1.0 110.204 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -41.06 123.88 2.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.322 -0.399 . . . . 1.0 110.91 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.08 178.63 33.27 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.86 -0.896 . . . . 1.0 110.86 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.4 p-10 -115.29 124.43 51.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.206 0.527 . . . . 1.0 110.222 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -119.32 112.46 19.48 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.244 -0.651 . . . . 1.0 109.244 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.24 -4.04 54.65 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.496 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.9 m-20 -147.58 138.34 23.37 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.398 -0.593 . . . . 1.0 109.398 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.476 ' CB ' ' CZ2' ' A' ' 69' ' ' TRP . 15.7 p-80 -58.48 -40.96 84.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.133 0.492 . . . . 1.0 110.969 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -54.3 -7.82 0.17 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.709 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -81.89 -34.82 29.79 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.386 -0.526 . . . . 1.0 111.05 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.75 13.19 18.91 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.963 -0.295 . . . . 1.0 110.311 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.424 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 52.6 mtt 74.51 35.98 0.66 Allowed 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.915 0.759 . . . . 1.0 109.967 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.425 ' HA2' ' CE1' ' A' ' 56' ' ' TYR . . . . . . . . 0 CA--C 1.531 1.057 0 C-N-CA 120.158 -1.02 . . . . 1.0 111.463 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.518 -0.259 0 N-CA-C 108.607 -0.886 . . . . 1.0 108.607 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -121.49 4.12 10.19 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.867 -0.606 . . . . 1.0 111.566 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.2 p -163.22 162.69 25.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.177 0.513 . . . . 1.0 110.543 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 25.2 p -155.55 147.26 23.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 1.0 110.188 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.08 146.46 50.36 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.933 -0.395 . . . . 1.0 109.933 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.448 HD13 ' CE2' ' A' ' 43' ' ' TRP . 24.0 tp -96.41 136.15 37.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.485 -0.932 . . . . 1.0 108.485 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.443 ' H ' HD12 ' A' ' 81' ' ' LEU . 2.2 mt -96.41 112.91 61.42 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.606 -0.516 . . . . 1.0 109.606 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo . . . . . 0 N--CA 1.498 1.783 0 C-N-CA 122.143 1.895 . . . . 1.0 113.224 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 m . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.835 0.35 . . . . 1.0 110.244 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.4 ' CE1' HD11 ' A' ' 171' ' ' ILE . 6.7 m-70 -136.06 114.69 11.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 1.0 110.94 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -142.29 133.76 26.55 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.195 -0.298 . . . . 1.0 110.195 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.515 HD12 HG22 ' A' ' 126' ' ' VAL . 16.9 tt -145.93 143.29 21.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.387 -0.37 . . . . 1.0 111.007 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -121.58 101.75 7.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.447 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.9 mt -82.89 139.29 33.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.964 -0.562 . . . . 1.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.471 ' CE1' ' CG ' ' A' ' 102' ' ' MET . 67.7 m-85 -115.15 136.96 52.55 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.527 0.679 . . . . 1.0 111.276 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.614 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 17.4 pt-20 -58.48 -47.12 85.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.278 -0.874 . . . . 1.0 110.354 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.493 ' N ' ' CG ' ' A' ' 94' ' ' GLU . 24.7 mtt85 -115.22 165.91 12.42 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.086 -0.506 . . . . 1.0 111.089 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 . . . . . 0 CA--C 1.507 -0.682 0 CA-C-N 115.312 -0.858 . . . . 1.0 110.354 179.027 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.413 0 N-CA-C 110.828 -0.909 . . . . 1.0 110.828 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.614 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 11.6 tp-100 -61.39 139.45 58.19 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.917 -0.313 . . . . 1.0 110.205 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.724 ' SD ' ' N ' ' A' ' 103' ' ' ILE . 4.3 tmm? -131.73 137.66 48.32 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.585 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.724 ' N ' ' SD ' ' A' ' 102' ' ' MET . 8.3 tt -134.37 137.41 51.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.094 -0.706 . . . . 1.0 109.094 178.134 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -111.33 146.88 36.3 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.526 0.679 . . . . 1.0 110.362 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.838 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 89.0 m-85 -130.27 155.67 45.93 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.037 -0.983 . . . . 1.0 110.466 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.6 p -143.77 27.76 1.47 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.681 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.408 ' CD ' ' N ' ' A' ' 107' ' ' GLU . 1.4 pm0 -168.08 -167.68 0.86 Allowed 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.713 -0.395 . . . . 1.0 110.47 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -81.64 147.34 29.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.419 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.521 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 3.2 m -139.16 97.05 3.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.44 -30.88 71.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.901 0.382 . . . . 1.0 110.983 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 51.5 m -137.74 93.14 2.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.982 -0.553 . . . . 1.0 110.511 -179.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.838 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 13.4 tp -60.59 -39.19 87.19 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.448 -0.796 . . . . 1.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.634 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.3 mp0 -43.86 -13.49 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.634 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 112' ' ' LEU . 93.6 m-20 -93.82 2.07 56.29 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.189 0.519 . . . . 1.0 110.751 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.3 mmt180 -133.59 -39.87 0.89 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.886 -1.052 . . . . 1.0 112.654 -177.019 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.727 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -123.1 136.08 54.65 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 122.061 0.934 . . . . 1.0 111.136 -179.036 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 118' ' ' PHE . 20.3 mmm180 -72.44 -70.09 0.36 Allowed 'General case' 0 C--N 1.315 -0.898 0 O-C-N 121.059 -1.026 . . . . 1.0 110.367 -178.438 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.672 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 61.0 m-85 -31.51 143.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.618 0.574 . . . . 1.0 110.187 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -105.03 6.79 33.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.998 0.428 . . . . 1.0 110.522 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -139.74 139.86 36.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.937 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.726 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.0 mm -120.11 120.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.385 -0.825 . . . . 1.0 109.108 178.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -110.59 22.29 15.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 1.0 111.584 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.478 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.8 p 169.08 151.71 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.071 0.463 . . . . 1.0 110.015 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.475 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.0 OUTLIER -161.96 157.11 23.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 1.0 110.183 -178.528 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -125.01 117.67 24.53 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.515 HG22 HD12 ' A' ' 90' ' ' ILE . 22.0 t -101.59 105.07 17.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 109.597 -0.52 . . . . 1.0 109.597 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.902 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.8 OUTLIER -78.54 -40.95 33.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.787 -0.642 . . . . 1.0 111.494 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.7 mm-40 -139.69 167.3 22.42 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.443 0.639 . . . . 1.0 110.633 -178.932 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 44.26 -179.49 0.01 OUTLIER Glycine 0 C--N 1.315 -0.637 0 CA-C-N 113.911 -1.495 . . . . 1.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 20.2 m -119.4 149.63 41.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.358 -0.608 . . . . 1.0 109.358 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.459 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 37.2 m95 -121.61 167.19 13.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.822 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.613 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.0 p -141.8 96.5 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.911 -0.315 . . . . 1.0 110.917 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 7.7 mt -66.53 142.63 57.45 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.389 -0.524 . . . . 1.0 110.966 -178.115 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -117.8 129.96 55.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.773 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -43.21 -49.11 6.62 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.053 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.39 175.45 7.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.197 0.522 . . . . 1.0 110.559 -179.122 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -81.81 172.78 12.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.562 -0.745 . . . . 1.0 110.508 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 38.4 m-20 63.44 17.65 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.29 -0.868 . . . . 1.0 110.278 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.419 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 7.4 m-85 36.29 77.89 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.174 -0.467 . . . . 1.0 111.71 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.45 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 52.9 ttm-85 -147.0 39.87 1.04 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.953 0.406 . . . . 1.0 110.64 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.452 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -154.51 -138.62 2.65 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.105 -0.798 . . . . 1.0 111.105 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -79.27 169.59 17.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.93 0.395 . . . . 1.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.94 137.91 21.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.747 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 17.8 m-85 -125.48 137.97 53.98 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 108.609 -0.886 . . . . 1.0 108.609 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.585 ' C ' HD22 ' A' ' 146' ' ' LEU . 38.5 tp -95.05 126.37 40.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.339 0.59 . . . . 1.0 111.149 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.838 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.6 mm? -114.33 109.31 18.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.208 -0.905 . . . . 1.0 109.832 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -83.26 166.66 33.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 116.295 -0.411 . . . . 1.0 110.1 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -62.01 114.03 2.13 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.979 1.786 . . . . 1.0 111.223 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.43 -150.87 11.3 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.587 -1.005 . . . . 1.0 110.587 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 66.6 t0 -128.56 134.62 48.68 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.815 0.34 . . . . 1.0 110.551 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.6 m-85 -125.95 131.4 52.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.209 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -117.22 -1.31 11.86 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.952 0.406 . . . . 1.0 110.419 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -157.16 165.3 36.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.892 -0.595 . . . . 1.0 110.402 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.458 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 14.4 p90 -79.39 -20.77 46.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.261 -0.881 . . . . 1.0 112.253 -177.772 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -68.6 -19.61 64.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 1.0 111.218 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -51.37 -48.81 62.42 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.894 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.723 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 17.8 p90 -97.64 20.74 11.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.714 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.92 75.57 0.21 Allowed Glycine 0 CA--C 1.518 0.223 0 N-CA-C 111.125 -0.79 . . . . 1.0 111.125 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.723 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.84 149.59 40.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 121.069 0.461 . . . . 1.0 110.274 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.3 t -79.11 -12.46 60.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.354 -0.839 . . . . 1.0 110.238 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.53 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 9.0 t-20 -170.5 -171.25 1.04 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.996 0.427 . . . . 1.0 110.486 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.726 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.98 -8.83 15.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.624 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -48.37 123.88 7.18 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 121.498 0.666 . . . . 1.0 111.171 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 41.5 t -131.28 133.78 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.924 178.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -111.19 -31.18 2.92 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 111.715 -0.554 . . . . 1.0 111.715 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 9.3 p -158.84 -169.46 2.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.763 0.316 . . . . 1.0 110.462 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.547 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -173.03 138.1 0.74 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.794 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.613 ' O ' HG12 ' A' ' 132' ' ' VAL . 0.3 OUTLIER -129.6 141.96 50.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.57 0.7 . . . . 1.0 109.878 179.414 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.84 ' CD ' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -77.22 145.91 37.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.155 178.135 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.476 ' C ' HD12 ' A' ' 171' ' ' ILE . 48.7 t -82.52 88.32 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.691 -0.404 . . . . 1.0 111.839 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.476 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.1 mp . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.187 -0.46 . . . . 1.0 110.496 179.368 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.246 0 N-CA-C 110.752 -0.939 . . . . 1.0 110.752 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 tttt -176.34 100.87 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.498 -0.481 . . . . 1.0 110.319 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -118.89 165.38 14.26 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.659 -179.401 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.472 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.9 m -124.0 120.3 32.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.542 -0.91 . . . . 1.0 108.542 177.48 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.4 mt -104.11 132.87 49.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.94 -1.027 . . . . 1.0 109.845 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.472 ' CE1' HG22 ' A' ' 5' ' ' THR . 67.1 m-85 -115.05 124.99 53.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.938 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -52.71 -29.85 29.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.596 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -117.23 154.96 30.26 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.112 0.482 . . . . 1.0 110.298 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 12' ' ' PHE . 11.5 ptm180 -59.86 -172.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.548 -0.751 . . . . 1.0 110.362 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.11 25.71 0.27 Allowed Glycine 0 N--CA 1.461 0.336 0 N-CA-C 111.086 -0.805 . . . . 1.0 111.086 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.55 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 51.44 69.17 0.69 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.527 -0.337 . . . . 1.0 110.25 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -131.28 -156.58 0.76 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.032 0.444 . . . . 1.0 110.521 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.12 -153.15 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.071 -0.812 . . . . 1.0 111.071 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -69.25 148.33 49.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.74 0.305 . . . . 1.0 110.712 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -136.64 152.57 50.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.138 0.494 . . . . 1.0 110.453 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.526 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -145.13 140.98 28.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.2 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.526 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.8 tt0 -110.3 123.63 50.17 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.269 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.499 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.2 t -112.58 127.0 55.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.737 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.7 t -118.06 15.52 14.16 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.026 -0.533 . . . . 1.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.1 p -158.89 167.58 29.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.458 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.458 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 54.1 p-10 -57.75 141.36 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.502 -0.772 . . . . 1.0 111.388 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.499 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.43 145.14 44.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.198 179.693 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 p -112.16 -16.66 12.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.735 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -150.8 120.34 6.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.1 0.476 . . . . 1.0 110.624 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.3 mt -119.1 0.11 11.19 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 31.5 mt-30 -48.41 -52.13 45.62 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.784 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.617 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.8 Cg_endo -54.55 -32.58 74.92 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.933 1.756 . . . . 1.0 112.22 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -94.37 -52.37 4.37 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 120.527 -0.469 . . . . 1.0 110.555 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.2 mt -116.95 127.07 53.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.714 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -95.13 -10.56 30.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.47 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -145.55 -61.97 0.34 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.28 -0.418 . . . . 1.0 111.475 -178.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.8 t 66.83 81.32 0.2 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.779 -0.452 . . . . 1.0 109.779 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.517 ' OD1' ' CE1' ' A' ' 66' ' ' HIS . 2.4 t30 -96.93 1.78 50.84 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 120.687 0.28 . . . . 1.0 110.966 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.55 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.9 t -155.2 156.51 35.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.835 0.35 . . . . 1.0 110.087 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.4 153.72 34.15 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.912 -0.585 . . . . 1.0 110.926 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.409 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.5 mtp180 -136.05 123.41 21.94 Favored 'General case' 0 C--O 1.206 -1.189 0 N-CA-C 109.347 -0.612 . . . . 1.0 109.347 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.542 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.5 p -109.66 132.0 59.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.036 0.446 . . . . 1.0 110.259 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -85.41 -42.59 14.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.231 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 t -163.95 150.42 11.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.937 -0.394 . . . . 1.0 109.937 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.56 177.81 42.73 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 110.745 -0.942 . . . . 1.0 110.745 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -111.85 140.8 46.2 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.594 -0.521 . . . . 1.0 109.594 178.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.409 ' CE2' HD13 ' A' ' 81' ' ' LEU . 57.2 m95 -128.46 133.75 48.58 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.495 0.664 . . . . 1.0 111.355 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.572 ' C ' HD12 ' A' ' 45' ' ' LEU . 27.5 tpp -107.45 129.37 54.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.294 -0.866 . . . . 1.0 109.233 178.49 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.572 HD12 ' C ' ' A' ' 44' ' ' MET . 9.9 mp -109.32 130.86 55.48 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.868 -0.605 . . . . 1.0 109.832 -179.239 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -111.09 130.65 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 1.0 111.402 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.634 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 9.3 pt-20 -56.69 -37.26 70.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.767 -0.651 . . . . 1.0 111.214 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 5.2 mt-30 -106.29 153.53 40.33 Favored Pre-proline 0 C--O 1.233 0.203 0 CA-C-N 115.83 -0.623 . . . . 1.0 110.688 -178.661 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.26 159.23 48.21 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.386 2.058 . . . . 1.0 112.208 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 62.4 45.04 6.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.744 -0.662 . . . . 1.0 111.149 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 42.96 74.93 0.1 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.419 -0.81 . . . . 1.0 110.837 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 m -145.38 157.31 44.05 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.061 0.458 . . . . 1.0 109.867 -178.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.7 -148.15 23.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.732 -0.746 . . . . 1.0 111.683 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.634 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.7 tp -76.83 142.41 40.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.44 -0.38 . . . . 1.0 110.202 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -119.41 150.42 40.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.487 -0.19 . . . . 1.0 110.487 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.43 ' C ' ' SD ' ' A' ' 44' ' ' MET . 18.5 m-85 -126.18 124.15 39.82 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 116.52 -0.309 . . . . 1.0 110.771 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.406 ' C ' HD12 ' A' ' 58' ' ' LEU . 46.6 t80 -84.23 123.64 30.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.255 -0.43 . . . . 1.0 109.893 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.5 mp -118.32 147.33 43.59 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.82 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' A' ' 60' ' ' ARG . 31.4 mtm-85 -134.74 155.02 51.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.89 -178.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' A' ' 59' ' ' ARG . 27.7 tpt85 -32.41 125.46 0.31 Allowed 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.542 0.526 . . . . 1.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.542 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 153.62 -177.34 31.2 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.242 -1.143 . . . . 1.0 110.242 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -115.6 136.18 53.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.825 0.345 . . . . 1.0 110.186 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -128.25 112.41 14.46 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.819 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.51 -4.57 55.34 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.677 -0.692 . . . . 1.0 111.339 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 19.6 m-20 -147.14 141.94 26.81 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.417 -0.586 . . . . 1.0 109.417 179.361 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.517 ' CE1' ' OD1' ' A' ' 34' ' ' ASN . 29.9 p-80 -63.6 -39.92 95.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.979 0.419 . . . . 1.0 111.367 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -54.43 -6.77 0.12 Allowed 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.244 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.496 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.3 mm-40 -83.65 -35.28 24.7 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.676 -0.41 . . . . 1.0 111.402 -177.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.477 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -95.92 19.53 11.36 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 119.229 -0.415 . . . . 1.0 110.978 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.45 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 48.6 mtt 81.46 12.15 0.73 Allowed 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.91 0.756 . . . . 1.0 110.35 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.403 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.342 0.88 0 C-N-CA 120.548 -0.834 . . . . 1.0 111.152 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' VAL . . . . . 0.427 ' O ' HG22 ' A' ' 76' ' ' VAL . 1.4 p . . . . . 0 N--CA 1.474 0.766 0 CA-C-O 120.689 0.28 . . . . 1.0 110.487 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -102.24 8.74 40.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.795 -0.362 . . . . 1.0 110.656 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.2 p -163.81 162.69 23.89 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.068 0.461 . . . . 1.0 110.828 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.3 p -155.34 146.88 23.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.689 -0.687 . . . . 1.0 110.273 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.3 ptm180 -128.4 150.05 50.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.455 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.409 HD13 ' CE2' ' A' ' 43' ' ' TRP . 38.0 tp -96.99 133.94 41.0 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.033 -0.729 . . . . 1.0 109.033 177.833 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.0 mt -97.18 112.7 61.6 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 N--CA 1.499 1.817 0 C-N-CA 122.353 2.035 . . . . 1.0 112.983 -179.948 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 CA--C 1.519 -0.234 0 N-CA-C 109.718 -0.475 . . . . 1.0 109.718 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.404 ' CE1' HG12 ' A' ' 171' ' ' ILE . 7.2 m-70 -128.94 109.02 10.88 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 121.061 -0.256 . . . . 1.0 111.166 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -138.46 141.9 39.46 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 120.384 -0.526 . . . . 1.0 110.516 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.486 HD12 HG22 ' A' ' 126' ' ' VAL . 19.4 tt -155.52 149.86 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.491 -0.322 . . . . 1.0 110.637 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.518 ' HE ' ' CB ' ' A' ' 125' ' ' ASN . 22.8 ptt180 -131.47 103.94 6.7 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.558 0.694 . . . . 1.0 111.048 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.59 150.15 26.11 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.598 -0.728 . . . . 1.0 111.801 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -122.55 136.93 55.01 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.26 -0.882 . . . . 1.0 111.371 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.23 -52.95 61.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.276 -0.875 . . . . 1.0 111.017 179.55 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.631 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 74.5 mtp180 -109.12 177.02 4.88 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 120.843 0.354 . . . . 1.0 110.138 -178.378 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 57.6 mp0 . . . . . 0 CA--C 1.508 -0.668 0 CA-C-N 115.45 -0.796 . . . . 1.0 110.229 179.861 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.556 0 N-CA-C 111.076 -0.809 . . . . 1.0 111.076 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.466 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 66.4 tp60 -65.91 148.67 51.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.554 0.692 . . . . 1.0 111.174 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.64 149.17 47.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.34 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.519 HG21 ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -140.5 140.46 34.09 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 109.437 -0.579 . . . . 1.0 109.437 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -113.71 132.09 55.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.369 0.604 . . . . 1.0 110.935 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.485 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 96.9 m-85 -116.06 155.87 27.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 114.658 -1.155 . . . . 1.0 110.106 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.2 p -144.38 20.18 1.71 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.532 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -159.43 -170.8 3.07 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.595 -0.442 . . . . 1.0 110.109 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.452 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 53.6 p-10 -73.82 141.83 46.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 1.0 111.2 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.414 ' O ' ' OH ' ' A' ' 139' ' ' TYR . 2.8 m -131.17 118.91 21.14 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.259 -0.645 . . . . 1.0 109.259 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.6 p -95.86 -22.42 17.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 1.0 111.006 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 50.3 t -146.07 96.82 2.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.299 0.571 . . . . 1.0 111.839 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.572 HD11 HD22 ' A' ' 167' ' ' LEU . 8.3 mt -62.45 -41.19 98.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.025 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -45.15 -12.58 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.139 -0.482 . . . . 1.0 111.098 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 112' ' ' LEU . 64.5 t0 -96.77 -27.18 14.85 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.958 0.409 . . . . 1.0 110.508 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.4 mmt180 -108.77 -40.64 4.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.103 -0.498 . . . . 1.0 111.497 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.519 ' CD1' HG21 ' A' ' 103' ' ' ILE . 5.9 t80 -121.94 118.52 29.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.208 0.528 . . . . 1.0 110.341 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -56.51 -69.07 0.16 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.215 -0.902 . . . . 1.0 111.079 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -39.72 138.46 0.74 Allowed 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 110.059 -0.348 . . . . 1.0 110.059 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -99.81 -0.41 39.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.515 -0.312 . . . . 1.0 111.038 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -125.52 138.36 53.97 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.538 0.685 . . . . 1.0 110.854 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.5 mm -121.17 119.01 58.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 CA-C-N 114.973 -1.012 . . . . 1.0 109.617 178.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.417 ' O ' ' CB ' ' A' ' 123' ' ' SER . 23.0 m-70 -110.92 22.02 15.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.694 -0.685 . . . . 1.0 111.675 -178.802 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.565 ' C ' HD13 ' A' ' 124' ' ' LEU . 1.8 p 166.97 152.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.865 0.364 . . . . 1.0 110.651 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -162.32 163.94 27.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.557 -179.518 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 125' ' ' ASN . . . . . 0.518 ' CB ' ' HE ' ' A' ' 91' ' ' ARG . 4.5 t-20 -126.92 116.06 20.24 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.009 -0.737 . . . . 1.0 109.009 179.634 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.486 HG22 HD12 ' A' ' 90' ' ' ILE . 58.0 t -99.72 106.38 19.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 O-C-N 123.553 0.533 . . . . 1.0 110.649 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.896 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.99 -42.74 23.3 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 124.025 0.828 . . . . 1.0 110.556 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -157.77 145.38 18.54 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.457 -0.497 . . . . 1.0 110.625 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.516 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 72.6 82.83 0.29 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 115.827 -0.624 . . . . 1.0 113.061 177.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.461 ' O ' ' O ' ' A' ' 129' ' ' GLY . 13.7 t -31.51 150.24 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.162 0.506 . . . . 1.0 110.616 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.516 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 53.3 m95 -124.12 163.49 21.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.13 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 46.4 t -134.22 137.93 50.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-N 115.881 -0.6 . . . . 1.0 109.479 179.188 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.641 ' HG ' HD11 ' A' ' 146' ' ' LEU . 28.5 mt -109.02 140.39 42.6 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 109.166 -0.679 . . . . 1.0 109.166 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 134' ' ' TYR . . . . . 0.624 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 30.8 m-85 -117.27 132.36 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.89 0.376 . . . . 1.0 110.875 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.439 ' OE2' ' CZ ' ' A' ' 163' ' ' ARG . 84.6 tt0 -40.7 -55.18 2.45 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.053 -0.522 . . . . 1.0 111.08 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.575 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -121.26 172.84 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.122 0.487 . . . . 1.0 110.098 -178.87 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 137' ' ' SER . . . . . 0.42 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -74.7 169.5 17.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.546 179.297 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 138' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.9 t30 66.96 15.77 10.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.231 -0.895 . . . . 1.0 110.019 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 109' ' ' CYS . 2.5 m-85 40.21 80.66 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 1.0 111.698 179.224 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.548 ' C ' HD11 ' A' ' 136' ' ' LEU . 61.8 ttt180 -149.89 40.57 0.81 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.2 0.524 . . . . 1.0 109.786 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -150.84 -140.43 3.18 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.281 -0.728 . . . . 1.0 111.281 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.442 ' C ' HE21 ' A' ' 143' ' ' GLN . 80.7 mtp85 -76.25 171.25 14.86 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 110.121 -0.325 . . . . 1.0 110.121 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.442 HE21 ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -150.3 137.42 19.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.012 -179.706 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 144' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 6.8 m-85 -127.52 141.28 51.69 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.195 -0.668 . . . . 1.0 109.195 178.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 59.1 tp -93.83 126.78 39.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.422 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.641 HD11 ' HG ' ' A' ' 133' ' ' LEU . 13.4 mt -116.33 90.46 3.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.83 -0.623 . . . . 1.0 109.397 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.6 mtm -73.59 161.61 78.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.939 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -49.94 113.58 1.05 Allowed 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.934 1.756 . . . . 1.0 111.31 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 173.08 -152.28 15.68 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.454 -1.058 . . . . 1.0 110.454 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.462 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 p-10 -135.48 127.19 29.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.831 0.348 . . . . 1.0 111.248 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 1.8 m-85 -118.58 133.66 55.7 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 109.385 -0.598 . . . . 1.0 109.385 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -112.85 -4.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.814 0.34 . . . . 1.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -153.42 162.81 40.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.251 0.548 . . . . 1.0 110.208 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.615 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.04 -19.83 59.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.134 -0.939 . . . . 1.0 112.202 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.557 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -67.48 -20.88 65.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.85 -179.029 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -51.64 -47.94 63.54 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 120.252 -0.579 . . . . 1.0 110.793 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.637 ' CZ3' HD11 ' A' ' 124' ' ' LEU . 37.9 p90 -101.9 18.53 20.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 1.0 110.305 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.69 77.85 0.13 Allowed Glycine 0 C--N 1.331 0.265 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.615 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . . . -96.12 -170.42 2.11 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.093 0.473 . . . . 1.0 109.995 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -34.92 2.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.462 -0.79 . . . . 1.0 111.621 -179.16 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.673 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 20.8 t-20 -150.17 -15.81 0.25 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.85 0.315 . . . . 1.0 111.85 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.745 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 88.52 -23.61 0.11 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.787 -0.642 . . . . 1.0 110.827 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.439 ' CZ ' ' OE2' ' A' ' 135' ' ' GLU . 34.2 ptt180 -42.17 119.4 1.35 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.568 0.699 . . . . 1.0 110.866 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.745 HG23 ' O ' ' A' ' 162' ' ' ALA . 30.4 t -121.33 132.09 71.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.504 -0.771 . . . . 1.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -108.73 -26.87 5.15 Favored Glycine 0 N--CA 1.465 0.608 0 N-CA-C 111.338 -0.705 . . . . 1.0 111.338 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.7 p -163.88 169.02 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.961 0.41 . . . . 1.0 110.784 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.572 HD22 HD11 ' A' ' 112' ' ' LEU . 0.5 OUTLIER -153.32 146.38 24.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.899 -0.592 . . . . 1.0 111.552 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.624 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 7.0 ptp180 -136.94 148.8 47.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.615 -0.513 . . . . 1.0 109.615 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.873 HH11 ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -82.06 152.59 26.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.219 -0.901 . . . . 1.0 109.622 177.735 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.793 ' C ' HD12 ' A' ' 171' ' ' ILE . 59.2 t -85.67 85.23 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.935 0.398 . . . . 1.0 111.453 -179.22 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.793 HD12 ' C ' ' A' ' 170' ' ' VAL . 2.3 mp . . . . . 0 N--CA 1.464 0.267 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.35 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.664 0 N-CA-C 110.504 -1.038 . . . . 1.0 110.504 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -172.92 106.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.062 -0.255 . . . . 1.0 110.698 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.454 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.55 173.31 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 120.813 0.34 . . . . 1.0 111.264 -179.311 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.543 HG22 ' CE1' ' A' ' 7' ' ' TYR . 33.5 m -130.24 120.96 25.27 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.456 -0.942 . . . . 1.0 108.456 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -105.91 133.09 51.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.044 -0.98 . . . . 1.0 110.058 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.543 ' CE1' HG22 ' A' ' 5' ' ' THR . 56.9 m-85 -114.29 129.55 56.64 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.553 -0.749 . . . . 1.0 111.231 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 79.4 tt0 -56.15 -20.98 19.95 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.789 . . . . 1.0 110.324 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -127.14 154.56 44.6 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.146 0.498 . . . . 1.0 110.086 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 12' ' ' PHE . 29.0 ptt85 -58.95 -172.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.619 -0.719 . . . . 1.0 110.299 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.15 26.1 0.16 Allowed Glycine 0 N--CA 1.463 0.44 0 N-CA-C 111.083 -0.807 . . . . 1.0 111.083 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.436 ' N ' ' O ' ' A' ' 10' ' ' ARG . 5.7 m-85 50.54 66.99 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.934 -0.395 . . . . 1.0 109.934 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -126.15 -155.84 0.7 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.825 0.345 . . . . 1.0 110.469 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 39.78 -149.1 0.14 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -71.19 149.0 46.75 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.906 0.384 . . . . 1.0 110.497 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -135.01 144.78 47.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.353 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.561 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.5 t80 -140.94 142.34 34.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 1.0 110.039 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.561 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 40.5 tt0 -110.82 122.1 47.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.269 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.46 127.21 54.24 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.187 -0.461 . . . . 1.0 110.513 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -117.56 14.6 14.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 95.5 p -159.62 169.17 24.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.538 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 81' ' ' LEU . 47.7 m-20 -57.82 139.88 53.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.722 -0.672 . . . . 1.0 110.884 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.83 148.58 50.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.552 -0.749 . . . . 1.0 110.146 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -118.84 -18.84 8.8 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.654 -0.703 . . . . 1.0 112.07 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -143.87 108.66 4.91 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.197 0.522 . . . . 1.0 109.954 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 26.0 mt -111.78 0.41 16.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.747 -0.661 . . . . 1.0 110.172 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.8 mt-30 -55.28 -42.97 98.71 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.621 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.3 Cg_exo -58.85 -36.89 96.22 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.277 1.985 . . . . 1.0 112.029 -179.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -93.33 -44.61 8.21 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.962 0.41 . . . . 1.0 111.067 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.74 127.8 49.67 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.766 -0.652 . . . . 1.0 111.444 -178.438 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -91.44 -11.41 37.69 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.143 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 42.0 ttm180 -176.16 120.39 0.16 Allowed 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t -101.49 107.42 18.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.115 -0.366 . . . . 1.0 110.394 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -103.56 -4.71 23.54 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.375 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.6 p -156.18 156.41 34.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.965 0.412 . . . . 1.0 110.333 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.84 155.14 36.54 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.897 -0.592 . . . . 1.0 110.997 -179.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.3 mtt-85 -136.03 122.34 20.51 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.74 -0.664 . . . . 1.0 109.567 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.481 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.4 p -110.47 129.39 65.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.981 0.42 . . . . 1.0 110.948 179.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -81.06 -46.02 15.63 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.453 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.5 t -162.37 153.33 17.55 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.018 -0.364 . . . . 1.0 110.018 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.54 175.27 43.17 Favored Glycine 0 C--N 1.32 -0.357 0 N-CA-C 110.876 -0.89 . . . . 1.0 110.876 179.385 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 84.5 m -111.0 132.36 54.27 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.209 -0.663 . . . . 1.0 109.209 178.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.526 ' CE2' HD13 ' A' ' 81' ' ' LEU . 50.3 m95 -118.62 146.93 44.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 1.0 111.195 -179.075 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.587 ' C ' HD12 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -117.99 127.18 53.57 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 109.246 -0.649 . . . . 1.0 109.246 178.876 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.587 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -108.27 127.38 53.8 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.53 -0.544 . . . . 1.0 109.53 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -103.88 131.12 51.4 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.579 0.704 . . . . 1.0 111.429 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.593 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.1 pt-20 -60.53 -35.34 75.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.908 -1.042 . . . . 1.0 109.557 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.418 ' O ' ' OG ' ' A' ' 78' ' ' SER . 6.8 mt-30 -102.24 152.59 38.3 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.066 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -56.94 151.16 51.01 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.752 1.635 . . . . 1.0 110.796 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.584 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.6 m120 70.26 -116.11 0.1 Allowed 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.241 -1.022 . . . . 1.0 108.241 -177.711 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -152.83 70.94 0.9 Allowed 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 178.298 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.7 t -137.18 18.08 2.97 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 120.785 0.326 . . . . 1.0 110.888 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -134.68 -171.18 12.42 Favored Glycine 0 CA--C 1.519 0.341 0 N-CA-C 111.069 -0.812 . . . . 1.0 111.069 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.593 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.2 tp -58.54 151.03 21.32 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.524 -0.338 . . . . 1.0 110.153 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -121.08 149.24 43.03 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.631 0.253 . . . . 1.0 111.196 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -126.09 129.18 48.6 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 116.42 -0.355 . . . . 1.0 110.849 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.515 ' C ' HD22 ' A' ' 58' ' ' LEU . 21.8 t80 -82.94 120.43 25.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.419 0.628 . . . . 1.0 110.138 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.515 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.9 mm? -110.79 133.78 53.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.135 -0.939 . . . . 1.0 109.678 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.707 ' NH1' HH12 ' A' ' 168' ' ' ARG . 76.6 mtm180 -127.92 145.67 50.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.266 -0.879 . . . . 1.0 109.534 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.466 ' HA ' HG13 ' A' ' 38' ' ' VAL . 73.1 ttt-85 -31.71 126.8 0.22 Allowed 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.447 0.467 . . . . 1.0 111.323 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.481 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 152.09 -174.34 31.1 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.472 -1.051 . . . . 1.0 110.472 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.63 133.36 56.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.004 0.43 . . . . 1.0 110.353 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -127.39 113.33 16.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.042 -0.526 . . . . 1.0 109.646 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.39 -3.68 54.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.302 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -146.63 143.48 28.84 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.395 -0.594 . . . . 1.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.521 ' C ' ' H ' ' A' ' 68' ' ' GLN . 22.7 p-80 -66.03 -42.43 89.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 1.0 110.928 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -52.01 -7.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.802 -0.635 . . . . 1.0 110.449 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.521 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.5 mm-40 -82.38 -36.14 27.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.825 -0.35 . . . . 1.0 111.212 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.7 p90 -93.53 19.58 8.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 119.391 -0.338 . . . . 1.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.463 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 66.6 mtp 79.88 17.19 0.75 Allowed 'General case' 0 C--O 1.233 0.209 0 O-C-N 123.942 0.776 . . . . 1.0 109.749 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.972 0 C-N-CA 120.898 -0.668 . . . . 1.0 112.123 179.563 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 109.053 -0.721 . . . . 1.0 109.053 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.8 mtm180 -127.94 6.25 6.02 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.477 -178.576 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 11.5 p -161.65 159.98 28.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.147 0.498 . . . . 1.0 110.305 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.6 p -155.8 146.98 22.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.109 -178.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -127.26 145.51 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.862 -0.421 . . . . 1.0 109.862 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.526 HD13 ' CE2' ' A' ' 43' ' ' TRP . 34.3 tp -95.04 134.36 37.81 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.052 -0.722 . . . . 1.0 109.052 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.497 HD11 ' SD ' ' A' ' 44' ' ' MET . 2.2 mt -95.33 113.53 61.83 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 109.543 -0.54 . . . . 1.0 109.543 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 N--CA 1.498 1.763 0 C-N-CA 122.257 1.971 . . . . 1.0 112.968 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 CA--C 1.52 -0.183 0 CA-C-O 120.767 0.318 . . . . 1.0 110.377 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.537 ' CD2' HD11 ' A' ' 171' ' ' ILE . 5.5 m80 -136.54 111.9 9.18 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.341 -0.39 . . . . 1.0 110.981 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 43.5 mtm-85 -142.32 139.21 31.75 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.755 -0.378 . . . . 1.0 110.425 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.4 tt -152.81 153.63 8.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.063 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -133.36 112.96 12.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.294 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.82 ' N ' HD22 ' A' ' 92' ' ' LEU . 1.5 mm? -88.92 123.47 33.3 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.419 -0.809 . . . . 1.0 109.821 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.585 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 26.6 m-85 -100.04 135.43 41.47 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 115.308 -0.86 . . . . 1.0 110.757 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.486 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.5 tm-20 -57.2 -60.58 3.4 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.585 -0.734 . . . . 1.0 111.394 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.466 ' O ' ' OG ' ' A' ' 123' ' ' SER . 84.4 mtp180 -102.2 166.8 10.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.748 -178.708 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 . . . . . 0 CA--C 1.516 -0.333 0 CA-C-N 115.641 -0.709 . . . . 1.0 110.711 178.812 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.837 0 N-CA-C 111.142 -0.783 . . . . 1.0 111.142 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -62.12 143.15 57.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 121.071 -0.251 . . . . 1.0 110.392 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.585 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 11.3 ttp -133.38 149.57 51.84 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.814 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.411 ' N ' ' HG2' ' A' ' 102' ' ' MET . 11.0 tt -143.0 141.8 26.48 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 N-CA-C 109.57 -0.53 . . . . 1.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -113.93 143.98 43.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 1.0 110.715 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.66 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 82.6 m-85 -131.36 154.83 48.18 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.011 -0.995 . . . . 1.0 110.489 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.6 p -144.52 19.85 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.805 -0.634 . . . . 1.0 111.137 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 1.019 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.0 pt-20 -167.45 83.35 0.21 Allowed 'General case' 0 C--O 1.213 -0.865 0 CA-C-O 118.025 -0.988 . . . . 1.0 109.967 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 1.019 ' O ' ' O ' ' A' ' 107' ' ' GLU . 51.9 p30 16.49 163.0 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 122.359 1.076 . . . . 1.0 113.358 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 108' ' ' ASP . 8.8 m -146.66 107.17 4.07 Favored 'General case' 0 C--N 1.308 -1.235 0 O-C-N 120.18 -1.575 . . . . 1.0 109.545 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.416 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.6 p -66.33 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.317 -0.401 . . . . 1.0 110.969 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 15.7 t -142.52 88.9 2.1 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.13 0.491 . . . . 1.0 110.208 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.66 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 11.7 tp -61.55 -41.71 97.77 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 115.553 -0.749 . . . . 1.0 110.265 -178.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.644 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.5 mp0 -43.15 -10.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.258 -0.428 . . . . 1.0 111.719 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 112' ' ' LEU . 62.7 t0 -95.29 -21.81 18.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.055 0.455 . . . . 1.0 110.748 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 112' ' ' LEU . 25.2 mmt85 -108.86 -36.71 6.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.899 0.703 . . . . 1.0 112.899 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.706 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.16 138.37 54.24 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 122.2 1.0 . . . . 1.0 110.861 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.3 mmt-85 -75.33 -73.72 0.24 Allowed 'General case' 0 C--N 1.312 -1.041 0 O-C-N 120.641 -1.287 . . . . 1.0 110.62 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.683 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.4 m-85 -31.31 144.77 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.564 0 O-C-N 123.508 0.505 . . . . 1.0 110.314 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -105.6 9.25 33.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.826 0.346 . . . . 1.0 111.075 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -137.85 138.75 39.43 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.008 -0.542 . . . . 1.0 111.173 -178.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.734 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.6 mm -120.98 121.35 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.426 -0.807 . . . . 1.0 109.183 178.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -111.24 20.74 17.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.883 -0.599 . . . . 1.0 111.634 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 3.1 p 169.85 153.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.069 0.461 . . . . 1.0 110.273 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.434 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.5 pp -165.94 161.59 17.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.662 -0.699 . . . . 1.0 110.788 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 125' ' ' ASN . . . . . 0.471 HD22 HD11 ' A' ' 127' ' ' LEU . 3.0 t30 -128.55 120.85 27.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.368 -0.378 . . . . 1.0 110.152 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.0 t -100.93 105.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.1 -0.704 . . . . 1.0 109.1 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.915 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.44 -42.2 30.62 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.932 -0.576 . . . . 1.0 111.212 -179.507 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.0 mm-40 -138.8 166.97 23.03 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.534 0.683 . . . . 1.0 110.498 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 42.96 -176.99 0.01 OUTLIER Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.953 -1.476 . . . . 1.0 111.007 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.36 152.9 35.99 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.379 -0.6 . . . . 1.0 109.379 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 39.6 m95 -125.25 168.09 13.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.697 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 132' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 168' ' ' ARG . 1.9 p -141.83 99.27 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.733 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.57 141.08 56.93 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 120.275 -0.57 . . . . 1.0 110.789 -178.155 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -118.51 131.63 56.23 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.843 -0.617 . . . . 1.0 109.703 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -46.93 -49.17 20.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.033 -0.53 . . . . 1.0 111.679 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.53 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.2 175.63 6.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.318 0.58 . . . . 1.0 110.383 -178.957 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.7 p -82.7 170.68 14.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.437 -0.801 . . . . 1.0 110.355 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 138' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 138' ' ' ASN . 41.1 t-20 66.22 17.34 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.261 -179.431 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 37.13 79.25 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.0 111.751 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 28.2 ttm180 -149.59 39.24 0.79 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.026 0.441 . . . . 1.0 110.508 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.448 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -152.93 -143.11 3.61 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.374 -0.691 . . . . 1.0 111.374 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -74.41 168.45 19.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.985 0.421 . . . . 1.0 110.24 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.486 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 6.6 pt20 -150.57 141.35 22.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.77 -0.65 . . . . 1.0 111.449 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 144' ' ' TYR . . . . . 0.449 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.8 m-85 -131.02 139.33 49.95 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.494 -0.928 . . . . 1.0 108.494 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.617 ' C ' HD22 ' A' ' 146' ' ' LEU . 49.4 tp -92.67 126.47 37.77 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.634 0.584 . . . . 1.0 111.617 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.826 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.7 mm? -114.83 102.71 10.25 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.437 -0.802 . . . . 1.0 109.608 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 3.6 mtm -81.99 164.82 46.68 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.451 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.62 119.28 6.44 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 121.968 1.779 . . . . 1.0 111.312 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.65 -153.17 21.22 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.536 -1.026 . . . . 1.0 110.536 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -128.36 132.63 48.56 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.755 0.312 . . . . 1.0 110.387 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.466 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 33.5 m-85 -123.26 132.07 53.89 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.003 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -117.03 -6.72 11.39 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -153.05 163.96 38.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.34 0.591 . . . . 1.0 110.03 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.4 p90 -76.76 -20.55 56.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.061 -0.972 . . . . 1.0 112.239 -178.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -68.82 -19.64 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 1.0 111.065 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.76 -49.56 57.76 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.934 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.689 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 17.3 p90 -96.84 22.54 8.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.317 -0.402 . . . . 1.0 110.713 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 75.56 0.21 Allowed Glycine 0 CA--C 1.517 0.195 0 N-CA-C 111.223 -0.751 . . . . 1.0 111.223 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.689 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.37 147.05 43.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 110.26 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.9 t -78.21 -10.09 59.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.097 178.231 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.514 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 8.1 t-20 -171.99 -169.15 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.583 -0.447 . . . . 1.0 110.259 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.734 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -110.28 -18.86 13.18 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.375 -0.375 . . . . 1.0 110.659 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 162' ' ' ALA . 20.0 ptp180 -37.22 123.69 0.93 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.309 0.576 . . . . 1.0 111.695 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 162' ' ' ALA . 22.0 t -127.32 159.84 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.02 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.52 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -135.27 -35.7 0.23 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.689 -0.687 . . . . 1.0 111.543 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.416 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.6 m -158.88 -168.36 2.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.702 0.287 . . . . 1.0 110.278 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.521 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -173.36 134.24 0.52 Allowed 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.472 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.707 HH12 ' NH1' ' A' ' 59' ' ' ARG . 1.8 ttm180 -129.32 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.409 0.623 . . . . 1.0 109.643 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.421 ' H ' ' HG2' ' A' ' 169' ' ' ARG . 10.4 ptt180 -80.27 153.44 28.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.841 -1.072 . . . . 1.0 110.075 178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.742 ' C ' HD12 ' A' ' 171' ' ' ILE . 47.9 t -90.33 86.03 2.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.861 0.363 . . . . 1.0 111.851 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.742 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.0 mp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.264 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.558 0 N-CA-C 110.39 -1.084 . . . . 1.0 110.39 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -171.7 105.06 0.2 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.021 -0.271 . . . . 1.0 110.398 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 167.8 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.111 0.481 . . . . 1.0 111.399 -178.966 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.5 m -124.87 121.4 34.4 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.029 -1.1 . . . . 1.0 108.029 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -106.39 133.82 50.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.015 -0.993 . . . . 1.0 110.364 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.479 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.6 m-85 -115.8 126.85 54.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.539 -0.755 . . . . 1.0 111.256 -178.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -53.88 -28.07 34.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 1.0 110.515 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -119.45 151.4 38.61 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.433 0.635 . . . . 1.0 110.621 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.8 ptt-85 -56.87 -175.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 1.0 110.847 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.3 25.54 0.78 Allowed Glycine 0 N--CA 1.462 0.397 0 N-CA-C 110.912 -0.875 . . . . 1.0 110.912 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 51.61 67.16 1.0 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.198 -0.297 . . . . 1.0 110.198 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -128.86 -157.91 0.85 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.085 0.469 . . . . 1.0 110.555 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.59 -151.31 0.31 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.822 -0.911 . . . . 1.0 110.822 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -70.14 148.36 48.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.871 -0.332 . . . . 1.0 110.87 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -136.0 149.48 48.86 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.37 0.605 . . . . 1.0 110.374 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.4 t80 -143.95 142.45 30.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.255 -0.884 . . . . 1.0 110.014 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 70.5 tt0 -110.83 121.43 45.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.264 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -108.71 126.79 53.38 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.739 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.0 m -117.61 12.08 13.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.751 -0.659 . . . . 1.0 110.56 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.5 m -157.48 168.46 27.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.177 0.513 . . . . 1.0 110.447 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -58.51 140.7 53.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.054 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.71 148.99 49.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.966 -0.561 . . . . 1.0 110.338 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.6 p -118.79 -13.54 9.54 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.748 -0.66 . . . . 1.0 112.047 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -150.28 111.99 4.51 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.314 0.578 . . . . 1.0 109.773 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.3 mt -116.02 -0.55 12.73 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.402 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.2 mt-30 -53.16 -42.28 90.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.3 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 34.3 Cg_exo -58.23 -34.91 99.04 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.03 1.82 . . . . 1.0 111.548 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -95.98 -52.82 3.89 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 121.037 -0.265 . . . . 1.0 111.072 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -118.57 127.41 53.59 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.976 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -95.06 -7.52 39.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.794 -0.639 . . . . 1.0 111.955 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -146.75 -60.46 0.29 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.418 0.525 . . . . 1.0 112.418 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 50.3 t 64.99 75.38 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 122.499 0.319 . . . . 1.0 110.158 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -92.01 4.33 53.29 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.305 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -156.9 157.58 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.969 0.414 . . . . 1.0 110.19 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.81 154.46 32.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.813 -0.631 . . . . 1.0 111.336 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -132.1 121.0 23.1 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.83 -0.804 . . . . 1.0 108.83 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -107.21 114.82 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.63 0.582 . . . . 1.0 110.424 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.37 -44.37 45.34 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.101 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.1 p -160.91 159.07 29.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 109.38 -0.6 . . . . 1.0 109.38 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.14 175.79 50.8 Favored Glycine 0 C--N 1.315 -0.586 0 N-CA-C 111.026 -0.83 . . . . 1.0 111.026 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 85.6 m -113.46 136.99 52.19 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.0 -0.741 . . . . 1.0 109.0 178.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.528 ' CE2' HD13 ' A' ' 81' ' ' LEU . 58.2 m95 -124.66 142.42 51.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.247 0.546 . . . . 1.0 111.415 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.537 ' C ' HD23 ' A' ' 45' ' ' LEU . 10.4 tpp -115.91 129.01 56.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.331 -0.85 . . . . 1.0 109.164 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.537 HD23 ' C ' ' A' ' 44' ' ' MET . 1.0 OUTLIER -107.97 130.17 55.07 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -104.81 131.87 51.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.674 0.75 . . . . 1.0 111.17 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.49 ' HG2' ' H ' ' A' ' 54' ' ' LEU . 0.4 OUTLIER -60.33 -33.82 72.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 1.0 110.808 -178.159 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.611 ' NE2' ' O ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -108.54 154.64 41.46 Favored Pre-proline 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 1.0 108.861 -179.61 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.611 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 20.9 Cg_endo -56.38 148.76 60.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 121.372 1.381 . . . . 1.0 111.621 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.536 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.1 m-20 74.83 -123.92 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.812 -0.81 . . . . 1.0 108.812 -178.685 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -150.83 74.65 1.17 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.198 0.523 . . . . 1.0 110.695 179.061 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 52' ' ' SER . . . . . 0.493 ' H ' ' CD ' ' A' ' 48' ' ' GLN . 1.4 t -142.72 20.59 2.0 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.764 -0.653 . . . . 1.0 111.893 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -139.2 -159.53 8.03 Favored Glycine 0 N--CA 1.46 0.282 0 N-CA-C 111.181 -0.768 . . . . 1.0 111.181 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.574 HD23 ' OH ' ' A' ' 56' ' ' TYR . 46.5 tp -64.77 146.47 54.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.818 -0.353 . . . . 1.0 110.499 -178.795 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -122.73 150.5 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 1.0 110.971 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.574 ' OH ' HD23 ' A' ' 54' ' ' LEU . 63.7 m-85 -125.61 123.66 39.5 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.569 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.629 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 46.1 t80 -83.94 121.73 27.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.237 0.541 . . . . 1.0 110.201 -178.643 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.414 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.5 mp -117.22 143.46 45.85 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.586 -0.734 . . . . 1.0 109.972 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.436 ' O ' ' C ' ' A' ' 60' ' ' ARG . 28.6 mtt85 -129.67 153.67 47.9 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.58 -0.736 . . . . 1.0 109.398 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 59' ' ' ARG . 17.0 ptm180 -32.69 127.58 0.27 Allowed 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.294 0.371 . . . . 1.0 111.431 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 151.4 -175.47 30.26 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.814 -0.914 . . . . 1.0 110.814 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.8 p-10 -116.2 134.2 55.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.085 0.469 . . . . 1.0 110.696 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -127.57 114.56 17.56 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.937 -0.574 . . . . 1.0 109.792 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.414 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.58 -3.78 52.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.152 -0.477 . . . . 1.0 111.605 -179.264 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -147.64 142.74 27.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.979 -0.749 . . . . 1.0 108.979 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.511 ' C ' ' H ' ' A' ' 68' ' ' GLN . 11.6 p-80 -62.11 -46.06 90.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.119 0.485 . . . . 1.0 111.116 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -49.22 -8.97 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.945 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.511 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.4 mm-40 -82.84 -35.32 26.43 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.513 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -91.49 19.73 5.94 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 118.956 -0.545 . . . . 1.0 111.571 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.513 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 61.6 mtp 87.38 8.33 0.19 Allowed 'General case' 0 N--CA 1.461 0.111 0 O-C-N 124.22 0.95 . . . . 1.0 109.368 -178.215 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.813 0 N-CA-C 110.238 -1.145 . . . . 1.0 110.238 178.405 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 t . . . . . 0 CA--C 1.519 -0.236 0 N-CA-C 108.836 -0.802 . . . . 1.0 108.836 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -120.32 1.95 10.78 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.796 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 6.1 p -161.44 160.69 29.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.404 0.621 . . . . 1.0 110.808 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.0 p -154.32 146.33 23.6 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.177 -0.919 . . . . 1.0 110.034 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.86 146.05 50.74 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.889 -0.411 . . . . 1.0 109.889 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.528 HD13 ' CE2' ' A' ' 43' ' ' TRP . 31.1 tp -96.96 134.79 39.86 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.815 -0.809 . . . . 1.0 108.815 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.45 ' H ' HD12 ' A' ' 81' ' ' LEU . 2.3 mt -96.24 111.26 55.99 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.485 -0.561 . . . . 1.0 109.485 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.501 1.948 0 C-N-CA 121.872 1.715 . . . . 1.0 113.285 -179.283 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 0 CA--C 1.522 -0.128 0 N-CA-C 109.667 -0.494 . . . . 1.0 109.667 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.442 ' CE1' HD11 ' A' ' 171' ' ' ILE . 5.7 m-70 -130.28 104.73 7.45 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 121.124 -0.23 . . . . 1.0 110.999 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -137.06 141.15 42.41 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.804 -0.359 . . . . 1.0 110.951 179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.445 HD12 HG22 ' A' ' 126' ' ' VAL . 19.9 tt -150.63 144.25 17.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.157 -0.474 . . . . 1.0 111.272 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -120.11 97.85 5.79 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.948 -0.569 . . . . 1.0 111.626 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 28.6 mt -78.54 142.67 37.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.966 -0.561 . . . . 1.0 109.936 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -121.18 138.93 53.98 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.339 0.59 . . . . 1.0 111.801 -178.275 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.524 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 8.9 tp10 -63.1 -37.72 88.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.649 -0.705 . . . . 1.0 110.829 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -128.2 169.27 14.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.364 0.602 . . . . 1.0 111.075 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 114.928 -1.033 . . . . 1.0 110.717 179.723 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.954 0 N-CA-C 111.189 -0.764 . . . . 1.0 111.189 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 67.9 tp60 -68.16 142.91 55.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 1.0 110.878 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.9 ptm -133.27 155.25 49.73 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.612 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.511 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.8 tt -147.97 142.0 19.25 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 N-CA-C 109.817 -0.438 . . . . 1.0 109.817 178.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -112.8 142.39 45.5 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.809 0.814 . . . . 1.0 110.811 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.12 157.05 40.73 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.441 -1.254 . . . . 1.0 110.506 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.6 p -142.27 19.11 2.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.3 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -164.13 -167.18 1.27 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.938 0.399 . . . . 1.0 110.87 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 51.2 p30 -78.9 148.4 32.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.262 0.553 . . . . 1.0 111.021 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.439 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.8 t -135.65 93.98 3.02 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.592 -0.731 . . . . 1.0 109.759 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -65.31 -27.68 68.78 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.618 -0.433 . . . . 1.0 111.274 -179.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 111' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' A' ' 111' ' ' CYS . 28.2 p -139.28 95.67 2.97 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.415 0.626 . . . . 1.0 110.849 -179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 114' ' ' ASP . 19.3 tp -62.47 -41.22 98.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.285 -0.87 . . . . 1.0 110.121 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.595 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 27.8 mp0 -45.23 -11.96 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.327 -0.397 . . . . 1.0 111.435 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.535 ' C ' ' HE ' ' A' ' 115' ' ' ARG . 21.8 m-20 -95.07 -25.11 16.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.095 0.474 . . . . 1.0 110.73 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.535 ' HE ' ' C ' ' A' ' 114' ' ' ASP . 6.4 mmp_? -107.87 -41.73 4.9 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.785 -0.643 . . . . 1.0 111.937 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.511 ' CD1' HG21 ' A' ' 103' ' ' ILE . 2.3 t80 -123.54 122.24 37.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.217 0.532 . . . . 1.0 109.68 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.2 mtt-85 -61.64 -46.16 90.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.514 -0.766 . . . . 1.0 111.059 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.524 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 97.3 m-85 -58.05 139.67 54.12 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.691 -0.686 . . . . 1.0 109.616 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -100.89 4.14 42.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.886 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -135.11 141.41 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.193 0.52 . . . . 1.0 110.913 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.5 mm -122.94 117.25 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.658 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 123' ' ' SER . 27.2 m-70 -105.9 27.56 8.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.188 -0.46 . . . . 1.0 112.03 -178.354 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 10.3 t 163.39 152.65 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 123.495 0.497 . . . . 1.0 109.818 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.48 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.0 OUTLIER -163.58 158.09 20.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.476 -178.69 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -122.74 116.98 24.67 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 109.411 -0.588 . . . . 1.0 109.411 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.445 HG22 HD12 ' A' ' 90' ' ' ILE . 39.1 t -101.63 105.58 18.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 116.143 -0.481 . . . . 1.0 109.791 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.865 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.78 -45.1 21.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.725 179.633 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -156.99 149.94 23.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.745 -0.382 . . . . 1.0 111.043 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 70.07 79.57 0.32 Allowed Glycine 0 C--N 1.329 0.163 0 CA-C-N 116.198 -0.456 . . . . 1.0 112.384 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.431 ' C ' ' O ' ' A' ' 129' ' ' GLY . 45.7 p -32.17 149.44 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 121.219 0.533 . . . . 1.0 111.202 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.512 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 44.1 m95 -123.38 164.99 17.77 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.466 -0.788 . . . . 1.0 111.521 -178.066 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 29.0 t -131.88 133.99 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 178.791 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.47 142.22 39.17 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -120.54 136.82 54.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.084 0.24 . . . . 1.0 110.917 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -48.94 -44.93 41.09 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.474 -0.49 . . . . 1.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.494 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.7 178.01 5.67 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.321 0.582 . . . . 1.0 110.684 -178.905 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.2 m -82.52 171.71 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.523 -0.762 . . . . 1.0 111.022 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 62.78 20.43 12.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 1.0 110.18 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 139' ' ' TYR . 1.0 OUTLIER 35.59 78.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.067 -0.515 . . . . 1.0 111.644 179.056 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.41 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 30.5 ttm180 -148.3 38.58 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.02 0.438 . . . . 1.0 110.408 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.438 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -153.6 -137.67 2.52 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.13 -0.788 . . . . 1.0 111.13 -178.672 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? -72.42 164.38 26.46 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.658 0.266 . . . . 1.0 110.439 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.629 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 5.7 pt20 -149.31 139.2 21.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.886 -0.597 . . . . 1.0 110.839 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -131.09 135.94 47.95 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.698 -0.852 . . . . 1.0 108.698 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.681 HD22 ' SD ' ' A' ' 147' ' ' MET . 0.8 OUTLIER -91.13 129.45 37.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.382 0.61 . . . . 1.0 109.649 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.627 ' N ' HD23 ' A' ' 145' ' ' LEU . 1.6 mm? -114.43 102.92 10.54 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.212 -1.033 . . . . 1.0 108.212 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.681 ' SD ' HD22 ' A' ' 145' ' ' LEU . 1.8 mpp? -80.53 165.95 42.76 Favored Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 109.72 -0.474 . . . . 1.0 109.72 -179.096 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -60.53 122.99 12.15 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.624 1.55 . . . . 1.0 111.406 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.31 -154.14 23.78 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 -179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -126.46 133.4 51.22 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.893 0.378 . . . . 1.0 110.327 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.1 m-85 -122.94 128.25 50.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.549 -0.537 . . . . 1.0 109.549 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -114.08 -5.13 13.09 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 110.341 -0.244 . . . . 1.0 110.341 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -154.96 163.22 40.62 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.494 0.664 . . . . 1.0 110.513 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.02 -22.01 58.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.175 -0.92 . . . . 1.0 111.807 -178.582 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.23 -22.39 66.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.134 -0.485 . . . . 1.0 111.361 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 156' ' ' ASP . . . . . 0.498 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.2 t0 -47.59 -50.03 25.16 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.333 -178.651 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.599 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.3 p90 -99.59 19.32 16.0 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.029 0.442 . . . . 1.0 110.131 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.93 72.72 0.47 Allowed Glycine 0 CA--C 1.522 0.481 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.43 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.599 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.25 -171.66 2.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.689 0.757 . . . . 1.0 110.84 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.13 -35.69 3.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.696 -1.138 . . . . 1.0 112.089 -178.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.597 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 23.7 t-20 -146.58 -25.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.006 -0.278 . . . . 1.0 111.64 -178.709 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.819 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 97.96 -19.87 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 124.301 1.001 . . . . 1.0 110.255 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -42.15 116.29 0.8 Allowed 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 115.145 -0.934 . . . . 1.0 111.345 -178.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 162' ' ' ALA . 60.8 t -123.3 124.41 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.393 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.454 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -103.42 -24.76 7.7 Favored Glycine 0 N--CA 1.462 0.407 0 N-CA-C 111.055 -0.818 . . . . 1.0 111.055 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 109' ' ' CYS . 5.7 t -160.14 171.34 19.43 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.644 -0.422 . . . . 1.0 110.311 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 166' ' ' SER . 0.9 OUTLIER -157.92 144.29 17.58 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.524 . . . . 1.0 111.699 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -133.42 162.35 32.1 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.604 -0.517 . . . . 1.0 109.604 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.465 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.42 153.9 17.57 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.446 -0.797 . . . . 1.0 109.261 178.922 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.424 HG21 ' OG ' ' A' ' 130' ' ' SER . 48.1 t -89.7 82.05 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.969 -0.457 . . . . 1.0 111.788 -178.366 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.442 HD11 ' CE1' ' A' ' 88' ' ' HIS . 1.2 mp . . . . . 0 N--CA 1.471 0.576 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.166 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.621 0 N-CA-C 110.609 -0.997 . . . . 1.0 110.609 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -171.76 105.81 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.856 -0.338 . . . . 1.0 110.589 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.18 168.8 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-O 120.908 0.385 . . . . 1.0 110.942 -178.841 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.489 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.3 m -126.28 120.73 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.263 -1.014 . . . . 1.0 108.263 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -105.4 132.91 50.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.1 -0.954 . . . . 1.0 110.242 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.489 ' CE1' HG22 ' A' ' 5' ' ' THR . 70.6 m-85 -115.58 126.55 54.35 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.224 -0.898 . . . . 1.0 111.201 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.13 -31.66 31.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.487 -0.779 . . . . 1.0 110.464 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -116.75 160.26 21.05 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.285 0.564 . . . . 1.0 110.486 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.414 ' C ' ' N ' ' A' ' 12' ' ' PHE . 11.2 ptm180 -63.87 -173.16 0.07 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.338 -0.846 . . . . 1.0 110.702 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.43 24.66 0.4 Allowed Glycine 0 N--CA 1.459 0.224 0 N-CA-C 110.732 -0.947 . . . . 1.0 110.732 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 8.3 m-85 50.43 70.09 0.55 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.527 -0.336 . . . . 1.0 110.275 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -131.83 -155.37 0.68 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.045 0.45 . . . . 1.0 110.309 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.64 -150.06 0.16 Allowed Glycine 0 CA--C 1.526 0.764 0 N-CA-C 111.036 -0.826 . . . . 1.0 111.036 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -69.36 145.92 52.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.774 0.321 . . . . 1.0 110.682 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -135.86 149.86 49.18 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.179 0.514 . . . . 1.0 110.296 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.1 t80 -144.32 141.57 29.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.36 -0.837 . . . . 1.0 110.204 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 33.0 tt0 -110.53 122.63 48.21 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.304 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -109.89 126.23 53.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.638 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.9 p -117.99 9.55 12.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.934 -0.576 . . . . 1.0 110.475 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.5 p -154.91 167.1 31.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.713 -178.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -58.08 137.45 56.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.557 -0.747 . . . . 1.0 111.512 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.37 141.47 47.91 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.685 -0.689 . . . . 1.0 110.156 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.9 p -108.92 -14.49 14.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.679 -0.691 . . . . 1.0 111.841 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -152.6 118.16 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.103 0.478 . . . . 1.0 110.602 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.437 HD11 ' SG ' ' A' ' 79' ' ' CYS . 11.0 mt -117.46 0.84 12.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.582 -0.736 . . . . 1.0 110.266 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.609 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 41.1 mt-30 -48.8 -51.4 54.44 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.124 -0.489 . . . . 1.0 110.759 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.609 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.8 Cg_endo -55.93 -32.94 87.46 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 121.544 1.496 . . . . 1.0 112.33 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -94.27 -52.02 4.54 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.296 -0.562 . . . . 1.0 110.644 -178.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -117.28 127.73 54.37 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.0 110.551 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.1 t -95.51 -10.23 30.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.527 -0.761 . . . . 1.0 111.631 -179.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -147.12 -55.32 0.24 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.392 -0.367 . . . . 1.0 111.824 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 t 59.96 75.48 0.4 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -92.88 4.12 54.46 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.339 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.543 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -154.69 155.44 34.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.906 0.384 . . . . 1.0 110.036 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.2 154.53 35.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.153 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -134.46 122.41 22.45 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 108.554 -0.906 . . . . 1.0 108.554 178.903 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.9 t -107.61 117.39 53.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.276 0.56 . . . . 1.0 109.869 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -79.81 -43.33 22.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.395 -0.821 . . . . 1.0 110.76 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 t -161.64 155.91 22.43 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.48 173.87 50.0 Favored Glycine 0 C--N 1.317 -0.523 0 N-CA-C 110.97 -0.852 . . . . 1.0 110.97 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.2 m -110.28 140.77 44.1 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.456 -0.572 . . . . 1.0 109.456 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.418 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 56.1 m95 -128.3 155.76 44.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.322 0.582 . . . . 1.0 111.063 -179.168 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.661 ' SD ' ' NE2' ' A' ' 55' ' ' GLN . 15.7 ttm -131.17 131.28 43.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.827 -0.805 . . . . 1.0 108.827 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.495 HD23 ' C ' ' A' ' 44' ' ' MET . 0.8 OUTLIER -108.62 131.1 55.22 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 108.948 -0.76 . . . . 1.0 108.948 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.427 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 61.6 m-85 -107.37 131.54 54.14 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.725 0.774 . . . . 1.0 110.667 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.616 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.1 pt-20 -58.35 -36.35 73.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.917 -1.038 . . . . 1.0 110.974 -178.243 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.452 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.6 mt-30 -109.88 152.81 43.19 Favored Pre-proline 0 C--O 1.232 0.153 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.47 -178.759 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 157.28 54.02 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.378 2.052 . . . . 1.0 112.591 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 64.86 36.57 7.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.871 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.427 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.7 m-85 50.83 75.1 0.2 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.051 -0.977 . . . . 1.0 111.038 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.4 m -142.61 154.27 44.25 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.884 0.373 . . . . 1.0 110.139 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.2 -148.13 22.06 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.854 -0.688 . . . . 1.0 111.728 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.616 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.8 tp -77.9 146.81 35.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.466 -0.367 . . . . 1.0 110.597 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.661 ' NE2' ' SD ' ' A' ' 44' ' ' MET . 7.3 pt20 -122.86 153.72 39.24 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.065 -0.346 . . . . 1.0 110.065 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.457 ' CE1' ' O ' ' A' ' 70' ' ' MET . 20.6 m-85 -129.38 129.67 45.05 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.923 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.427 ' C ' HD22 ' A' ' 58' ' ' LEU . 45.6 t80 -82.53 121.22 26.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.389 0.614 . . . . 1.0 109.814 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.427 HD22 ' C ' ' A' ' 57' ' ' PHE . 2.8 mm? -109.94 136.75 48.73 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.56 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 60' ' ' ARG . 23.0 mtm-85 -129.05 154.89 46.22 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.485 -0.779 . . . . 1.0 109.934 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 78.8 ttt-85 -38.29 125.9 1.33 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.668 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.0 -177.84 32.85 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.625 -0.99 . . . . 1.0 110.625 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.1 p-10 -116.16 125.38 52.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.151 0.501 . . . . 1.0 110.517 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -119.23 112.49 19.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 1.0 109.35 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.428 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.46 -2.43 56.27 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.923 -0.58 . . . . 1.0 111.762 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -149.48 131.86 15.63 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.201 -0.666 . . . . 1.0 109.201 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.482 ' CB ' ' CZ2' ' A' ' 69' ' ' TRP . 17.3 p-80 -53.67 -37.68 63.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.974 0.416 . . . . 1.0 110.963 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -56.4 -7.89 0.45 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.948 -0.569 . . . . 1.0 110.537 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.6 mm-40 -82.31 -32.91 29.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 120.546 -0.461 . . . . 1.0 111.107 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.2 p90 -96.21 13.47 27.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.868 -0.333 . . . . 1.0 110.586 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.457 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 58.3 mtt 74.77 31.61 0.91 Allowed 'General case' 0 C--O 1.225 -0.211 0 O-C-N 124.481 1.113 . . . . 1.0 110.306 -179.215 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.409 ' HA3' ' HE1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.333 0.404 0 C-N-CA 120.448 -0.882 . . . . 1.0 111.877 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.7 t . . . . . 0 CA--C 1.517 -0.31 0 N-CA-C 109.585 -0.524 . . . . 1.0 109.585 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -128.38 4.58 5.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.241 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.4 p -163.38 162.66 25.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.051 0.453 . . . . 1.0 110.851 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' CYS . . . . . 0.437 ' SG ' HD11 ' A' ' 26' ' ' LEU . 19.2 p -153.66 144.85 22.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.752 -0.658 . . . . 1.0 109.744 -178.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -127.37 150.08 49.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.411 HD13 ' CE2' ' A' ' 43' ' ' TRP . 17.2 tp -95.37 125.84 40.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.461 -1.311 . . . . 1.0 107.461 177.506 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.403 ' N ' HD12 ' A' ' 81' ' ' LEU . 22.9 mt -78.43 114.75 45.64 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 120.539 -0.464 . . . . 1.0 110.812 -178.294 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo . . . . . 0 N--CA 1.49 1.274 0 C-N-CA 122.017 1.811 . . . . 1.0 111.755 179.804 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 m . . . . . 0 CA--C 1.515 -0.373 0 N-CA-C 109.967 -0.383 . . . . 1.0 109.967 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -124.31 99.51 6.25 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.898 -0.321 . . . . 1.0 111.736 -179.318 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -135.4 137.67 42.52 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 120.558 -0.457 . . . . 1.0 110.359 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.522 HG22 ' CH2' ' A' ' 131' ' ' TRP . 16.8 tt -149.18 145.48 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.604 -0.271 . . . . 1.0 111.026 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.61 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.4 mtp180 -124.39 98.83 5.92 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.051 -0.522 . . . . 1.0 111.633 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 20.5 mt -79.01 137.79 37.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.873 -0.603 . . . . 1.0 110.878 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 44.6 m-85 -116.5 135.29 53.95 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.638 -0.71 . . . . 1.0 110.711 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.527 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 1.0 OUTLIER -53.97 -67.01 0.3 Allowed 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.516 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 123' ' ' SER . 77.0 mtp85 -96.03 169.45 9.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.465 -179.222 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 . . . . . 0 C--N 1.332 -0.168 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.495 179.528 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.636 0 N-CA-C 111.013 -0.835 . . . . 1.0 111.013 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.55 147.95 13.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.356 . . . . 1.0 110.348 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.61 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 8.1 ttp -130.88 151.17 51.6 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.352 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.462 ' N ' ' HG2' ' A' ' 102' ' ' MET . 10.7 tt -146.42 141.06 20.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 177.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.41 143.96 42.66 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.677 0.751 . . . . 1.0 110.506 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.768 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 88.2 m-85 -130.52 156.49 44.72 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 114.742 -1.117 . . . . 1.0 110.678 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.2 p -143.93 32.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.731 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -171.14 -166.71 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.557 178.001 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 51.8 t0 -81.78 148.11 29.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.503 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.494 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.7 t -136.96 98.61 3.8 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.165 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.77 -23.84 64.36 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.878 0.371 . . . . 1.0 111.554 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.2 p -144.48 88.86 1.95 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.388 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.768 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.9 tp -60.65 -40.91 93.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.368 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.63 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 3.8 mp0 -43.85 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.999 -0.546 . . . . 1.0 112.072 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 112' ' ' LEU . 95.9 m-20 -94.78 -22.08 18.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.191 0.519 . . . . 1.0 110.42 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.5 mmt180 -107.93 -36.28 6.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.346 -0.843 . . . . 1.0 112.448 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.677 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.55 136.52 54.95 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 122.47 1.129 . . . . 1.0 110.812 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 15.0 mmp_? -73.43 -71.16 0.33 Allowed 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.609 -1.307 . . . . 1.0 110.669 -178.292 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.633 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.9 m-85 -34.2 147.88 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.295 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -106.98 8.19 30.31 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.758 0.313 . . . . 1.0 110.949 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -138.0 139.1 39.48 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.307 0.575 . . . . 1.0 111.118 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.73 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.7 mm -120.96 119.64 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 115.438 -0.801 . . . . 1.0 109.029 177.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -110.02 20.86 17.49 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.433 -178.505 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.2 p 170.94 150.76 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.089 0.471 . . . . 1.0 109.859 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.463 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.0 OUTLIER -162.11 157.26 23.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.659 -0.7 . . . . 1.0 110.313 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -122.57 112.95 18.62 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.349 -0.612 . . . . 1.0 109.349 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.515 HG22 HD12 ' A' ' 90' ' ' ILE . 21.4 t -100.34 105.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.048 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.882 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.6 OUTLIER -78.36 -43.04 28.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.981 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 26.0 tp10 -160.54 158.82 29.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.913 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.521 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 68.23 76.25 0.44 Allowed Glycine 0 CA--C 1.509 -0.324 0 CA-C-N 115.796 -0.638 . . . . 1.0 112.359 178.188 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.487 ' OG ' HD11 ' A' ' 145' ' ' LEU . 30.8 t -31.71 149.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.074 0.464 . . . . 1.0 111.021 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.522 ' CH2' HG22 ' A' ' 90' ' ' ILE . 33.0 m95 -124.42 169.14 12.14 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.72 -0.673 . . . . 1.0 110.835 -178.367 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 25.1 t -138.2 103.52 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.364 -0.38 . . . . 1.0 109.995 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.7 mt -77.38 141.77 39.65 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.787 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -120.54 133.82 55.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.618 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.564 ' CD ' HH21 ' A' ' 142' ' ' ARG . 48.0 tp10 -44.91 -49.95 10.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.453 -0.34 . . . . 1.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.77 171.06 10.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.411 0.624 . . . . 1.0 110.186 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.6 m -75.76 179.47 5.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.086 -0.961 . . . . 1.0 111.12 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 138' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 139' ' ' TYR . 10.3 m120 58.16 21.99 8.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.42 -1.264 . . . . 1.0 109.555 -179.088 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.445 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.4 m-85 33.82 77.67 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.21 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -148.75 44.1 1.0 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.245 0.545 . . . . 1.0 109.859 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.44 -135.15 2.1 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 111.423 -0.671 . . . . 1.0 111.423 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.628 HH12 ' CG2' ' A' ' 160' ' ' THR . 84.0 mtm180 -84.19 166.59 17.44 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.936 -0.394 . . . . 1.0 109.936 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.75 137.4 26.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.912 -0.586 . . . . 1.0 110.841 -179.385 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -128.69 145.01 51.28 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.109 -0.7 . . . . 1.0 109.109 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.554 ' C ' HD22 ' A' ' 146' ' ' LEU . 39.5 tp -94.28 122.56 36.95 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.479 0.487 . . . . 1.0 111.937 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.851 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.1 mm? -112.87 100.29 8.54 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.52 -0.764 . . . . 1.0 109.483 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 163.42 62.44 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 114.914 -1.039 . . . . 1.0 109.904 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.67 107.23 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.301 2.001 . . . . 1.0 111.532 179.104 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -175.73 -153.04 9.95 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.598 -1.001 . . . . 1.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.453 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.0 p-10 -124.8 125.82 44.63 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.054 0.454 . . . . 1.0 110.61 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.4 m-85 -117.84 129.59 55.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.953 -0.567 . . . . 1.0 109.83 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -115.66 -4.24 12.22 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.809 0.338 . . . . 1.0 110.134 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -155.54 161.62 40.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.618 0.723 . . . . 1.0 110.148 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.429 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.8 p90 -75.02 -19.2 60.17 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.654 -1.157 . . . . 1.0 112.227 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -70.05 -19.36 63.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.279 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -50.62 -49.14 57.44 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.048 -179.044 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.616 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 19.4 p90 -96.81 22.45 8.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.483 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.77 75.92 0.2 Allowed Glycine 0 CA--C 1.521 0.457 0 N-CA-C 111.326 -0.71 . . . . 1.0 111.326 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.616 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -122.0 145.52 48.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.06 0.457 . . . . 1.0 110.327 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 160' ' ' THR . . . . . 0.628 ' CG2' HH12 ' A' ' 142' ' ' ARG . 14.7 t -74.15 -15.06 61.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.144 -0.934 . . . . 1.0 110.028 177.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.451 HD22 HH22 ' A' ' 142' ' ' ARG . 14.9 p30 -166.44 -167.4 1.01 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.132 0.492 . . . . 1.0 110.308 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.73 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -109.37 -15.9 14.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.869 -0.605 . . . . 1.0 110.264 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -37.74 121.97 0.94 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.023 0.439 . . . . 1.0 111.889 -178.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.719 HG23 ' O ' ' A' ' 162' ' ' ALA . 24.7 t -125.39 158.68 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.438 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.502 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -136.23 -36.77 0.19 Allowed Glycine 0 C--N 1.334 0.431 0 N-CA-C 111.461 -0.656 . . . . 1.0 111.461 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.4 m -156.77 -170.47 3.32 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.046 -0.353 . . . . 1.0 110.046 -179.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.686 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -174.74 138.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.492 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -132.33 162.67 30.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.409 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -91.76 146.24 23.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.773 ' C ' HD12 ' A' ' 171' ' ' ILE . 42.2 t -79.22 84.62 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.186 -0.461 . . . . 1.0 111.506 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.773 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.9 mp . . . . . 0 N--CA 1.464 0.256 0 CA-C-O 121.076 0.465 . . . . 1.0 109.972 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.539 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.526 0.772 0 N-CA-C 110.371 -1.092 . . . . 1.0 110.371 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -175.86 109.03 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.636 -0.426 . . . . 1.0 110.366 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.4 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -120.06 169.21 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.952 0.406 . . . . 1.0 110.833 -179.08 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.467 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.9 m -127.89 119.72 26.18 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.203 -1.036 . . . . 1.0 108.203 177.568 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.8 mt -105.55 133.14 50.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.68 -1.145 . . . . 1.0 109.819 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.467 ' CE1' HG22 ' A' ' 5' ' ' THR . 70.8 m-85 -115.1 130.09 56.84 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.623 -0.717 . . . . 1.0 111.644 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.478 ' O ' ' O ' ' A' ' 32' ' ' ARG . 80.8 tt0 -54.9 -24.44 23.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.402 -0.817 . . . . 1.0 110.459 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -125.39 161.06 27.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.284 0.564 . . . . 1.0 110.004 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 8.3 ptp180 -65.28 -175.33 0.22 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.311 -0.859 . . . . 1.0 110.929 -177.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.36 29.31 1.69 Allowed Glycine 0 C--N 1.335 0.482 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 48.36 68.03 0.75 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.489 -0.355 . . . . 1.0 110.288 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -129.78 -158.5 0.89 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.966 0.412 . . . . 1.0 110.454 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.48 -148.66 0.77 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.861 -0.895 . . . . 1.0 110.861 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.11 148.51 45.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.767 0.318 . . . . 1.0 110.463 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -135.7 146.84 48.16 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.381 0.61 . . . . 1.0 110.256 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.521 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -142.26 142.41 32.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.107 -0.951 . . . . 1.0 109.76 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.521 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 75.1 tt0 -111.7 123.48 50.33 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.229 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.6 126.54 54.57 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.306 -0.406 . . . . 1.0 110.67 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.3 p -118.17 11.06 13.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.861 -0.609 . . . . 1.0 110.425 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.6 p -156.45 169.36 24.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.579 -178.713 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -58.94 136.09 57.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.786 -0.643 . . . . 1.0 111.104 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.39 146.53 52.03 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.676 -0.693 . . . . 1.0 110.423 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -117.52 -19.98 9.22 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.478 -0.783 . . . . 1.0 112.774 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -141.29 106.28 4.96 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.461 0.648 . . . . 1.0 109.652 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 mt -109.62 -3.38 16.9 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.171 -0.922 . . . . 1.0 110.058 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.578 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 1.4 mt-30 -52.23 -51.11 75.09 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.921 -0.581 . . . . 1.0 110.735 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.578 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.0 Cg_endo -56.04 -35.08 94.21 Favored 'Trans proline' 0 N--CA 1.487 1.127 0 C-N-CA 121.22 1.28 . . . . 1.0 112.759 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -90.79 -40.97 11.49 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.314 -0.555 . . . . 1.0 111.027 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.4 mt -126.14 127.76 46.25 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.423 -0.808 . . . . 1.0 111.284 -178.726 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 t -90.36 -14.15 33.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.191 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' GLU . 44.3 ttm180 -175.64 120.62 0.18 Allowed 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 108.89 -0.781 . . . . 1.0 108.89 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.5 t -100.22 106.36 18.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 1.0 110.258 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -101.59 -5.17 25.45 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.521 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.449 ' OG ' ' C ' ' A' ' 64' ' ' ALA . 71.9 m -155.74 156.99 35.83 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.977 0.417 . . . . 1.0 110.54 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.56 155.48 37.48 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.949 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -133.99 123.81 25.22 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.71 -0.848 . . . . 1.0 108.71 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.8 t -109.0 134.71 50.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.098 -0.704 . . . . 1.0 109.098 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -97.42 -42.83 7.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.505 -0.771 . . . . 1.0 110.51 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 m -161.45 160.46 29.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.426 -0.583 . . . . 1.0 109.426 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.51 176.26 48.73 Favored Glycine 0 C--N 1.316 -0.538 0 N-CA-C 111.085 -0.806 . . . . 1.0 111.085 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.8 m -112.4 140.96 46.69 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.884 -0.784 . . . . 1.0 108.884 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.619 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 48.2 m95 -127.42 150.44 49.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.63 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.523 ' C ' HD23 ' A' ' 45' ' ' LEU . 0.8 OUTLIER -124.37 130.05 51.8 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.179 -0.674 . . . . 1.0 109.179 178.594 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.523 HD23 ' C ' ' A' ' 44' ' ' MET . 0.5 OUTLIER -109.78 131.71 54.81 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.673 -0.862 . . . . 1.0 108.673 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -106.19 131.45 53.43 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.374 0.607 . . . . 1.0 111.279 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.671 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -56.04 -34.8 66.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.398 -0.819 . . . . 1.0 110.367 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -104.82 153.64 39.17 Favored Pre-proline 0 C--N 1.327 -0.41 0 O-C-N 121.945 -0.472 . . . . 1.0 109.918 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -55.68 150.84 42.23 Favored 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 121.363 1.375 . . . . 1.0 110.873 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.525 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.5 m-20 79.68 -122.95 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.735 0.814 . . . . 1.0 109.115 -178.82 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.525 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 15.3 m-85 -138.73 78.42 1.68 Allowed 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.017 -0.538 . . . . 1.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.0 m -152.3 163.53 39.26 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.738 -0.467 . . . . 1.0 109.738 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.04 -153.16 33.81 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 115.627 -0.715 . . . . 1.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.671 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.3 tp -77.73 144.47 37.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.343 -0.429 . . . . 1.0 109.987 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -121.41 154.17 36.87 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.691 0.282 . . . . 1.0 110.261 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.468 ' CE1' ' O ' ' A' ' 70' ' ' MET . 36.2 m-85 -127.04 129.56 48.27 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.113 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.425 ' C ' HD22 ' A' ' 58' ' ' LEU . 36.8 t80 -81.64 119.42 23.79 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.689 -0.687 . . . . 1.0 109.704 -179.356 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.425 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.3 mm? -111.36 134.42 52.96 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.9 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.4 ' O ' ' C ' ' A' ' 60' ' ' ARG . 18.3 mtm-85 -129.52 154.84 46.63 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.301 -0.863 . . . . 1.0 109.931 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.4 ' C ' ' O ' ' A' ' 59' ' ' ARG . 34.5 ptt180 -36.6 128.54 0.81 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.186 0.517 . . . . 1.0 111.696 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.18 179.92 29.88 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 111.117 -0.793 . . . . 1.0 111.117 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -115.79 124.1 49.9 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -118.92 113.5 21.12 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.131 -0.692 . . . . 1.0 109.131 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.449 ' C ' ' OG ' ' A' ' 35' ' ' SER . . . -93.99 3.42 55.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.015 0.436 . . . . 1.0 111.756 -179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 67.3 m-20 -152.14 140.68 20.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.77 -0.826 . . . . 1.0 108.77 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.472 ' C ' ' H ' ' A' ' 68' ' ' GLN . 13.9 p-80 -64.36 -40.66 96.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.974 0.416 . . . . 1.0 110.846 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.67 -8.17 0.14 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.899 -0.591 . . . . 1.0 110.248 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.472 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.5 mm-40 -80.93 -32.95 34.43 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 120.43 -0.508 . . . . 1.0 111.306 -178.284 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.41 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -96.1 13.33 27.56 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 121.05 -0.26 . . . . 1.0 110.69 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.468 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 54.9 mtt 76.26 30.01 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 124.278 0.986 . . . . 1.0 109.807 -179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.762 0 C-N-CA 119.852 -1.166 . . . . 1.0 112.181 -179.052 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.467 0.379 0 CA-C-O 121.032 0.444 . . . . 1.0 110.106 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -137.39 14.25 3.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.743 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.3 p -162.04 161.13 28.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.218 0.532 . . . . 1.0 110.795 178.461 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.2 p -155.67 146.94 22.63 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.471 -0.786 . . . . 1.0 110.662 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.603 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.7 ptm180 -126.82 150.55 49.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.467 -0.568 . . . . 1.0 109.467 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -102.41 124.92 48.85 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.911 -1.144 . . . . 1.0 107.911 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.721 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.2 mt -84.2 116.58 65.62 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.146 -178.656 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.501 1.96 0 C-N-CA 121.906 1.737 . . . . 1.0 113.229 179.676 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 CA--C 1.52 -0.203 0 N-CA-C 110.011 -0.366 . . . . 1.0 110.011 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.628 ' CE1' HD11 ' A' ' 171' ' ' ILE . 14.7 m-70 -135.04 110.78 9.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 1.0 111.162 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.8 mtp180 -143.54 135.61 26.75 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.746 -0.381 . . . . 1.0 110.068 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.5 HD12 HG22 ' A' ' 126' ' ' VAL . 17.6 tt -146.59 146.59 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.622 -0.263 . . . . 1.0 110.614 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -125.88 104.89 8.56 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.488 0.492 . . . . 1.0 111.424 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.4 mp -85.42 139.07 31.82 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.416 0.627 . . . . 1.0 111.87 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -116.44 136.25 53.15 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.798 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.51 ' OE1' ' CB ' ' A' ' 118' ' ' PHE . 78.2 mm-40 -55.72 -64.4 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.455 -0.793 . . . . 1.0 112.702 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -93.93 167.75 11.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.224 -177.77 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 . . . . . 0 CA--C 1.507 -0.697 0 CA-C-N 115.316 -0.857 . . . . 1.0 110.264 178.778 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.331 0 N-CA-C 110.175 -1.17 . . . . 1.0 110.175 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -60.83 145.99 47.94 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.607 -0.437 . . . . 1.0 109.837 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.2 ttp -131.08 145.55 52.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.324 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.1 tt -138.8 138.35 42.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -111.59 143.66 42.1 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.511 0.672 . . . . 1.0 110.66 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.812 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 77.6 m-85 -129.15 153.15 47.97 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.586 -1.188 . . . . 1.0 110.537 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 58.4 p -143.73 10.67 1.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 1.0 111.01 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.978 ' O ' ' O ' ' A' ' 108' ' ' ASP . 6.3 pt-20 -161.16 83.19 0.64 Allowed 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 118.657 -0.687 . . . . 1.0 110.016 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.978 ' O ' ' O ' ' A' ' 107' ' ' GLU . 53.4 p-10 14.99 164.83 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.021 1.119 . . . . 1.0 114.021 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -149.62 109.27 4.02 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 120.144 -1.597 . . . . 1.0 110.021 178.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 m -64.07 -31.88 73.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.651 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 t -135.41 89.68 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.246 0.546 . . . . 1.0 110.1 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.812 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.8 tp -61.4 -42.47 98.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.378 -0.828 . . . . 1.0 109.829 -178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.406 ' HG2' ' H ' ' A' ' 113' ' ' GLN . 21.5 mm100 -42.93 -8.31 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.864 -0.607 . . . . 1.0 112.028 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 112' ' ' LEU . 47.0 t0 -97.2 -22.32 16.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.118 0.485 . . . . 1.0 110.66 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 112' ' ' LEU . 5.0 mmp_? -106.09 -37.21 6.68 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.183 0.809 . . . . 1.0 113.183 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.656 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.21 136.44 54.97 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.887 0.851 . . . . 1.0 110.128 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 118' ' ' PHE . 68.6 mtt85 -72.73 -69.61 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.632 -1.293 . . . . 1.0 110.371 -177.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.596 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -33.54 146.77 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.426 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -106.69 7.33 30.45 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.729 0.299 . . . . 1.0 111.326 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -138.41 139.74 39.04 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.11 0.481 . . . . 1.0 111.098 -178.417 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.722 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.0 mm -122.9 124.92 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.493 -0.776 . . . . 1.0 109.24 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.521 ' O ' ' OG ' ' A' ' 123' ' ' SER . 40.9 m-70 -116.0 21.62 13.62 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.543 -178.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.521 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 11.4 m 171.94 153.25 0.07 Allowed 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.161 0.505 . . . . 1.0 110.558 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.471 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 2.0 pp -165.72 157.7 14.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.321 -0.854 . . . . 1.0 110.788 -178.521 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -125.51 120.53 31.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.056 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.5 HG22 HD12 ' A' ' 90' ' ' ILE . 40.7 t -103.23 104.38 16.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 109.681 -0.488 . . . . 1.0 109.681 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.934 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.25 -40.68 36.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.231 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.476 ' O ' ' O ' ' A' ' 129' ' ' GLY . 36.9 mm-40 -133.81 162.01 33.16 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.835 0.826 . . . . 1.0 110.933 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 38.11 -165.51 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 CA-C-N 113.474 -1.694 . . . . 1.0 110.91 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.478 ' OG ' ' CG2' ' A' ' 170' ' ' VAL . 32.1 p -119.73 162.41 19.09 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -134.49 160.9 36.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.069 -0.514 . . . . 1.0 109.995 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.09 139.39 50.36 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 N-CA-C 109.296 -0.631 . . . . 1.0 109.296 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.492 ' HG ' HD11 ' A' ' 146' ' ' LEU . 38.5 mt -111.11 141.73 44.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 110.184 -0.302 . . . . 1.0 110.184 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -117.41 132.84 56.5 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.26 0.35 . . . . 1.0 110.812 179.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -45.3 -36.85 4.33 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.371 -0.377 . . . . 1.0 110.725 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -137.01 175.46 9.59 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.289 0.566 . . . . 1.0 110.767 -179.34 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.1 p -81.75 172.48 13.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.496 -0.775 . . . . 1.0 110.678 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 64.5 19.19 11.72 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.833 -1.076 . . . . 1.0 109.839 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.511 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 13.2 m-85 35.8 79.36 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.919 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -148.97 38.89 0.83 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.393 0.616 . . . . 1.0 109.989 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.437 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -151.72 -140.8 3.21 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 -178.107 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -74.64 165.44 25.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.918 -0.401 . . . . 1.0 109.918 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.52 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 1.3 pt20 -146.83 135.3 21.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.955 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 144' ' ' TYR . . . . . 0.408 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 7.2 m-85 -128.01 131.62 49.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.457 ' HB2' ' HE2' ' A' ' 44' ' ' MET . 41.6 tp -87.72 126.37 34.94 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.29 0.567 . . . . 1.0 110.8 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.492 HD11 ' HG ' ' A' ' 133' ' ' LEU . 28.6 mt -115.17 108.51 16.7 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.039 -0.982 . . . . 1.0 109.694 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.603 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 3.3 mtm -88.43 163.23 37.11 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.699 -0.4 . . . . 1.0 110.247 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -52.84 124.32 15.15 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 121.608 1.538 . . . . 1.0 111.393 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 165.64 -155.27 26.49 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 110.565 -1.014 . . . . 1.0 110.565 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 68.3 t0 -127.38 130.42 49.36 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.803 0.335 . . . . 1.0 110.299 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.2 m-85 -121.36 129.26 52.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 1.0 109.952 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 152' ' ' ARG . . . . . 0.5 ' C ' ' OG ' ' A' ' 123' ' ' SER . 13.5 ptm180 -118.95 5.99 11.37 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.838 0.351 . . . . 1.0 110.199 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -163.76 160.02 22.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.463 0.649 . . . . 1.0 110.319 179.161 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.465 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.4 p90 -75.99 -19.63 58.54 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.697 -1.138 . . . . 1.0 112.613 -177.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -70.52 -17.81 62.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.843 0.354 . . . . 1.0 111.228 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -54.68 -46.81 74.12 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.388 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.698 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 14.3 p90 -97.45 20.47 11.62 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.266 -0.425 . . . . 1.0 110.738 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.82 75.32 0.23 Allowed Glycine 0 CA--C 1.521 0.439 0 N-CA-C 111.21 -0.756 . . . . 1.0 111.21 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.698 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.32 147.9 43.78 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 121.088 0.47 . . . . 1.0 110.336 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 160' ' ' THR . . . . . 0.411 ' O ' ' CG ' ' A' ' 161' ' ' ASN . 15.1 t -76.02 -20.46 57.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.894 -1.048 . . . . 1.0 110.106 177.977 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.411 ' CG ' ' O ' ' A' ' 160' ' ' THR . 71.3 m-20 -163.56 -170.65 2.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.437 . . . . 1.0 110.503 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.722 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.27 -22.33 12.39 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.993 -0.548 . . . . 1.0 110.557 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -36.98 120.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.252 0.549 . . . . 1.0 111.651 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 162' ' ' ALA . 21.3 t -124.23 162.12 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.714 -0.675 . . . . 1.0 109.794 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.529 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -141.94 -33.67 0.11 Allowed Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 14.5 p -159.67 169.35 23.91 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.656 -0.417 . . . . 1.0 110.853 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.649 ' H ' HD23 ' A' ' 167' ' ' LEU . 1.3 pt? -153.67 146.82 24.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.849 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.511 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 11.3 ptp180 -135.81 147.99 48.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.403 0.62 . . . . 1.0 110.01 178.274 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.426 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -83.12 150.69 26.12 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.144 -0.934 . . . . 1.0 108.902 178.204 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.743 ' C ' HD12 ' A' ' 171' ' ' ILE . 35.6 t -83.71 85.25 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 111.837 0.31 . . . . 1.0 111.837 -177.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.743 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp . . . . . 0 N--CA 1.468 0.426 0 N-CA-C 109.491 -0.559 . . . . 1.0 109.491 179.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.605 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.525 0.712 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -168.22 140.93 3.03 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.25 -0.278 . . . . 1.0 110.25 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.429 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -148.46 167.43 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-N 116.448 -0.342 . . . . 1.0 110.912 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.2 m -127.09 121.09 30.51 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 108.278 -1.008 . . . . 1.0 108.278 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.3 mt -105.77 133.09 51.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.871 -1.059 . . . . 1.0 110.097 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.479 ' CE1' HG22 ' A' ' 5' ' ' THR . 68.1 m-85 -115.92 126.52 54.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.361 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -53.75 -29.31 39.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.561 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -118.19 153.29 34.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.206 0.527 . . . . 1.0 110.365 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -58.38 -174.51 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.348 -0.842 . . . . 1.0 110.348 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.13 26.45 0.53 Allowed Glycine 0 N--CA 1.461 0.32 0 N-CA-C 110.798 -0.921 . . . . 1.0 110.798 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 50.29 68.98 0.67 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.395 -0.403 . . . . 1.0 110.304 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -129.35 -156.48 0.76 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.958 0.409 . . . . 1.0 110.485 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.41 -151.68 0.1 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.088 -0.805 . . . . 1.0 111.088 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.1 147.16 51.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.319 . . . . 1.0 110.689 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.8 p-80 -135.84 150.57 49.45 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.363 0.601 . . . . 1.0 110.25 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.54 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.1 t80 -145.22 142.13 29.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.22 -0.9 . . . . 1.0 110.203 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.54 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 31.0 tt0 -110.62 122.53 48.0 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.174 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . 0.453 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -110.41 127.05 54.91 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.535 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -119.41 13.6 12.71 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.392 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.8 m -158.29 172.31 18.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 1.0 110.692 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 50.0 p-10 -62.49 137.33 58.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.505 -0.771 . . . . 1.0 112.051 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.453 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -133.08 143.49 49.36 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.463 -0.789 . . . . 1.0 110.404 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.403 HG22 ' CE2' ' A' ' 51' ' ' TYR . 18.4 p -112.36 -16.11 13.0 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.527 -0.76 . . . . 1.0 111.724 -179.145 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -149.88 115.19 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 1.0 110.32 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.7 mt -117.89 0.51 11.93 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.334 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 4.3 mt-30 -52.92 -42.16 88.79 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.043 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 39.1 Cg_exo -59.26 -33.66 97.98 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.078 1.852 . . . . 1.0 111.556 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.94 -53.13 3.78 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.828 0.347 . . . . 1.0 111.012 -179.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -117.3 126.27 52.45 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.463 -178.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.6 t -93.93 -7.68 42.31 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.61 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.471 ' HG2' HD22 ' A' ' 34' ' ' ASN . 15.5 tpp180 -146.97 -60.65 0.29 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.436 -0.347 . . . . 1.0 111.923 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.3 t 64.98 75.81 0.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 O-C-N 123.269 0.356 . . . . 1.0 110.128 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' ASN . . . . . 0.471 HD22 ' HG2' ' A' ' 32' ' ' ARG . 91.1 m-20 -93.1 3.34 55.89 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 116.33 -0.396 . . . . 1.0 111.32 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.9 p -155.41 157.35 36.91 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.959 -0.386 . . . . 1.0 109.959 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.75 155.32 34.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.006 -0.543 . . . . 1.0 111.059 -178.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.478 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 24.3 mtp85 -133.81 122.02 22.65 Favored 'General case' 0 C--O 1.21 -0.98 0 N-CA-C 108.371 -0.974 . . . . 1.0 108.371 178.858 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.94 114.63 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-O 121.259 0.552 . . . . 1.0 110.05 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -74.22 -44.89 51.38 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.002 -0.999 . . . . 1.0 110.695 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.1 t -162.68 155.13 19.01 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.643 -0.503 . . . . 1.0 109.643 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.89 175.97 50.06 Favored Glycine 0 C--N 1.317 -0.513 0 N-CA-C 110.566 -1.014 . . . . 1.0 110.566 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.1 m -111.94 138.1 49.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.671 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 54.9 m95 -126.04 146.29 49.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.619 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.515 ' C ' HD23 ' A' ' 45' ' ' LEU . 18.5 tpp -121.4 130.78 53.79 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 108.684 -0.858 . . . . 1.0 108.684 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.515 HD23 ' C ' ' A' ' 44' ' ' MET . 1.3 mt -110.1 132.08 54.48 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.026 -0.731 . . . . 1.0 109.026 -179.374 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.453 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 64.2 m-85 -108.12 130.96 55.08 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.634 0.731 . . . . 1.0 110.306 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.7 -34.61 71.5 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.006 -0.997 . . . . 1.0 110.596 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.0 mt-30 -109.5 153.04 43.04 Favored Pre-proline 0 C--N 1.333 -0.119 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.339 -178.758 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.29 160.24 35.93 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.308 2.005 . . . . 1.0 112.497 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 62.13 38.21 13.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.364 -0.835 . . . . 1.0 111.106 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.453 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.9 m-85 48.99 75.24 0.15 Allowed 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.899 -1.046 . . . . 1.0 111.02 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.6 m -143.91 154.2 43.09 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.021 0.439 . . . . 1.0 110.276 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.65 -150.02 22.15 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.978 -0.63 . . . . 1.0 111.947 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.621 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.8 tp -74.92 144.5 43.25 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.043 -0.579 . . . . 1.0 110.265 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -122.42 151.52 41.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.671 0.272 . . . . 1.0 110.433 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 8.4 m-85 -128.23 126.19 40.44 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.742 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.421 ' C ' HD12 ' A' ' 58' ' ' LEU . 46.8 t80 -83.43 123.81 30.06 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.019 0.437 . . . . 1.0 109.886 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.8 mp -117.3 145.61 43.88 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.079 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtm-85 -131.98 157.11 44.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.401 -0.818 . . . . 1.0 109.767 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 59' ' ' ARG . 71.8 ttt180 -36.32 126.52 0.79 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.69 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.94 -177.89 32.78 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.348 -1.101 . . . . 1.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.478 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 68.6 m-20 -115.99 129.56 56.43 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.86 0.362 . . . . 1.0 110.209 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -123.27 112.86 18.14 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.439 -0.578 . . . . 1.0 109.439 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.6 -4.23 55.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.882 -0.599 . . . . 1.0 111.456 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 76.7 m-20 -147.72 139.33 23.87 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.18 -0.674 . . . . 1.0 109.18 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.483 ' CB ' ' CZ2' ' A' ' 69' ' ' TRP . 15.2 p-80 -59.98 -41.14 91.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.093 0.473 . . . . 1.0 110.971 -179.072 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.3 mm100 -53.84 -7.6 0.13 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.67 179.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.479 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.0 mm-40 -83.96 -35.29 24.08 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.58 -0.448 . . . . 1.0 111.506 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.81 15.45 12.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 119.286 -0.388 . . . . 1.0 110.938 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.585 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 77.0 mtp 83.77 16.35 0.26 Allowed 'General case' 0 N--CA 1.463 0.215 0 O-C-N 123.922 0.764 . . . . 1.0 109.932 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLY . . . . . 0.417 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.344 1.007 0 C-N-CA 120.068 -1.063 . . . . 1.0 110.68 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.518 -0.251 0 N-CA-C 109.317 -0.623 . . . . 1.0 109.317 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -124.41 3.14 8.42 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.192 -0.458 . . . . 1.0 111.393 -178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 p -163.47 162.54 24.73 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.062 0.458 . . . . 1.0 110.647 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.4 p -155.49 147.09 23.01 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.748 . . . . 1.0 110.105 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.45 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 2.9 ptm180 -128.02 152.44 47.93 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.796 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.1 tt -104.65 128.54 52.73 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.957 -1.127 . . . . 1.0 107.957 178.262 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.796 ' N ' HD23 ' A' ' 81' ' ' LEU . 2.3 mt -90.56 115.71 64.76 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.295 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo . . . . . 0 N--CA 1.502 2.013 0 C-N-CA 122.468 2.112 . . . . 1.0 112.97 179.03 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.231 0.111 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -132.2 120.22 21.92 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.624 -0.262 . . . . 1.0 111.179 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -146.92 134.7 21.19 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.957 -0.386 . . . . 1.0 109.957 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.496 HD12 HG22 ' A' ' 126' ' ' VAL . 18.0 tt -147.81 138.61 17.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.71 -0.223 . . . . 1.0 110.83 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -118.03 102.2 8.86 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.457 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.78 147.32 27.66 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.315 -0.402 . . . . 1.0 111.288 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -118.28 133.66 55.7 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 115.554 -0.748 . . . . 1.0 111.508 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.648 ' OE1' ' O ' ' A' ' 101' ' ' GLN . 0.5 OUTLIER -55.21 -36.49 66.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.965 -1.016 . . . . 1.0 111.291 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.612 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 36.8 mtp85 -130.98 170.05 14.99 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.419 -0.355 . . . . 1.0 110.131 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 115.837 -0.62 . . . . 1.0 110.723 179.443 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.173 0 N-CA-C 111.413 -0.675 . . . . 1.0 111.413 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.648 ' O ' ' OE1' ' A' ' 94' ' ' GLU . 67.4 tp60 -63.81 134.46 55.29 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 120.992 0.425 . . . . 1.0 111.728 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.402 ' SD ' ' C ' ' A' ' 102' ' ' MET . 0.5 OUTLIER -122.41 138.6 54.48 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.8 tt -139.99 138.57 37.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.246 -0.65 . . . . 1.0 109.246 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -112.95 147.25 37.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.203 0.525 . . . . 1.0 110.359 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.531 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 74.8 m-85 -130.56 154.45 47.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.684 -1.144 . . . . 1.0 110.285 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 18.2 p -143.28 9.3 1.64 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.547 -0.751 . . . . 1.0 111.17 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.956 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.1 pt-20 -158.51 81.08 0.82 Allowed 'General case' 0 C--O 1.216 -0.664 0 CA-C-O 118.488 -0.768 . . . . 1.0 109.884 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.956 ' O ' ' O ' ' A' ' 107' ' ' GLU . 14.0 p-10 18.46 164.99 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.514 1.149 . . . . 1.0 113.482 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 109' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 108' ' ' ASP . 98.3 m -148.43 107.58 3.89 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 120.133 -1.604 . . . . 1.0 109.896 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.442 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.0 p -66.28 -19.59 65.86 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.667 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.1 m -146.61 95.09 2.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.269 0.557 . . . . 1.0 109.974 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.531 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -62.39 -42.33 99.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.54 -0.754 . . . . 1.0 110.285 -179.201 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -45.72 -14.65 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.345 -0.388 . . . . 1.0 111.47 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 112' ' ' LEU . 81.3 m-20 -93.05 7.15 45.33 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.582 0.706 . . . . 1.0 110.481 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 112' ' ' LEU . 39.4 mmt180 -136.67 -42.78 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.508 -1.224 . . . . 1.0 113.719 -177.232 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.625 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -125.26 143.4 50.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.646 0.736 . . . . 1.0 110.667 -178.509 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 87.1 mtt180 -72.63 -73.7 0.19 Allowed 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.748 -0.781 . . . . 1.0 110.616 -177.673 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.606 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 93.2 m-85 -30.46 142.18 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 O-C-N 123.821 0.701 . . . . 1.0 110.391 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -104.3 12.44 33.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.851 0.358 . . . . 1.0 110.905 -178.467 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -142.02 138.48 31.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.536 0.684 . . . . 1.0 111.012 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.9 mm -120.43 118.09 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-N 115.067 -0.97 . . . . 1.0 109.088 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -109.9 24.09 13.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.629 -0.714 . . . . 1.0 111.497 -178.783 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.3 p 170.17 150.0 0.04 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.046 0.451 . . . . 1.0 109.825 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.403 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.8 pp -163.48 157.97 20.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.353 -0.84 . . . . 1.0 110.232 -178.219 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -125.16 120.27 30.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.529 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.496 HG22 HD12 ' A' ' 90' ' ' ILE . 43.5 t -103.83 104.21 16.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 178.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.916 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.13 -40.32 31.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.564 -0.744 . . . . 1.0 111.22 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -139.88 148.21 41.74 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.106 0.479 . . . . 1.0 110.766 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 59.11 -176.86 2.46 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.029 -0.828 . . . . 1.0 111.029 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.427 ' OG ' HG21 ' A' ' 170' ' ' VAL . 22.0 p -117.46 151.71 36.52 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -127.56 168.21 15.27 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.53 -0.759 . . . . 1.0 110.526 -178.632 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.54 144.84 25.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.516 ' HG ' HD11 ' A' ' 146' ' ' LEU . 48.3 mt -111.48 142.83 43.24 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 134' ' ' TYR . . . . . 0.419 ' CE2' ' HG2' ' A' ' 143' ' ' GLN . 39.1 m-85 -117.55 131.61 56.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.801 0.334 . . . . 1.0 110.247 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -43.82 -44.74 7.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.283 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -130.77 169.25 15.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.999 0.428 . . . . 1.0 110.001 -179.345 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 137' ' ' SER . . . . . 0.441 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 3.1 t -73.64 168.81 18.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.849 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 138' ' ' ASN . . . . . 0.441 ' N ' ' OG ' ' A' ' 137' ' ' SER . 3.2 t-20 69.32 14.82 8.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.142 -0.935 . . . . 1.0 109.911 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 41.42 78.43 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.241 -0.436 . . . . 1.0 111.997 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.562 ' C ' HD11 ' A' ' 136' ' ' LEU . 89.0 mtt-85 -147.46 35.36 0.87 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 120.926 0.393 . . . . 1.0 110.462 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -145.81 -150.14 5.14 Favored Glycine 0 N--CA 1.464 0.516 0 N-CA-C 111.763 -0.535 . . . . 1.0 111.763 -177.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.437 ' NH1' HG21 ' A' ' 160' ' ' THR . 95.2 mtt180 -69.51 165.35 21.16 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.904 -0.406 . . . . 1.0 109.904 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.585 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 42.3 mt-30 -142.8 135.01 27.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.552 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -126.86 124.75 40.32 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 108.807 -0.812 . . . . 1.0 108.807 178.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.651 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -82.2 126.63 32.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.048 -179.0 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.651 ' N ' HD23 ' A' ' 145' ' ' LEU . 23.7 mt -114.79 100.01 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.206 -0.907 . . . . 1.0 109.391 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.568 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -82.28 158.69 66.27 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.319 -179.199 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -47.36 121.76 5.8 Favored 'Trans proline' 0 N--CA 1.491 1.375 0 C-N-CA 121.632 1.555 . . . . 1.0 111.518 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.53 -154.83 24.93 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.38 -1.088 . . . . 1.0 110.38 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -129.49 129.27 44.35 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.874 0.368 . . . . 1.0 110.226 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.51 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -119.24 130.12 55.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.054 -0.521 . . . . 1.0 109.996 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -118.01 -3.8 11.1 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.843 0.354 . . . . 1.0 110.569 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -155.41 157.73 37.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.26 0.552 . . . . 1.0 109.964 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.544 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -70.3 -21.32 62.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.879 -1.055 . . . . 1.0 111.459 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.533 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.4 mt-30 -66.06 -21.3 66.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.234 0.54 . . . . 1.0 110.971 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -50.21 -47.96 54.59 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.793 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.665 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 19.1 p90 -101.9 18.45 20.57 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.16 0.505 . . . . 1.0 110.167 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.36 75.7 0.21 Allowed Glycine 0 C--N 1.331 0.269 0 N-CA-C 111.103 -0.799 . . . . 1.0 111.103 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.665 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -95.07 -171.05 2.32 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.053 0.454 . . . . 1.0 110.264 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 160' ' ' THR . . . . . 0.437 HG21 ' NH1' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -121.74 -35.94 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.342 -0.844 . . . . 1.0 111.588 -178.681 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.638 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 20.8 t-20 -146.31 -18.98 0.44 Allowed 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 111.948 0.351 . . . . 1.0 111.948 -178.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.676 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 90.66 -21.95 0.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.658 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -42.39 122.57 2.27 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.565 -0.743 . . . . 1.0 110.72 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 162' ' ' ALA . 26.0 t -123.21 133.24 69.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.275 -0.875 . . . . 1.0 110.106 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.33 -29.5 3.94 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.879 -0.489 . . . . 1.0 111.879 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 110' ' ' SER . 16.0 m -163.56 176.69 9.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.829 0.347 . . . . 1.0 110.188 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -160.2 142.6 13.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.841 -0.618 . . . . 1.0 110.52 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -131.84 157.28 44.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.498 -0.556 . . . . 1.0 109.498 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -88.85 153.11 21.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.832 -0.622 . . . . 1.0 109.411 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.427 HG21 ' OG ' ' A' ' 130' ' ' SER . 59.0 t -88.56 88.43 2.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.588 -0.445 . . . . 1.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.464 0.253 0 CA-C-N 116.235 -0.439 . . . . 1.0 110.439 179.397 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.503 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 110.429 -1.068 . . . . 1.0 110.429 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -171.38 111.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 121.034 -0.266 . . . . 1.0 110.692 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.83 169.37 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 120.928 0.394 . . . . 1.0 111.049 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.3 m -127.33 120.23 28.09 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.842 -1.17 . . . . 1.0 107.842 177.142 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -104.72 132.7 50.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.937 -1.029 . . . . 1.0 110.057 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.49 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.8 m-85 -115.15 125.87 53.95 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.394 -0.821 . . . . 1.0 111.022 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -51.63 -34.28 37.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.634 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -114.84 151.54 33.72 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.205 0.526 . . . . 1.0 110.423 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ARG . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' PHE . 12.0 ptm180 -56.42 -171.96 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.588 -179.3 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.28 23.76 0.17 Allowed Glycine 0 C--N 1.332 0.334 0 N-CA-C 110.937 -0.865 . . . . 1.0 110.937 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.451 ' N ' ' O ' ' A' ' 10' ' ' ARG . 9.6 m-85 52.54 69.59 0.67 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.568 -0.316 . . . . 1.0 110.172 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -131.69 -161.37 1.12 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.944 0.402 . . . . 1.0 110.482 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.76 -148.68 1.86 Allowed Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.951 -0.86 . . . . 1.0 110.951 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -72.48 148.1 45.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.786 0.327 . . . . 1.0 110.735 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.4 p-80 -137.04 151.98 49.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.259 0.552 . . . . 1.0 110.409 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.5 t80 -145.23 141.61 28.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.297 -0.865 . . . . 1.0 110.148 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.519 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.5 tt0 -110.42 123.04 49.14 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.895 -0.593 . . . . 1.0 110.183 -179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -111.69 126.95 55.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.288 -0.415 . . . . 1.0 110.994 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 72.0 p -118.78 11.24 12.62 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.809 -0.632 . . . . 1.0 110.566 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.5 p -156.02 168.81 26.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.477 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 50.2 p-10 -58.86 136.75 57.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.638 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' HIS . . . . . 0.419 ' CG ' HD21 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.74 142.99 49.92 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.443 -0.798 . . . . 1.0 110.533 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 24' ' ' THR . . . . . 0.504 ' O ' ' OG ' ' A' ' 78' ' ' SER . 65.4 p -115.73 -11.96 11.57 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.401 -0.818 . . . . 1.0 111.887 -178.921 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -149.95 110.96 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.274 0.559 . . . . 1.0 109.777 -179.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.419 HD21 ' CG ' ' A' ' 23' ' ' HIS . 36.4 mt -118.01 -3.55 11.12 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.428 -179.386 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.591 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -47.17 -52.67 33.15 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.488 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.591 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.5 Cg_endo -55.88 -32.45 85.21 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 C-N-CA 121.556 1.504 . . . . 1.0 112.295 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.1 m-85 -91.98 -49.5 6.19 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.362 -0.535 . . . . 1.0 110.38 -178.515 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.3 mt -121.41 126.95 50.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.44 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -94.7 -14.59 24.67 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.725 -0.671 . . . . 1.0 111.942 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -144.59 -55.84 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.381 . . . . 1.0 111.685 -178.067 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.0 t 60.75 79.5 0.24 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.096 -0.335 . . . . 1.0 110.096 -178.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -94.25 4.83 53.35 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.243 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.1 p -156.83 158.03 36.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.958 0.409 . . . . 1.0 110.372 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.68 154.45 32.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.624 . . . . 1.0 110.893 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.5 mtp85 -133.16 122.46 24.06 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 108.688 -0.856 . . . . 1.0 108.688 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.7 t -107.82 115.93 50.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.149 0.5 . . . . 1.0 109.873 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -78.44 -43.6 26.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.465 -0.788 . . . . 1.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 57.7 m -160.42 159.81 31.43 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.375 -0.602 . . . . 1.0 109.375 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.93 176.02 48.98 Favored Glycine 0 C--N 1.316 -0.565 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.9 m -112.49 138.02 49.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.091 -0.707 . . . . 1.0 109.091 178.408 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.598 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 52.4 m95 -127.94 148.82 50.52 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.288 0.566 . . . . 1.0 110.916 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.687 ' C ' HD23 ' A' ' 45' ' ' LEU . 1.9 ttt -128.06 137.04 52.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.413 -0.812 . . . . 1.0 110.021 178.289 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.687 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -113.27 139.73 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.374 -178.884 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -109.64 134.93 51.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.461 0.648 . . . . 1.0 111.711 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 15.4 pt-20 -57.86 -32.41 67.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.863 -1.062 . . . . 1.0 111.133 -178.243 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.438 ' NE2' ' HA3' ' A' ' 53' ' ' GLY . 5.2 pt20 -115.93 155.16 48.17 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.31 -0.626 . . . . 1.0 109.31 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -52.82 149.0 26.97 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 121.089 1.193 . . . . 1.0 111.87 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ASN . . . . . 0.543 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.2 m-20 75.78 -123.46 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.566 -1.197 . . . . 1.0 109.403 -178.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.543 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -150.96 73.29 1.1 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.18 0.514 . . . . 1.0 110.218 179.034 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.4 m -140.08 18.19 2.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.776 -0.647 . . . . 1.0 112.037 -177.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLY . . . . . 0.438 ' HA3' ' NE2' ' A' ' 48' ' ' GLN . . . -137.7 -164.74 10.13 Favored Glycine 0 N--CA 1.467 0.73 0 N-CA-C 111.127 -0.789 . . . . 1.0 111.127 178.803 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.571 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 38.9 tp -59.39 146.76 38.8 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.516 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 4.9 pt20 -121.97 150.09 42.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.696 0.284 . . . . 1.0 110.692 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -125.61 123.64 39.47 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.009 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -83.58 122.32 28.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.112 0.482 . . . . 1.0 110.59 -179.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.5 mp -118.36 145.25 45.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.724 -0.671 . . . . 1.0 110.144 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.635 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 64.1 mtm180 -132.11 157.71 43.51 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.468 -0.787 . . . . 1.0 110.025 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.2 ptm180 -34.32 125.23 0.49 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.035 -0.529 . . . . 1.0 110.941 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.65 -178.3 32.32 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.35 129.02 56.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.059 0.457 . . . . 1.0 110.644 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -122.22 113.2 19.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.507 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.81 -3.66 54.33 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.982 -0.554 . . . . 1.0 111.537 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.9 m-20 -147.64 137.26 22.64 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.001 -0.74 . . . . 1.0 109.001 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.445 ' CB ' ' CZ2' ' A' ' 69' ' ' TRP . 19.3 p-80 -58.93 -37.87 77.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.059 0.457 . . . . 1.0 111.035 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.73 -7.83 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.917 -0.583 . . . . 1.0 110.494 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.437 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.7 mm-40 -83.14 -33.9 26.15 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 120.675 -0.41 . . . . 1.0 111.694 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.445 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.0 p90 -94.41 15.57 17.36 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.812 -0.355 . . . . 1.0 110.813 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 53.3 mtt 75.4 27.92 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.912 0.757 . . . . 1.0 109.942 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.727 0 C-N-CA 120.135 -1.031 . . . . 1.0 111.999 -179.46 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.1 p . . . . . 0 N--CA 1.455 -0.184 0 N-CA-C 109.03 -0.73 . . . . 1.0 109.03 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -131.21 12.99 5.12 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.976 -178.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' SER . . . . . 0.504 ' OG ' ' O ' ' A' ' 24' ' ' THR . 3.5 m -160.84 159.55 29.99 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.306 0.574 . . . . 1.0 111.104 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.5 p -155.56 146.55 22.42 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.229 -0.896 . . . . 1.0 110.984 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.602 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 7.9 ptm180 -125.49 150.8 47.05 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.706 HD23 ' N ' ' A' ' 82' ' ' ILE . 3.8 tt -102.6 121.84 43.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.347 -1.353 . . . . 1.0 107.347 178.405 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.706 ' N ' HD23 ' A' ' 81' ' ' LEU . 5.3 mt -84.12 116.64 65.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 116.115 -0.493 . . . . 1.0 109.903 -178.274 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo . . . . . 0 N--CA 1.5 1.884 0 C-N-CA 121.912 1.741 . . . . 1.0 113.219 179.937 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 120.85 0.357 . . . . 1.0 110.093 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -133.48 110.11 9.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.856 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -137.99 131.69 31.14 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.839 -0.344 . . . . 1.0 110.084 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.428 HG22 ' CZ2' ' A' ' 131' ' ' TRP . 19.5 tt -147.84 148.26 16.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.84 0.352 . . . . 1.0 111.114 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -125.73 98.07 5.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.565 -0.743 . . . . 1.0 111.699 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' LEU . . . . . 0.428 HD11 HD22 ' A' ' 167' ' ' LEU . 17.4 mt -75.57 135.95 40.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 1.0 110.071 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -117.78 138.28 52.16 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.566 0.698 . . . . 1.0 111.481 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.526 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.8 OUTLIER -56.56 -65.04 0.68 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.348 -0.842 . . . . 1.0 111.79 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -96.68 173.25 7.42 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.352 0.596 . . . . 1.0 111.446 -178.674 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 114.845 -1.071 . . . . 1.0 111.697 179.767 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 N-CA-C 111.27 -0.732 . . . . 1.0 111.27 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -63.07 146.13 53.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.958 0.408 . . . . 1.0 110.798 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.497 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.1 ppp? -132.49 158.67 41.5 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.743 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.8 tt -148.85 142.07 18.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 73.4 tt0 -113.53 141.94 46.55 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.619 0.723 . . . . 1.0 110.804 -178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.783 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 83.7 m-85 -129.32 151.68 49.71 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 114.669 -1.15 . . . . 1.0 110.267 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.4 p -143.63 16.95 1.82 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.082 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.97 ' O ' ' O ' ' A' ' 108' ' ' ASP . 4.9 pt-20 -166.31 86.14 0.32 Allowed 'General case' 0 C--O 1.213 -0.867 0 CA-C-O 118.328 -0.844 . . . . 1.0 111.013 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.97 ' O ' ' O ' ' A' ' 107' ' ' GLU . 7.8 t70 16.68 154.34 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 122.231 1.015 . . . . 1.0 113.16 178.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 4.1 t -140.99 104.82 4.74 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.098 -1.001 . . . . 1.0 110.531 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.3 m -64.52 -31.72 73.05 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.246 -0.434 . . . . 1.0 110.726 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.2 t -137.09 90.14 2.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.073 -0.512 . . . . 1.0 110.099 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.783 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.2 tp -62.03 -42.86 99.62 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.736 -0.666 . . . . 1.0 110.423 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.615 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.2 mp0 -43.08 -9.7 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' A' ' 112' ' ' LEU . 84.0 m-20 -95.31 -20.83 18.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.176 0.512 . . . . 1.0 110.472 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 112' ' ' LEU . 24.9 mmt85 -109.96 -35.72 6.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.405 -0.816 . . . . 1.0 113.149 -178.346 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.676 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.71 137.24 54.83 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.765 0.793 . . . . 1.0 110.151 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.8 mtt180 -75.27 -70.66 0.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 120.914 -1.116 . . . . 1.0 110.653 -177.739 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.632 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 87.4 m-85 -33.0 145.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.307 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -104.32 10.49 35.48 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.779 0.323 . . . . 1.0 111.115 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 120' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 76.7 mt-10 -141.07 141.72 34.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.087 0.47 . . . . 1.0 111.228 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 35.4 mm -122.68 116.44 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.564 -0.744 . . . . 1.0 109.116 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.463 ' O ' ' CB ' ' A' ' 123' ' ' SER . 41.7 m-70 -109.34 31.13 5.99 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.333 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.6 t 161.59 150.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.14 0.495 . . . . 1.0 110.661 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.437 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 0.9 OUTLIER -159.63 156.05 27.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.524 -0.762 . . . . 1.0 110.529 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -126.87 107.26 9.95 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.702 -0.481 . . . . 1.0 109.702 -179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.598 HG13 ' H ' ' A' ' 149' ' ' GLY . 1.1 p -104.57 108.18 24.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 108.666 -0.864 . . . . 1.0 108.666 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.965 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.3 OUTLIER -78.4 -33.25 48.86 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.875 -1.057 . . . . 1.0 110.83 -179.04 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -148.61 164.76 33.34 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.277 0.561 . . . . 1.0 110.859 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 55.81 170.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 110.416 -1.074 . . . . 1.0 110.416 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.514 ' OG ' HD11 ' A' ' 145' ' ' LEU . 4.1 t -115.67 146.76 41.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 41.1 m95 -120.79 161.16 21.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.076 -177.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.7 t -135.84 98.56 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.622 HD13 HD11 ' A' ' 146' ' ' LEU . 5.5 mp -69.71 138.51 52.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.527 -0.306 . . . . 1.0 110.26 -179.012 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 134' ' ' TYR . . . . . 0.63 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 43.3 m-85 -118.31 133.4 55.92 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.825 -0.625 . . . . 1.0 110.802 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 135' ' ' GLU . . . . . 0.448 ' OE2' ' CD ' ' A' ' 163' ' ' ARG . 42.9 tp10 -39.94 -56.14 1.88 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.858 -0.61 . . . . 1.0 111.199 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.59 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -123.92 170.45 10.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.487 -178.494 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 22.0 p -74.7 169.16 18.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.372 -0.831 . . . . 1.0 110.744 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 59.6 t30 67.24 17.27 10.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.268 -0.878 . . . . 1.0 109.667 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 139' ' ' TYR . . . . . 0.402 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.0 m-85 38.1 80.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.873 -0.603 . . . . 1.0 112.215 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.534 ' C ' HD11 ' A' ' 136' ' ' LEU . 15.9 tpp180 -148.98 39.79 0.86 Allowed 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.815 0.34 . . . . 1.0 110.326 179.302 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.15 -136.28 2.47 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.197 -0.761 . . . . 1.0 111.197 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 142' ' ' ARG . . . . . 0.451 ' NH2' HD13 ' A' ' 54' ' ' LEU . 77.1 mtp85 -81.22 172.34 13.75 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.209 -0.293 . . . . 1.0 110.209 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -149.35 134.85 18.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.512 . . . . 1.0 111.188 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -130.05 120.0 24.0 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.924 0.392 . . . . 1.0 110.212 179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.514 HD11 ' OG ' ' A' ' 130' ' ' SER . 53.2 tp -79.97 131.24 35.78 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.614 0.721 . . . . 1.0 110.8 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.622 HD11 HD13 ' A' ' 133' ' ' LEU . 22.9 mt -117.27 105.03 11.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.023 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.602 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.7 mtm -77.52 159.56 76.89 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 109.823 -0.436 . . . . 1.0 109.823 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.45 114.81 2.08 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.207 1.938 . . . . 1.0 111.999 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 149' ' ' GLY . . . . . 0.598 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 175.21 -154.98 19.46 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 50.5 p-10 -121.23 136.11 55.02 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.061 0.458 . . . . 1.0 110.715 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.542 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 9.8 m-85 -127.29 126.76 43.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 32.1 ptt-85 -117.22 3.67 12.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.874 0.369 . . . . 1.0 110.305 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -162.37 160.72 26.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.532 0.682 . . . . 1.0 110.482 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.581 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -74.68 -17.96 60.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.869 -1.06 . . . . 1.0 111.93 -178.476 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.534 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.5 mt-30 -66.4 -20.55 66.1 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.115 -0.493 . . . . 1.0 111.214 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 156' ' ' ASP . . . . . 0.542 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 41.6 t0 -50.39 -49.47 54.39 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.067 -178.686 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.553 ' NE1' ' HB2' ' A' ' 159' ' ' ALA . 36.1 p90 -101.55 19.2 18.42 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.033 0.444 . . . . 1.0 110.323 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.0 75.14 0.24 Allowed Glycine 0 CA--C 1.518 0.253 0 CA-C-N 115.617 -0.719 . . . . 1.0 111.433 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.581 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . . . -95.4 -171.14 2.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 1.0 110.71 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.31 -40.85 2.55 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.295 -0.866 . . . . 1.0 111.955 -178.099 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.631 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.7 OUTLIER -143.01 -16.52 0.68 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.974 -177.744 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.631 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 90.32 -21.24 0.12 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.832 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 163' ' ' ARG . . . . . 0.448 ' CD ' ' OE2' ' A' ' 135' ' ' GLU . 17.4 ptp180 -44.35 123.56 3.57 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.593 0.711 . . . . 1.0 110.939 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 162' ' ' ALA . 11.8 t -119.54 156.08 22.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.159 -0.928 . . . . 1.0 110.343 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.401 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -128.11 -34.47 0.54 Allowed Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.711 -0.677 . . . . 1.0 111.512 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 4.9 p -159.17 -167.72 2.15 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.051 -0.351 . . . . 1.0 110.051 -178.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.589 HD21 HD13 ' A' ' 112' ' ' LEU . 1.8 pp -174.49 137.06 0.48 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.283 -0.417 . . . . 1.0 110.357 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.635 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 8.1 ptp180 -131.94 150.18 52.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 1.0 109.845 179.278 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -81.49 153.25 26.94 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.454 -0.793 . . . . 1.0 108.956 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 54.7 t -87.78 88.19 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.921 0.391 . . . . 1.0 111.309 -179.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.084 179.335 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.629 -0.988 . . . . 1.0 110.629 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 mttm 179.21 103.84 0.03 OUTLIER 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.676 -0.308 . . . . 1.0 110.289 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.77 170.94 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.838 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.543 HG22 ' CE1' ' A' ' 7' ' ' TYR . 31.4 m -129.53 121.24 26.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.256 -1.016 . . . . 1.0 108.256 177.112 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.3 mt -106.6 132.79 52.2 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 114.939 -1.028 . . . . 1.0 110.238 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.543 ' CE1' HG22 ' A' ' 5' ' ' THR . 50.9 m-85 -114.42 130.47 56.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.355 -0.839 . . . . 1.0 111.127 -178.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.451 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 83.8 tt0 -55.8 -24.15 34.31 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.464 -0.789 . . . . 1.0 110.403 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -126.91 153.48 45.71 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.173 0.511 . . . . 1.0 110.221 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.6 ptt85 -56.63 -173.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.51 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.69 30.24 0.32 Allowed Glycine 0 C--N 1.333 0.408 0 N-CA-C 110.994 -0.842 . . . . 1.0 110.994 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' PHE . . . . . 0.557 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 46.38 68.94 0.53 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.472 -0.364 . . . . 1.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -126.88 -157.49 0.81 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.15 -146.9 0.26 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.972 -0.851 . . . . 1.0 110.972 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.2 mmt180 -74.54 150.13 39.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.905 0.383 . . . . 1.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -136.98 145.38 44.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.334 0.588 . . . . 1.0 110.24 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 7.1 t80 -139.89 142.78 36.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.069 -0.969 . . . . 1.0 109.893 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.511 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.1 tt0 -111.24 122.99 49.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.293 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 t -109.51 126.58 53.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.17 -0.468 . . . . 1.0 109.947 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.0 m -117.38 7.32 12.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.308 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 89.5 p -153.84 167.9 28.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.816 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASP . . . . . 0.443 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 51.9 p-10 -57.72 137.46 56.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.708 -0.678 . . . . 1.0 111.493 -179.455 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.03 149.25 50.11 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.619 -0.718 . . . . 1.0 110.649 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 p -116.75 -18.9 10.14 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.799 -0.637 . . . . 1.0 112.083 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.451 ' OD1' ' CG ' ' A' ' 28' ' ' PRO . 2.3 t-20 -132.1 115.64 16.01 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.246 0.546 . . . . 1.0 110.503 -178.633 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.8 mp -115.39 -8.14 12.26 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.027 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.621 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 12.6 mt-30 -60.13 -41.41 84.41 Favored Pre-proline 0 CA--C 1.516 -0.358 0 C-N-CA 120.454 -0.498 . . . . 1.0 110.43 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.6 Cg_exo -58.61 -41.28 65.85 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.084 1.856 . . . . 1.0 112.112 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -92.96 -47.41 7.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.164 0.507 . . . . 1.0 111.103 -178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.56 128.02 54.54 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.46 -0.791 . . . . 1.0 111.307 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 t -90.88 -16.31 28.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.133 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 43.9 ttm180 -174.5 119.84 0.24 Allowed 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.955 -0.757 . . . . 1.0 108.955 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.6 t -99.2 112.08 24.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.678 0.275 . . . . 1.0 110.644 179.283 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -106.25 -3.97 20.67 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.343 -0.39 . . . . 1.0 110.229 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' SER . . . . . 0.557 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.6 t -156.16 155.64 32.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.881 0.372 . . . . 1.0 110.309 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.74 155.5 37.32 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.092 -0.503 . . . . 1.0 110.786 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.0 mtt-85 -135.15 122.76 22.11 Favored 'General case' 0 C--O 1.212 -0.872 0 N-CA-C 108.953 -0.758 . . . . 1.0 108.953 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.3 t -107.99 130.08 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.156 0.503 . . . . 1.0 109.66 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -90.07 -43.21 10.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.276 -0.875 . . . . 1.0 110.635 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.2 p -161.8 164.45 28.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.725 -0.472 . . . . 1.0 109.725 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.49 175.87 41.29 Favored Glycine 0 C--N 1.316 -0.549 0 N-CA-C 111.278 -0.729 . . . . 1.0 111.278 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 97.7 m -111.69 129.63 56.04 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.484 -0.562 . . . . 1.0 109.484 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.47 145.81 43.02 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.751 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.567 ' C ' HD12 ' A' ' 45' ' ' LEU . 17.3 tpp -122.05 130.55 53.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.282 -0.872 . . . . 1.0 109.496 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.567 HD12 ' C ' ' A' ' 44' ' ' MET . 10.1 mp -108.69 131.82 54.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.544 -0.753 . . . . 1.0 109.429 -179.598 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' TYR . . . . . 0.402 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 85.3 m-85 -111.17 132.28 54.43 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.383 0.611 . . . . 1.0 111.814 -179.254 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.625 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.7 pt-20 -57.08 -36.14 70.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.271 -0.877 . . . . 1.0 111.261 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLN . . . . . 0.421 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.9 mt-30 -107.31 153.37 41.21 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.598 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.13 159.59 46.04 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.419 2.079 . . . . 1.0 112.045 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 62.92 34.66 14.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.545 -0.752 . . . . 1.0 111.388 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.402 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.6 m-85 54.1 76.45 0.23 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.267 -0.878 . . . . 1.0 111.439 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.1 m -146.04 154.15 41.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.077 0.465 . . . . 1.0 110.442 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.64 -148.41 21.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.031 -0.604 . . . . 1.0 111.805 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.625 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.7 tp -75.61 144.11 41.94 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.358 -0.421 . . . . 1.0 110.475 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.599 HE22 ' H ' ' A' ' 145' ' ' LEU . 1.0 OUTLIER -119.31 153.57 34.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.549 0.214 . . . . 1.0 110.496 179.169 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.448 ' O ' ' SD ' ' A' ' 44' ' ' MET . 39.9 m-85 -125.93 123.63 38.99 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 120.821 0.344 . . . . 1.0 110.457 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.465 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 43.2 t80 -82.87 123.25 29.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.128 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 mp -120.27 145.06 47.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.248 -0.887 . . . . 1.0 110.5 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 44.8 mtp180 -132.13 157.52 44.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.103 -0.953 . . . . 1.0 110.433 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.1 ttp85 -37.54 126.67 1.11 Allowed 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.856 -0.611 . . . . 1.0 110.765 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 179.9 31.9 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.471 -1.051 . . . . 1.0 110.471 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.7 p-10 -114.34 127.68 55.98 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.984 0.421 . . . . 1.0 110.399 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' TYR . . . . . 0.456 ' O ' ' OG ' ' A' ' 35' ' ' SER . 41.3 m-85 -122.3 113.53 19.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.85 -0.614 . . . . 1.0 109.761 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.94 -4.04 55.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.282 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -146.79 139.21 24.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.495 ' C ' ' H ' ' A' ' 68' ' ' GLN . 16.2 p-80 -60.18 -42.17 94.43 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 120.987 0.423 . . . . 1.0 111.121 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.18 -7.47 0.09 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.498 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.495 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -82.17 -32.25 30.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.269 -178.162 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.1 p90 -97.09 16.85 18.47 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 120.807 -0.357 . . . . 1.0 110.743 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 78.6 mtp 73.34 29.84 1.6 Allowed 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.838 0.711 . . . . 1.0 109.857 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.663 0 C-N-CA 120.122 -1.037 . . . . 1.0 111.606 -179.833 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 109.021 -0.733 . . . . 1.0 109.021 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -120.76 14.38 11.69 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.353 -0.385 . . . . 1.0 110.941 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 p -164.91 163.07 21.04 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.05 0.452 . . . . 1.0 110.975 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -154.87 146.24 22.99 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.638 . . . . 1.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ARG . . . . . 0.428 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 1.6 ptm180 -127.68 148.01 50.39 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 120.637 0.256 . . . . 1.0 110.514 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -96.0 111.37 23.4 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.846 -1.168 . . . . 1.0 107.846 177.656 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mt -57.2 110.47 2.47 Favored Pre-proline 0 C--N 1.322 -0.591 0 C-N-CA 120.247 -0.581 . . . . 1.0 110.629 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo . . . . . 0 N--CA 1.49 1.316 0 C-N-CA 121.989 1.792 . . . . 1.0 111.556 -179.803 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--O 1.231 0.116 0 N-CA-C 109.663 -0.495 . . . . 1.0 109.663 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.438 ' CD2' HD11 ' A' ' 171' ' ' ILE . 2.5 m80 -131.64 115.28 15.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.115 -0.234 . . . . 1.0 110.811 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 46.3 mtm-85 -143.38 134.64 25.9 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 1.0 110.017 178.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.516 HD12 HG22 ' A' ' 126' ' ' VAL . 15.7 tt -146.58 143.81 20.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.719 0.295 . . . . 1.0 110.967 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -121.33 97.7 5.63 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.872 -0.604 . . . . 1.0 111.427 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.9 mt -76.56 138.29 40.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.559 . . . . 1.0 110.184 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -117.0 136.47 52.92 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 115.432 -0.803 . . . . 1.0 111.093 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.561 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -57.99 -70.28 0.14 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.135 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -96.17 174.51 6.86 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.29 0.567 . . . . 1.0 110.639 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 . . . . . 0 CA--C 1.517 -0.326 0 CA-C-N 115.188 -0.914 . . . . 1.0 110.58 -179.382 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.677 0 N-CA-C 111.025 -0.83 . . . . 1.0 111.025 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -58.01 151.22 18.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 1.0 110.332 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ptm -130.79 156.37 45.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.358 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.9 tt -150.56 142.53 16.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 N-CA-C 109.632 -0.507 . . . . 1.0 109.632 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -113.56 144.09 43.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.435 0.636 . . . . 1.0 110.81 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.647 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 78.0 m-85 -131.01 152.73 50.0 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 114.59 -1.186 . . . . 1.0 110.265 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 p -143.2 10.85 1.73 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.893 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.969 ' O ' ' O ' ' A' ' 108' ' ' ASP . 7.3 pt-20 -158.85 81.49 0.79 Allowed 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.697 -0.668 . . . . 1.0 109.788 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.969 ' O ' ' O ' ' A' ' 107' ' ' GLU . 54.6 p30 19.86 162.02 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 122.336 1.065 . . . . 1.0 113.236 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 5.9 t -144.0 106.09 4.36 Favored 'General case' 0 C--N 1.315 -0.9 0 O-C-N 120.483 -1.386 . . . . 1.0 109.712 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.469 ' O ' ' OG ' ' A' ' 166' ' ' SER . 15.6 m -68.58 -28.02 66.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.667 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 37.1 t -139.38 89.19 2.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.183 0.516 . . . . 1.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.647 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 1.8 mt -62.29 -42.34 99.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.411 -0.813 . . . . 1.0 110.696 -179.456 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -45.98 -8.07 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.288 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 112' ' ' LEU . 63.8 t0 -96.73 -23.9 16.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.175 0.512 . . . . 1.0 110.526 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 115' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' A' ' 112' ' ' LEU . 28.2 mmt180 -104.49 -40.47 6.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.495 -0.775 . . . . 1.0 112.966 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.692 ' CZ ' ' O ' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -123.62 138.72 54.49 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.362 0.601 . . . . 1.0 109.8 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 118' ' ' PHE . 90.6 mtt180 -71.86 -74.06 0.17 Allowed 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.594 -0.691 . . . . 1.0 111.308 -177.17 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.692 ' O ' ' CZ ' ' A' ' 116' ' ' PHE . 72.4 m-85 -29.56 146.23 0.01 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 O-C-N 123.975 0.797 . . . . 1.0 110.413 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -106.47 13.18 28.79 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.041 0.448 . . . . 1.0 111.155 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -141.73 140.53 33.14 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.912 -0.585 . . . . 1.0 111.113 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.7 mm -120.74 117.12 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 115.38 -0.827 . . . . 1.0 109.036 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 122' ' ' HIS . . . . . 0.471 ' O ' ' CB ' ' A' ' 123' ' ' SER . 38.3 m-70 -108.53 30.16 6.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.914 -0.584 . . . . 1.0 111.395 -178.357 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.471 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.5 p 162.06 152.49 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.034 0.445 . . . . 1.0 110.103 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.465 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.1 pp -163.32 157.71 20.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 1.0 110.149 -178.449 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -124.75 116.21 21.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.965 0.412 . . . . 1.0 109.999 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.516 HG22 HD12 ' A' ' 90' ' ' ILE . 24.0 t -102.78 104.82 17.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 115.818 -0.628 . . . . 1.0 109.704 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.921 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -78.33 -38.66 41.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.633 -0.712 . . . . 1.0 111.433 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -141.59 155.95 45.72 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 120.536 -0.465 . . . . 1.0 110.757 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.96 -175.03 0.14 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 110.475 -1.05 . . . . 1.0 110.475 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 130' ' ' SER . . . . . 0.526 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.9 OUTLIER -116.32 178.53 4.29 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.099 -0.704 . . . . 1.0 109.099 178.856 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.526 ' CD1' ' C ' ' A' ' 130' ' ' SER . 69.7 m95 -148.86 162.87 38.96 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.286 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 24.0 t -136.25 105.53 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.577 -0.283 . . . . 1.0 111.105 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.466 ' HG ' HD11 ' A' ' 146' ' ' LEU . 26.5 mt -77.06 143.0 39.59 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.947 -0.301 . . . . 1.0 110.266 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 134' ' ' TYR . . . . . 0.52 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 37.8 m-85 -119.29 133.24 55.84 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.68 0.276 . . . . 1.0 110.538 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -43.47 -46.86 7.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.531 -0.304 . . . . 1.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.818 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -129.9 165.91 21.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.062 0.458 . . . . 1.0 110.011 -178.355 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 137' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 4.1 t -69.71 174.78 4.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.768 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 138' ' ' ASN . . . . . 0.491 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.7 t30 63.39 18.78 11.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.046 -0.979 . . . . 1.0 109.752 -178.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 37.42 74.87 0.07 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.163 -0.471 . . . . 1.0 111.318 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.818 ' C ' HD11 ' A' ' 136' ' ' LEU . 45.3 mmt-85 -144.2 40.38 1.35 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.872 0.368 . . . . 1.0 110.09 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.423 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -151.69 -146.82 4.42 Favored Glycine 0 N--CA 1.462 0.399 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -178.477 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -70.74 171.16 10.97 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.182 -0.303 . . . . 1.0 110.182 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.465 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 5.7 pt20 -149.29 135.48 19.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.203 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -130.15 124.03 31.71 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.757 -0.461 . . . . 1.0 109.757 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.599 ' H ' HE22 ' A' ' 55' ' ' GLN . 42.7 tp -79.9 127.47 32.29 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.025 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.466 HD11 ' HG ' ' A' ' 133' ' ' LEU . 30.0 mt -117.47 107.86 14.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.42 -0.809 . . . . 1.0 110.5 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.428 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.3 OUTLIER -80.67 171.52 12.11 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.794 -179.589 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -67.45 115.7 3.84 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.225 1.95 . . . . 1.0 111.422 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 177.85 -152.26 11.61 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.621 -0.992 . . . . 1.0 110.621 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.459 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.3 p-10 -127.75 125.2 39.48 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.193 0.521 . . . . 1.0 110.603 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 12.2 m-85 -115.91 127.69 55.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.823 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -114.15 -3.07 13.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.827 0.346 . . . . 1.0 110.762 -179.262 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -157.23 164.45 37.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.732 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 154' ' ' TYR . . . . . 0.572 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.57 -20.76 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.031 -0.986 . . . . 1.0 111.978 -178.547 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -65.55 -21.82 66.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.226 -0.443 . . . . 1.0 111.041 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -48.14 -51.24 25.69 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.029 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.595 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.4 p90 -99.61 19.71 15.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.938 0.399 . . . . 1.0 110.258 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.0 74.36 0.3 Allowed Glycine 0 CA--C 1.518 0.243 0 N-CA-C 111.249 -0.741 . . . . 1.0 111.249 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.595 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.22 -171.13 2.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 1.0 110.233 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 12.6 t -123.15 -33.67 3.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.144 -0.935 . . . . 1.0 111.573 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 161' ' ' ASN . . . . . 0.629 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.8 OUTLIER -149.43 -15.89 0.28 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.757 0.313 . . . . 1.0 111.646 -178.953 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.629 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 89.49 -21.71 0.13 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.48 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -42.02 124.49 2.7 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.674 -0.694 . . . . 1.0 110.748 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 162' ' ' ALA . 24.8 t -120.73 160.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.713 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 165' ' ' GLY . . . . . 0.52 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -138.17 -35.08 0.17 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.282 -0.727 . . . . 1.0 111.282 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -162.06 172.06 16.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.01 0.433 . . . . 1.0 110.577 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 167' ' ' LEU . . . . . 0.407 ' CD2' HD11 ' A' ' 112' ' ' LEU . 0.4 OUTLIER -154.4 144.17 21.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.325 179.929 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.52 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 12.5 ptp180 -134.6 150.3 50.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.268 0.556 . . . . 1.0 110.27 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.434 ' HD2' ' N ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -76.88 147.69 36.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.146 -0.934 . . . . 1.0 108.698 177.143 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.462 HG21 ' CB ' ' A' ' 130' ' ' SER . 27.6 m -86.33 68.44 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.934 -0.575 . . . . 1.0 112.384 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.438 HD11 ' CD2' ' A' ' 88' ' ' HIS . 1.3 mp . . . . . 0 N--CA 1.467 0.424 0 CA-C-O 121.173 0.511 . . . . 1.0 109.913 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 2' ' ' GLY . . . . . 0.573 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.527 0.818 0 N-CA-C 110.435 -1.066 . . . . 1.0 110.435 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.2 tttt -172.99 106.82 0.15 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.778 -0.369 . . . . 1.0 110.141 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.452 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.91 169.16 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.346 0.594 . . . . 1.0 111.647 -179.771 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.448 HG22 ' CE1' ' A' ' 7' ' ' TYR . 62.3 m -125.07 121.73 35.15 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.35 -0.982 . . . . 1.0 108.35 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.2 134.2 50.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.176 -0.92 . . . . 1.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' TYR . . . . . 0.448 ' CE1' HG22 ' A' ' 5' ' ' THR . 86.0 m-85 -114.53 129.73 56.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.036 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 80.5 tt0 -55.62 -20.78 14.91 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.571 -0.741 . . . . 1.0 109.894 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -126.93 163.2 24.19 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.399 0.618 . . . . 1.0 111.0 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -67.82 179.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.0 111.37 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.59 25.98 7.11 Favored Glycine 0 C--N 1.335 0.518 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 51.7 66.02 1.32 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -128.51 -155.06 0.68 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.945 0.402 . . . . 1.0 110.535 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.07 -153.62 0.08 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.012 -0.835 . . . . 1.0 111.012 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -68.62 148.08 50.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.688 0.28 . . . . 1.0 110.75 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -135.46 151.32 50.29 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.418 0.628 . . . . 1.0 110.683 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.3 t80 -147.29 141.64 26.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.975 -1.011 . . . . 1.0 109.682 -179.344 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.8 tt0 -110.07 121.4 45.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.517 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.5 t -107.18 126.0 51.83 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.954 0.407 . . . . 1.0 110.891 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.5 m -118.72 13.22 13.24 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.755 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 49.8 m -158.03 169.49 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.421 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -61.03 136.41 58.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.029 -0.532 . . . . 1.0 111.457 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.34 150.22 51.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.576 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.7 p -117.05 -13.85 10.58 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.084 0.772 . . . . 1.0 113.084 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -152.01 109.43 3.59 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.127 -0.629 . . . . 1.0 111.618 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.3 mp -100.39 -1.76 35.18 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.052 -0.976 . . . . 1.0 110.336 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.611 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 28.5 mt-30 -51.85 -49.96 80.64 Favored Pre-proline 0 C--N 1.327 -0.409 0 C-N-CA 120.368 -0.533 . . . . 1.0 111.04 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 19.6 Cg_endo -57.88 -33.55 97.18 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 121.52 1.48 . . . . 1.0 112.414 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -95.39 -51.48 4.56 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 111.131 -178.09 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LEU . . . . . 0.417 ' N ' ' O ' ' A' ' 26' ' ' LEU . 11.1 mt -121.32 129.94 53.37 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.032 -0.531 . . . . 1.0 111.327 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -93.7 -9.23 38.46 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.177 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.456 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 62.3 ttp180 -179.1 119.29 0.07 Allowed 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 108.637 -0.875 . . . . 1.0 108.637 -179.089 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.6 t -100.95 113.41 26.37 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.739 0.304 . . . . 1.0 110.289 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -105.5 -5.3 20.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.888 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.1 p -156.61 158.26 36.75 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.686 -0.406 . . . . 1.0 110.863 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.6 155.05 34.02 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.347 0.594 . . . . 1.0 112.036 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.7 mtt180 -136.47 122.45 20.15 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.207 -0.906 . . . . 1.0 108.838 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' VAL . . . . . 0.499 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.2 p -110.29 123.17 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.973 0.416 . . . . 1.0 110.016 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -77.19 -45.06 27.92 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.985 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.5 p -159.8 162.87 34.88 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.74 -0.837 . . . . 1.0 108.74 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 173.1 46.01 Favored Glycine 0 C--N 1.314 -0.671 0 N-CA-C 110.253 -1.139 . . . . 1.0 110.253 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.78 142.98 43.45 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.714 -0.847 . . . . 1.0 108.714 178.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' TRP . . . . . 0.626 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 56.4 m95 -130.88 155.56 46.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.455 0.645 . . . . 1.0 111.206 -178.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' MET . . . . . 0.64 ' C ' HD23 ' A' ' 45' ' ' LEU . 9.2 ttm -130.68 131.48 44.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.036 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.64 HD23 ' C ' ' A' ' 44' ' ' MET . 0.3 OUTLIER -107.97 137.45 45.94 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.114 -0.699 . . . . 1.0 109.114 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -113.68 132.18 55.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.178 0.513 . . . . 1.0 110.925 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.645 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.3 pt-20 -60.9 -35.67 77.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.643 -0.708 . . . . 1.0 111.237 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.77 151.66 42.46 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.445 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PRO . . . . . 0.448 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 42.1 Cg_endo -64.01 158.21 48.83 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.69 2.26 . . . . 1.0 113.533 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 63.82 36.24 10.56 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.091 -0.959 . . . . 1.0 111.626 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 52.5 72.67 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.995 -1.002 . . . . 1.0 110.852 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.1 p -142.41 159.64 41.83 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 116.004 -0.544 . . . . 1.0 109.679 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.6 -149.15 24.32 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.728 -0.749 . . . . 1.0 112.261 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LEU . . . . . 0.645 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.5 tp -77.8 140.95 39.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.807 -0.697 . . . . 1.0 110.244 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . 0.491 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 13.9 pt20 -120.53 149.31 42.62 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 117.803 0.274 . . . . 1.0 110.663 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -128.49 129.88 46.71 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.622 -0.263 . . . . 1.0 111.276 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' PHE . . . . . 0.496 ' H ' ' NE2' ' A' ' 143' ' ' GLN . 67.6 t80 -82.66 123.52 29.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.506 0.67 . . . . 1.0 110.597 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -110.08 134.5 52.09 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.809 -1.087 . . . . 1.0 108.5 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 60' ' ' ARG . 37.8 ttp180 -130.03 151.68 50.31 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ARG . . . . . 0.456 ' HA ' HG13 ' A' ' 38' ' ' VAL . 78.0 ttt-85 -34.66 125.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.167 -0.47 . . . . 1.0 111.769 -178.113 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLY . . . . . 0.499 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 152.48 -175.29 31.16 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.221 -1.152 . . . . 1.0 110.221 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 49.5 p-10 -117.32 131.29 56.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.182 0.515 . . . . 1.0 111.106 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -125.27 115.14 19.91 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.102 -0.703 . . . . 1.0 109.102 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . 0.439 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -95.51 -5.06 43.72 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.764 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 90.6 m-20 -145.76 136.04 23.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.674 -0.861 . . . . 1.0 108.674 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' HIS . . . . . 0.446 ' C ' ' H ' ' A' ' 68' ' ' GLN . 20.6 p-80 -56.06 -42.64 76.95 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.074 -0.65 . . . . 1.0 110.918 -178.817 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -50.17 -8.89 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.566 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -85.05 -34.06 22.36 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.336 -0.546 . . . . 1.0 110.983 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' TRP . . . . . 0.425 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -91.91 20.5 5.66 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.32 -0.552 . . . . 1.0 110.873 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' MET . . . . . 0.425 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 43.0 mtt 81.22 12.25 0.76 Allowed 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 123.772 0.67 . . . . 1.0 109.665 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.703 0 N-CA-C 110.962 -0.855 . . . . 1.0 110.962 179.174 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 61.8 t . . . . . 0 C--O 1.232 0.143 0 N-CA-C 109.435 -0.58 . . . . 1.0 109.435 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 77' ' ' ARG . . . . . 0.448 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.3 mtm-85 -114.73 6.68 15.67 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.685 0.254 . . . . 1.0 111.685 -179.09 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -164.44 163.42 22.24 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.153 -0.619 . . . . 1.0 111.127 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 28.1 p -158.4 149.11 20.39 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.709 -0.678 . . . . 1.0 111.037 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -128.2 150.52 49.98 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.742 0.306 . . . . 1.0 110.208 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LEU . . . . . 0.717 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -101.2 124.76 47.41 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.339 -0.986 . . . . 1.0 108.339 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ILE . . . . . 0.717 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.2 mt -86.03 114.33 56.56 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 116.1 -0.5 . . . . 1.0 110.577 -178.246 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 N--CA 1.498 1.772 0 C-N-CA 121.844 1.696 . . . . 1.0 112.274 179.687 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 C--O 1.232 0.159 0 N-CA-C 109.379 -0.601 . . . . 1.0 109.379 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.572 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 1.9 m170 -129.69 107.69 9.62 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.068 0.395 . . . . 1.0 112.068 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ARG . . . . . 0.412 HH21 ' HG ' ' A' ' 127' ' ' LEU . 57.3 ttp180 -138.21 127.61 24.69 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.468 -0.567 . . . . 1.0 109.468 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' ILE . . . . . 0.514 HG22 ' CH2' ' A' ' 131' ' ' TRP . 18.3 tt -145.85 145.11 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-O 120.758 0.313 . . . . 1.0 111.286 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 91' ' ' ARG . . . . . 0.667 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.2 mtp180 -122.69 98.69 6.03 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.773 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.27 139.06 36.83 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.522 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' TYR . . . . . 0.401 ' CE1' ' HG3' ' A' ' 102' ' ' MET . 78.7 m-85 -115.0 134.05 55.52 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.121 -0.491 . . . . 1.0 111.141 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' GLU . . . . . 0.567 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 20.1 pt-20 -54.33 -41.3 68.88 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.496 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 95' ' ' ARG . . . . . 0.49 ' O ' ' OG ' ' A' ' 123' ' ' SER . 9.9 mtt-85 -121.88 168.24 12.1 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.011 -0.541 . . . . 1.0 110.846 -178.063 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 121.448 0.642 . . . . 1.0 111.034 179.294 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.808 0 N-CA-C 111.403 -0.679 . . . . 1.0 111.403 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 101' ' ' GLN . . . . . 0.567 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 67.4 tp60 -65.01 146.78 54.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.071 0.463 . . . . 1.0 110.987 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 102' ' ' MET . . . . . 0.667 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 10.8 ttp -129.92 152.53 49.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.49 -0.777 . . . . 1.0 110.439 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' ILE . . . . . 0.465 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.7 tt -145.01 137.54 21.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 108.459 -0.941 . . . . 1.0 108.459 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 78.0 tt0 -111.78 141.75 45.0 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.449 0.642 . . . . 1.0 110.737 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 105' ' ' PHE . . . . . 0.619 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 92.2 m-85 -127.44 148.88 50.3 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 114.868 -1.06 . . . . 1.0 110.533 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.6 p -139.81 16.67 2.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.704 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 107' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.0 OUTLIER -149.41 -174.95 4.81 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.526 -0.47 . . . . 1.0 110.293 178.961 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 108' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 52.0 p-10 -74.33 141.49 45.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.335 -0.393 . . . . 1.0 111.165 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.07 116.52 16.44 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.324 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 110' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' A' ' 166' ' ' SER . 83.5 p -90.97 -21.64 21.21 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.921 0.391 . . . . 1.0 110.911 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 38.5 m -146.4 94.54 2.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.406 0.622 . . . . 1.0 109.867 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 112' ' ' LEU . . . . . 0.619 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -60.59 -39.54 88.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.821 -1.081 . . . . 1.0 110.673 -178.467 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 113' ' ' GLN . . . . . 0.614 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 3.3 mp0 -49.09 -12.75 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.736 0.643 . . . . 1.0 112.736 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 114' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' A' ' 114' ' ' ASP . 61.6 t0 -88.87 -10.42 48.03 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.909 -0.774 . . . . 1.0 108.909 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -118.85 -39.52 2.95 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 114.22 1.193 . . . . 1.0 114.22 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 116' ' ' PHE . . . . . 0.623 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.08 135.2 53.4 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 122.523 1.154 . . . . 1.0 112.467 -178.898 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.13 -68.27 0.37 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.111 -0.949 . . . . 1.0 111.022 -177.788 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 118' ' ' PHE . . . . . 0.59 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 65.9 m-85 -42.91 141.62 1.07 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.406 -0.816 . . . . 1.0 109.61 -179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -101.15 5.7 42.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.928 0.394 . . . . 1.0 110.269 -179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -134.46 139.13 45.29 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.461 0.648 . . . . 1.0 111.344 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 121' ' ' ILE . . . . . 0.715 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 45.9 mm -119.5 123.39 71.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.853 -1.067 . . . . 1.0 108.895 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -115.08 15.72 17.11 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 111.9 0.333 . . . . 1.0 111.9 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 123' ' ' SER . . . . . 0.49 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 5.7 p 176.93 149.97 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.212 -0.662 . . . . 1.0 109.212 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 124' ' ' LEU . . . . . 0.46 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.1 pp -159.97 156.54 27.3 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.569 -0.742 . . . . 1.0 109.856 -178.16 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -124.21 109.31 13.25 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.194 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 126' ' ' VAL . . . . . 0.43 HG22 HD12 ' A' ' 90' ' ' ILE . 4.1 t -96.4 103.95 15.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 109.171 -0.677 . . . . 1.0 109.171 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 127' ' ' LEU . . . . . 0.826 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -74.03 -36.87 64.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.562 179.578 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 128' ' ' GLU . . . . . 0.409 ' O ' ' O ' ' A' ' 129' ' ' GLY . 21.4 pt-20 -151.55 168.58 24.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.734 -0.666 . . . . 1.0 111.007 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 129' ' ' GLY . . . . . 0.409 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 54.41 167.79 0.03 OUTLIER Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.746 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 70.5 m -113.99 145.06 42.08 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.15 -0.685 . . . . 1.0 109.15 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 131' ' ' TRP . . . . . 0.514 ' CH2' HG22 ' A' ' 90' ' ' ILE . 30.3 m95 -120.52 162.24 19.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.474 -0.785 . . . . 1.0 110.64 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 16.3 t -137.03 93.04 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.749 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 133' ' ' LEU . . . . . 0.447 ' CD1' HD11 ' A' ' 146' ' ' LEU . 26.5 mt -66.09 146.15 55.0 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.21 -178.136 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 134' ' ' TYR . . . . . 0.583 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 60.1 m-85 -121.54 136.43 54.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.793 0.33 . . . . 1.0 111.071 178.779 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -48.39 -40.69 26.59 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.33 -0.395 . . . . 1.0 111.037 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 136' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -133.13 176.57 8.39 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.273 0.559 . . . . 1.0 111.069 -179.46 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.8 p -80.62 169.7 17.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.488 -0.778 . . . . 1.0 111.628 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 42.9 t30 64.98 15.51 10.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.888 -1.051 . . . . 1.0 110.614 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 42.26 79.32 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 1.0 112.536 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 140' ' ' ARG . . . . . 0.415 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 94.1 mtt-85 -147.39 35.45 0.88 Allowed 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.768 0.318 . . . . 1.0 110.934 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 141' ' ' GLY . . . . . 0.418 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -147.11 -142.52 3.71 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.559 -0.616 . . . . 1.0 111.559 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -77.1 167.1 22.37 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 110.119 -0.326 . . . . 1.0 110.119 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 143' ' ' GLN . . . . . 0.496 ' NE2' ' H ' ' A' ' 57' ' ' PHE . 1.8 pt20 -143.31 138.1 29.28 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.126 -178.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -128.99 123.05 31.39 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.065 0.393 . . . . 1.0 110.304 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 145' ' ' LEU . . . . . 0.591 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.7 OUTLIER -78.74 126.97 31.44 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.435 -0.802 . . . . 1.0 112.345 -178.795 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 146' ' ' LEU . . . . . 0.591 ' N ' HD23 ' A' ' 145' ' ' LEU . 40.0 mt -116.69 102.45 9.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.418 178.456 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 147' ' ' MET . . . . . 0.624 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -79.36 160.69 69.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 109.121 -0.696 . . . . 1.0 109.121 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -56.97 113.83 1.65 Allowed 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.888 1.726 . . . . 1.0 111.209 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.92 -153.91 15.95 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 110.539 -1.024 . . . . 1.0 110.539 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 150' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 53.6 p-10 -123.42 141.72 51.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.999 0.428 . . . . 1.0 110.614 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 151' ' ' TYR . . . . . 0.531 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.5 m-85 -133.17 129.32 37.65 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.952 -0.567 . . . . 1.0 109.837 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -118.27 -0.58 11.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.649 0.262 . . . . 1.0 110.331 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -157.42 158.58 36.12 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.279 0.561 . . . . 1.0 110.36 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -74.16 -22.48 59.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 1.0 112.651 -177.552 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -68.32 -18.84 64.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.48 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 156' ' ' ASP . . . . . 0.531 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 58.6 t0 -54.17 -47.82 71.58 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.976 -0.289 . . . . 1.0 110.691 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 157' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 24.3 p90 -92.44 21.17 5.51 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 178.206 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.1 74.32 0.31 Allowed Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.931 -0.868 . . . . 1.0 110.931 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 159' ' ' ALA . . . . . 0.643 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.45 153.66 33.74 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.922 0.868 . . . . 1.0 111.677 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -81.8 -17.24 48.25 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.749 -1.569 . . . . 1.0 110.141 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -168.51 -171.38 1.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.821 -0.352 . . . . 1.0 110.351 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 162' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.58 -4.95 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 1.0 110.896 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -50.93 116.15 1.85 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 120.631 0.253 . . . . 1.0 111.317 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 164' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 162' ' ' ALA . 77.6 t -128.35 133.69 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.495 -0.557 . . . . 1.0 109.495 178.067 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -110.38 -28.41 4.07 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.017 -0.433 . . . . 1.0 112.017 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 166' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 110' ' ' SER . 32.0 m -158.67 -168.56 2.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.731 0.3 . . . . 1.0 110.367 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.33 139.58 0.61 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.464 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 168' ' ' ARG . . . . . 0.583 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 8.8 ptp180 -129.68 154.2 47.38 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.675 -0.491 . . . . 1.0 109.675 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 169' ' ' ARG . . . . . 0.601 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -88.46 145.08 25.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.933 -0.766 . . . . 1.0 108.933 178.742 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 170' ' ' VAL . . . . . 0.501 ' C ' HD12 ' A' ' 171' ' ' ILE . 57.3 t -77.26 84.74 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.069 0.462 . . . . 1.0 110.862 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 171' ' ' ILE . . . . . 0.501 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.3 mp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.739 -0.664 . . . . 1.0 109.577 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.35 -0.611 . . . . 1.0 109.35 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.522 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -90.37 170.76 35.95 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.507 -1.037 . . . . 1.0 110.507 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -167.66 107.63 0.57 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.008 -0.277 . . . . 1.0 110.604 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.456 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.23 168.83 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.229 0.538 . . . . 1.0 111.206 -179.128 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' CE1' ' A' ' 7' ' ' TYR . 33.0 m -126.24 121.18 31.97 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 107.806 -1.183 . . . . 1.0 107.806 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.1 mt -106.59 134.72 49.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.008 -0.996 . . . . 1.0 110.117 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.476 ' CE1' HG22 ' A' ' 5' ' ' THR . 72.8 m-85 -117.18 128.25 54.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.631 -0.713 . . . . 1.0 111.461 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -53.05 -31.87 43.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.701 -0.681 . . . . 1.0 110.301 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -115.97 160.41 20.3 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.246 0.546 . . . . 1.0 110.774 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -63.76 -173.78 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 1.0 111.047 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.89 26.69 0.48 Allowed Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.765 -0.934 . . . . 1.0 110.765 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 50.29 70.41 0.51 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.147 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -133.69 -159.63 0.98 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.915 0.388 . . . . 1.0 110.378 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.16 -150.77 0.97 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.754 -0.938 . . . . 1.0 110.754 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -68.44 145.56 53.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.738 0.304 . . . . 1.0 110.822 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -135.59 151.84 50.67 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 121.288 0.566 . . . . 1.0 110.457 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -146.24 141.38 27.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.252 -0.886 . . . . 1.0 109.995 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 73.4 tt0 -110.22 121.24 44.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.317 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.57 127.05 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.973 0.416 . . . . 1.0 111.043 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 p -117.15 10.08 13.75 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.731 -0.668 . . . . 1.0 110.589 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.0 t -155.38 166.21 34.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.969 -0.56 . . . . 1.0 110.488 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -57.74 140.18 52.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.659 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.51 146.86 48.54 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.743 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.1 p -114.87 -14.98 11.89 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.787 -0.642 . . . . 1.0 112.17 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.2 t-20 -150.87 111.08 4.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.216 0.532 . . . . 1.0 110.352 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 24.7 mt -111.43 0.96 16.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.304 -0.862 . . . . 1.0 110.278 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.607 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 20.4 mt-30 -51.65 -48.22 87.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.009 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 24.5 Cg_endo -57.22 -33.08 95.34 Favored 'Trans proline' 0 N--CA 1.491 1.37 0 C-N-CA 121.322 1.348 . . . . 1.0 112.239 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.17 -50.61 5.2 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.427 -0.509 . . . . 1.0 110.952 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.25 128.81 54.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.872 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.7 t -95.55 -8.2 35.77 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.842 -0.617 . . . . 1.0 111.631 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.669 ' O ' ' O ' ' A' ' 75' ' ' SER . 88.6 mtm180 -145.0 -70.82 0.27 Allowed 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 112.427 0.528 . . . . 1.0 112.427 -177.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.5 t 76.69 71.68 0.07 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 122.757 0.423 . . . . 1.0 110.325 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -92.76 3.0 56.44 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.609 -0.269 . . . . 1.0 111.378 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.2 p -156.64 158.78 37.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.937 0.399 . . . . 1.0 110.181 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -156.25 153.84 29.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 1.0 111.495 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.5 mtp180 -131.94 122.45 25.63 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 108.771 -0.825 . . . . 1.0 108.771 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.69 110.83 33.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.254 0.55 . . . . 1.0 109.96 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -73.77 -43.5 58.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.296 -0.865 . . . . 1.0 110.851 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 95.7 p -160.83 160.34 30.99 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.761 -0.829 . . . . 1.0 108.761 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.05 168.29 42.8 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 111.158 -0.777 . . . . 1.0 111.158 179.255 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 171' ' ' ILE . 64.7 m -110.28 124.55 51.85 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.919 -0.771 . . . . 1.0 108.919 178.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 57.0 m95 -115.28 152.42 32.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.613 0.721 . . . . 1.0 111.616 -178.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.518 ' C ' HD12 ' A' ' 45' ' ' LEU . 2.1 ttt -127.72 133.92 49.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.713 -1.131 . . . . 1.0 109.021 177.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.518 HD12 ' C ' ' A' ' 44' ' ' MET . 8.9 mp -109.96 134.83 51.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.882 -1.054 . . . . 1.0 110.092 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -111.49 133.45 53.77 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.343 0.592 . . . . 1.0 111.378 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.569 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.3 pt-20 -60.4 -37.11 79.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.306 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -105.37 153.8 39.44 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.123 -0.944 . . . . 1.0 111.256 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.93 152.51 80.25 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.776 2.318 . . . . 1.0 112.818 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.448 ' C ' ' CD1' ' A' ' 51' ' ' TYR . 7.0 m120 60.71 32.54 20.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.237 -0.892 . . . . 1.0 110.955 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.448 ' CD1' ' C ' ' A' ' 50' ' ' ASN . 0.1 OUTLIER 46.6 65.07 1.29 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.171 -0.922 . . . . 1.0 109.65 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.7 m -123.2 17.44 9.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.435 -0.802 . . . . 1.0 111.798 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -142.05 -154.28 6.13 Favored Glycine 0 N--CA 1.46 0.289 0 C-N-CA 120.687 -0.768 . . . . 1.0 111.572 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.569 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.0 tp -63.48 152.44 38.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.338 -0.431 . . . . 1.0 109.88 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.422 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 9.7 pt20 -123.72 149.28 45.73 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.646 0.26 . . . . 1.0 111.298 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -125.99 122.9 37.22 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.16 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.411 ' C ' HD12 ' A' ' 58' ' ' LEU . 76.8 t80 -82.9 122.38 28.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.084 0.469 . . . . 1.0 110.139 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.411 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.6 mp -118.21 147.46 43.36 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.712 -0.676 . . . . 1.0 109.521 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' ' C ' ' A' ' 60' ' ' ARG . 5.3 ptm180 -136.39 161.82 34.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.723 -0.671 . . . . 1.0 109.897 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.404 ' C ' ' O ' ' A' ' 59' ' ' ARG . 62.3 ttp180 -38.49 124.73 1.32 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.766 0.317 . . . . 1.0 110.75 -178.068 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.6 -178.65 32.08 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.702 -0.959 . . . . 1.0 110.702 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -115.84 131.52 56.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.888 0.375 . . . . 1.0 110.491 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -125.09 113.4 17.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.419 -0.585 . . . . 1.0 109.419 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.48 -1.87 55.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.275 -0.421 . . . . 1.0 111.914 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -148.11 146.76 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.189 -1.041 . . . . 1.0 108.189 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.481 ' C ' ' H ' ' A' ' 68' ' ' GLN . 8.7 p-80 -66.13 -45.61 80.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.047 0.451 . . . . 1.0 111.296 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.1 mm100 -49.5 -9.86 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.741 -0.663 . . . . 1.0 110.93 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.481 ' H ' ' C ' ' A' ' 66' ' ' HIS . 14.7 mm-40 -81.46 -37.38 28.09 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 120.481 -0.487 . . . . 1.0 111.007 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.453 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -87.89 18.82 3.88 Favored 'General case' 0 CA--C 1.509 -0.62 0 C-N-CA 120.323 -0.551 . . . . 1.0 111.244 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.55 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 63.8 mtp 80.52 19.16 0.54 Allowed 'General case' 0 CA--C 1.521 -0.138 0 O-C-N 123.929 0.768 . . . . 1.0 109.833 -178.505 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.24 94.32 0.06 OUTLIER Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.431 -1.067 . . . . 1.0 110.431 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.2 mt -69.4 -33.43 73.01 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.642 -0.503 . . . . 1.0 109.642 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.41 ' O ' ' O ' ' A' ' 74' ' ' ASP . 22.8 t -135.59 126.13 26.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.304 -0.407 . . . . 1.0 110.492 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.525 ' O ' ' CB ' ' A' ' 75' ' ' SER . 52.9 p-10 -55.57 -172.48 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.872 -0.788 . . . . 1.0 108.872 178.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.669 ' O ' ' O ' ' A' ' 32' ' ' ARG . 4.5 t 99.25 -122.91 0.0 OUTLIER 'General case' 0 C--O 1.21 -1.014 0 CA-C-O 118.834 -0.603 . . . . 1.0 109.546 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.606 HG23 ' C ' ' A' ' 75' ' ' SER . 4.6 t 89.65 102.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 108.491 -0.929 . . . . 1.0 108.491 -178.275 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -117.76 7.89 12.59 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 121.015 -0.274 . . . . 1.0 110.978 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.6 p -162.49 162.82 27.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 1.0 110.543 178.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 14.2 p -156.27 147.57 22.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.486 -0.779 . . . . 1.0 110.426 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -126.93 151.44 48.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.912 0.386 . . . . 1.0 110.241 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.522 HD21 ' H ' ' A' ' 2' ' ' GLY . 17.8 tp -97.45 126.86 42.97 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 177.725 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 28.7 mt -83.34 113.8 48.87 Favored Pre-proline 0 CA--C 1.538 0.5 0 C-N-CA 120.807 -0.357 . . . . 1.0 111.337 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.449 ' C ' ' CG ' ' A' ' 84' ' ' HIS . 35.7 Cg_endo -79.14 175.41 10.9 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 121.811 1.674 . . . . 1.0 111.581 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.449 ' CG ' ' C ' ' A' ' 83' ' ' PRO . 30.5 m-70 80.92 131.14 0.05 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 114.415 1.265 . . . . 1.0 114.415 176.416 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 97.0 p -160.65 -1.51 0.06 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.993 -0.549 . . . . 1.0 111.527 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.476 ' O ' ' CE1' ' A' ' 88' ' ' HIS . . . -65.38 -115.38 0.01 OUTLIER Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.49 -1.044 . . . . 1.0 110.49 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m -77.58 156.12 31.07 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.923 -0.399 . . . . 1.0 109.923 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.652 ' NE2' HD11 ' A' ' 171' ' ' ILE . 12.6 m80 -128.19 97.15 4.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 121.104 -0.238 . . . . 1.0 111.258 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -131.59 136.41 47.76 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 120.631 -0.428 . . . . 1.0 110.647 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.514 HG22 ' CZ2' ' A' ' 131' ' ' TRP . 18.4 tt -148.21 141.53 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-O 120.895 0.379 . . . . 1.0 111.486 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -119.28 98.06 5.97 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.838 -0.619 . . . . 1.0 111.511 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.9 139.82 40.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.203 0.525 . . . . 1.0 110.171 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.587 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 55.1 m-85 -119.84 137.44 53.99 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.984 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.527 ' OE2' ' CD1' ' A' ' 118' ' ' PHE . 1.8 tm-20 -56.32 -66.52 0.42 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.722 -0.672 . . . . 1.0 111.446 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.441 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.2 mtp85 -97.25 167.83 10.79 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.272 0.558 . . . . 1.0 111.715 -177.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -59.52 166.55 2.35 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.229 -0.896 . . . . 1.0 111.558 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.553 ' O ' ' CG ' ' A' ' 98' ' ' TYR . 97.1 m-20 51.29 43.99 29.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.676 -1.147 . . . . 1.0 111.243 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.553 ' CG ' ' O ' ' A' ' 97' ' ' ASP . 12.5 p90 45.08 42.57 6.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.189 -0.914 . . . . 1.0 110.837 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.2 tpt85 -106.69 155.39 19.73 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.956 -0.566 . . . . 1.0 110.381 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 86.52 -165.34 36.96 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.891 -0.883 . . . . 1.0 110.891 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -62.97 144.12 57.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 1.0 110.81 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.587 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 6.3 ttp -131.67 148.08 52.56 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 116.345 -0.389 . . . . 1.0 111.013 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.52 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.4 tt -141.14 140.93 31.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.484 0 N-CA-C 109.464 -0.569 . . . . 1.0 109.464 177.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.68 137.73 50.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.639 0.733 . . . . 1.0 110.895 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.55 155.68 37.15 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.422 -1.263 . . . . 1.0 110.222 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 16.7 p -143.07 25.98 1.71 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.018 -0.537 . . . . 1.0 110.344 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -166.5 -166.86 0.91 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.842 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -76.09 141.99 41.85 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.111 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.9 m -130.6 92.56 3.27 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.079 -0.51 . . . . 1.0 109.998 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.51 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.3 m -68.48 -32.12 71.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.7 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -133.55 93.32 3.12 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.325 0.583 . . . . 1.0 110.479 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.485 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.7 tp -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.232 -0.895 . . . . 1.0 110.363 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -47.73 -9.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.697 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.485 ' H ' ' C ' ' A' ' 112' ' ' LEU . 92.5 m-20 -96.4 -25.31 15.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.035 0.445 . . . . 1.0 110.407 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -108.28 -39.96 5.31 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.662 -0.699 . . . . 1.0 111.704 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.52 ' CD1' HG21 ' A' ' 103' ' ' ILE . 3.6 t80 -124.81 122.07 36.39 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.629 -0.508 . . . . 1.0 109.629 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 78.2 mtt-85 -60.69 -56.07 25.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.641 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.527 ' CD1' ' OE2' ' A' ' 94' ' ' GLU . 95.2 m-85 -46.73 140.04 4.85 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.945 -0.571 . . . . 1.0 109.668 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -101.5 15.02 30.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.028 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 120' ' ' GLU . 3.4 pm0 -151.51 148.66 28.31 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.833 -179.067 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.627 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.1 mm -123.71 125.58 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 109.547 -0.538 . . . . 1.0 109.547 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.557 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 16.3 m-70 -108.89 20.81 18.03 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.078 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.487 ' H ' HG22 ' A' ' 121' ' ' ILE . 2.4 p 167.44 150.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.515 -0.55 . . . . 1.0 109.515 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.457 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.1 pp -161.27 156.79 24.57 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.709 -0.678 . . . . 1.0 110.285 -178.731 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -122.1 112.03 17.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.499 -0.556 . . . . 1.0 109.499 178.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.483 HG22 HD12 ' A' ' 90' ' ' ILE . 23.9 t -98.58 105.81 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.207 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.838 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.73 -45.0 22.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.957 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 29.5 tp10 -156.67 157.52 35.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.61 -0.436 . . . . 1.0 111.477 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.432 ' O ' ' O ' ' A' ' 130' ' ' SER . . . 64.2 78.72 0.19 Allowed Glycine 0 C--N 1.333 0.378 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.365 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.432 ' O ' ' O ' ' A' ' 129' ' ' GLY . 4.2 m -32.28 151.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.915 0.388 . . . . 1.0 111.599 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.514 ' CZ2' HG22 ' A' ' 90' ' ' ILE . 46.9 m95 -122.03 168.21 12.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.387 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.36 99.5 2.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.526 -0.306 . . . . 1.0 110.428 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.436 HD23 ' HB3' ' A' ' 167' ' ' LEU . 14.9 mt -74.77 141.35 44.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.612 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -120.45 134.66 55.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.366 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -48.81 -45.03 39.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.289 -0.414 . . . . 1.0 110.79 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.775 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -126.96 169.04 13.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.261 0.553 . . . . 1.0 110.478 -178.475 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 18.4 m -75.48 176.32 7.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.303 -0.862 . . . . 1.0 111.303 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 58.21 21.37 8.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.507 -1.224 . . . . 1.0 109.801 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 35.48 78.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.606 -0.724 . . . . 1.0 111.735 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.775 ' C ' HD11 ' A' ' 136' ' ' LEU . 63.2 ttt180 -149.01 45.6 1.0 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.0 0.429 . . . . 1.0 110.298 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.512 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -157.42 -137.51 2.31 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.764 -0.935 . . . . 1.0 110.764 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.449 HH12 ' CG2' ' A' ' 160' ' ' THR . 82.1 mtp180 -78.85 163.26 25.46 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.958 -0.297 . . . . 1.0 110.224 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.55 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.36 136.17 29.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.987 -0.551 . . . . 1.0 110.877 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -128.23 140.4 51.92 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.134 -0.691 . . . . 1.0 109.134 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.52 ' C ' HD22 ' A' ' 146' ' ' LEU . 39.0 tp -96.01 126.38 41.21 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.725 0.774 . . . . 1.0 111.425 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.828 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.1 mm? -112.68 99.5 7.98 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 114.39 -1.277 . . . . 1.0 109.733 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.516 ' SD ' HD21 ' A' ' 145' ' ' LEU . 2.0 mpp? -73.94 167.68 33.17 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -62.91 116.43 3.55 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 121.56 1.506 . . . . 1.0 111.163 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 178.08 -158.01 22.58 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 111.021 -0.832 . . . . 1.0 111.021 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -124.78 115.69 21.11 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.081 0.467 . . . . 1.0 110.537 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 37.1 m-85 -107.1 129.47 54.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 1.0 109.878 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -113.15 -4.53 13.78 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.709 0.29 . . . . 1.0 110.604 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -156.38 166.35 33.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.365 0.603 . . . . 1.0 110.337 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -78.09 -20.1 52.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.016 -0.993 . . . . 1.0 112.249 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -69.6 -20.02 63.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.786 0.327 . . . . 1.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -50.42 -47.73 56.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.993 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.599 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 24.5 p90 -97.65 22.22 9.32 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.091 0.472 . . . . 1.0 110.35 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.19 74.32 0.31 Allowed Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.599 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -121.28 149.1 43.41 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.292 0.568 . . . . 1.0 110.593 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 160' ' ' THR . . . . . 0.449 ' CG2' HH12 ' A' ' 142' ' ' ARG . 11.6 t -77.37 -10.73 59.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.75 -1.114 . . . . 1.0 110.198 178.023 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -172.0 -165.49 0.36 Allowed 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.131 179.533 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.826 ' O ' HG23 ' A' ' 164' ' ' VAL . . . -111.7 -19.71 12.37 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.894 -0.593 . . . . 1.0 110.924 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.425 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.6 mtt180 -31.9 116.77 0.19 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.299 0.374 . . . . 1.0 111.881 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.826 HG23 ' O ' ' A' ' 162' ' ' ALA . 62.4 t -126.28 137.15 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-N 116.13 -0.486 . . . . 1.0 110.575 178.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -116.47 -34.57 1.29 Allowed Glycine 0 N--CA 1.465 0.581 0 N-CA-C 111.597 -0.601 . . . . 1.0 111.597 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.51 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -159.47 172.22 18.28 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 120.534 -0.466 . . . . 1.0 110.88 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.436 ' HB3' HD23 ' A' ' 133' ' ' LEU . 0.5 OUTLIER -157.32 142.48 17.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.539 -179.209 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -130.66 166.36 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.351 -0.981 . . . . 1.0 108.351 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -104.01 139.45 39.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.448 -0.796 . . . . 1.0 109.607 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.566 ' C ' HD12 ' A' ' 171' ' ' ILE . 19.0 t -81.48 121.22 34.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.849 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.652 HD11 ' NE2' ' A' ' 88' ' ' HIS . 1.6 mp -122.27 129.62 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.189 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -96.46 -17.65 20.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.798 -0.637 . . . . 1.0 110.797 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -61.84 -46.05 91.15 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.862 0.363 . . . . 1.0 110.737 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 174' ' ' SER . . . . . 0.416 ' H ' HG22 ' A' ' 171' ' ' ILE . 44.8 t . . . . . 0 C--O 1.219 -0.514 0 CA-C-O 117.997 -1.002 . . . . 1.0 110.558 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.43 ' O ' ' OE1' ' A' ' 1' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.182 -0.673 . . . . 1.0 109.182 . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.533 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -87.34 178.04 47.55 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.459 -1.057 . . . . 1.0 110.459 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -172.81 103.31 0.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.124 -0.324 . . . . 1.0 110.124 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.38 166.78 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.089 0.471 . . . . 1.0 111.175 -178.418 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.452 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.5 m -124.62 121.19 34.03 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.86 -1.163 . . . . 1.0 107.86 177.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -106.19 133.72 50.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.874 -1.057 . . . . 1.0 110.244 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.452 ' CE1' HG22 ' A' ' 5' ' ' THR . 61.6 m-85 -115.97 125.94 53.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.351 -0.84 . . . . 1.0 111.219 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -53.75 -29.7 41.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.507 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -117.84 153.85 32.81 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.292 0.567 . . . . 1.0 110.675 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.422 ' C ' ' N ' ' A' ' 12' ' ' PHE . 16.3 ptt-85 -59.58 -176.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.827 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 46.1 22.53 0.9 Allowed Glycine 0 C--N 1.33 0.211 0 N-CA-C 110.552 -1.019 . . . . 1.0 110.552 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.537 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 10.6 m-85 54.14 67.85 0.94 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -129.92 -155.66 0.71 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.029 0.443 . . . . 1.0 110.468 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.14 -152.46 0.11 Allowed Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.984 -0.846 . . . . 1.0 110.984 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -68.98 146.53 52.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.787 0.327 . . . . 1.0 110.69 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.8 p80 -135.55 145.19 46.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.265 0.555 . . . . 1.0 110.444 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.4 t80 -140.26 142.26 35.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.31 -0.859 . . . . 1.0 110.213 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.545 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 41.1 tt0 -110.63 122.08 46.89 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.101 -0.499 . . . . 1.0 110.154 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.435 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -109.75 126.24 53.53 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.998 0.428 . . . . 1.0 110.67 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -117.32 13.96 14.65 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.624 -0.716 . . . . 1.0 110.357 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.9 m -157.91 167.87 28.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.582 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -58.67 140.13 55.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.577 -0.738 . . . . 1.0 111.549 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.435 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.16 145.31 45.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.868 -0.605 . . . . 1.0 110.821 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.2 p -112.64 -11.92 13.48 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.976 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -149.73 117.92 6.4 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.514 0.673 . . . . 1.0 110.172 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.8 mp -113.13 -2.44 14.15 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.096 -0.956 . . . . 1.0 110.246 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.629 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.1 mt-30 -58.15 -41.77 91.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.301 -178.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.9 Cg_exo -58.79 -37.7 92.53 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.175 1.917 . . . . 1.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -97.22 -51.21 4.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.919 0.39 . . . . 1.0 111.327 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' A' ' 26' ' ' LEU . 6.9 mt -118.55 127.95 54.1 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.735 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -94.75 -8.39 37.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.937 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -147.5 -58.04 0.25 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.955 0.354 . . . . 1.0 111.955 -178.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t 63.08 74.83 0.42 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.755 0.312 . . . . 1.0 110.174 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.513 ' OD1' ' CE1' ' A' ' 66' ' ' HIS . 1.3 t30 -90.56 3.89 52.77 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.197 -0.456 . . . . 1.0 111.284 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.537 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -157.25 155.9 31.58 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 1.0 110.051 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 155.11 35.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 1.0 111.431 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -132.74 121.41 23.01 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 108.602 -0.888 . . . . 1.0 108.602 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.3 t -108.53 117.77 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 O-C-N 123.629 0.581 . . . . 1.0 109.905 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -78.84 -43.81 24.35 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.995 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.1 m -161.2 159.38 28.76 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.316 -0.624 . . . . 1.0 109.316 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.21 174.45 50.39 Favored Glycine 0 C--N 1.316 -0.55 0 N-CA-C 110.96 -0.856 . . . . 1.0 110.96 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 98.3 m -112.85 131.0 55.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.949 -0.76 . . . . 1.0 108.949 178.523 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.526 ' CE2' HD13 ' A' ' 81' ' ' LEU . 54.6 m95 -119.26 143.21 47.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.29 0.567 . . . . 1.0 111.438 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.544 ' C ' HD12 ' A' ' 45' ' ' LEU . 1.2 tpt -113.93 129.0 56.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.393 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.544 HD12 ' C ' ' A' ' 44' ' ' MET . 9.6 mp -108.15 127.57 53.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.995 -0.743 . . . . 1.0 108.995 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -106.85 133.41 51.55 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.687 0.756 . . . . 1.0 111.215 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.4 pt-20 -62.66 -36.7 83.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.828 -1.078 . . . . 1.0 110.296 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -106.59 151.68 40.49 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.244 -0.889 . . . . 1.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.1 154.14 74.91 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.575 2.183 . . . . 1.0 112.737 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 3.5 m120 59.47 34.8 22.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.967 -1.015 . . . . 1.0 110.721 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 23' ' ' HIS . 1.5 m-85 42.93 66.22 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.34 -0.846 . . . . 1.0 110.26 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.4 m -123.58 17.31 9.61 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.283 -0.871 . . . . 1.0 111.298 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.29 -155.12 6.37 Favored Glycine 0 N--CA 1.462 0.375 0 C-N-CA 120.693 -0.765 . . . . 1.0 111.553 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.58 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.4 tp -65.82 151.99 45.41 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.459 -0.371 . . . . 1.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -123.15 152.03 41.54 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.742 0.306 . . . . 1.0 111.624 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.402 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 27.1 m-85 -127.76 125.82 40.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.011 -0.541 . . . . 1.0 111.302 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -82.6 121.92 27.44 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.336 -0.393 . . . . 1.0 109.962 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.34 146.08 47.65 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.11 0.481 . . . . 1.0 110.311 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.467 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 42.5 mtp180 -134.69 160.42 38.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.494 -0.775 . . . . 1.0 110.283 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' A' ' 59' ' ' ARG . 9.7 ptm180 -34.02 127.32 0.42 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.829 -0.623 . . . . 1.0 111.272 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.63 -179.53 30.66 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.084 -0.807 . . . . 1.0 111.084 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.9 p-10 -116.36 125.19 51.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.161 0.505 . . . . 1.0 110.432 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -118.93 113.49 21.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.769 -0.651 . . . . 1.0 109.426 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.422 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.44 -3.31 53.35 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.669 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.422 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -148.36 141.63 25.13 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.628 -0.879 . . . . 1.0 108.628 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 34' ' ' ASN . 22.8 p-80 -62.52 -41.41 98.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.174 0.512 . . . . 1.0 110.689 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -51.98 -8.94 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.46 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -81.31 -34.93 31.6 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.116 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -92.78 15.65 14.15 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 120.813 -0.355 . . . . 1.0 110.515 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.442 ' C ' ' H ' ' A' ' 72' ' ' LEU . 58.7 mtt 72.55 30.55 1.88 Allowed 'General case' 0 CA--C 1.514 -0.433 0 O-C-N 124.31 1.006 . . . . 1.0 109.633 -178.923 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.692 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -67.75 41.4 0.25 Allowed Glycine 0 CA--C 1.525 0.668 0 CA-C-O 118.786 -1.008 . . . . 1.0 112.834 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.481 ' C ' ' O ' ' A' ' 71' ' ' GLY . 18.3 mt -6.53 -52.61 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.808 0.843 . . . . 1.0 111.741 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.692 ' N ' ' O ' ' A' ' 71' ' ' GLY . 37.1 m -110.78 120.98 44.18 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.356 -0.838 . . . . 1.0 108.98 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 40.9 p-10 -67.17 40.51 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.933 0.397 . . . . 1.0 111.188 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.53 ' H ' ' C ' ' A' ' 73' ' ' SER . 30.0 t -115.23 126.45 54.56 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.951 -0.568 . . . . 1.0 109.712 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -149.06 112.64 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -122.91 4.78 9.38 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.703 0.287 . . . . 1.0 110.723 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.7 t -166.12 163.42 18.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.199 0.523 . . . . 1.0 110.822 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -155.89 146.63 22.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.433 -0.803 . . . . 1.0 109.945 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.519 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 3.1 ptm180 -126.99 151.51 48.48 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.533 HD21 ' H ' ' A' ' 2' ' ' GLY . 27.5 tp -100.05 135.22 41.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.457 -0.942 . . . . 1.0 108.457 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 81' ' ' LEU . 3.5 mt -96.7 111.32 56.94 Favored Pre-proline 0 CA--C 1.543 0.711 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -50.71 149.57 13.8 Favored 'Trans proline' 0 N--CA 1.5 1.9 0 C-N-CA 121.901 1.734 . . . . 1.0 113.295 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 61.4 m170 -68.91 179.55 1.79 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.144 -0.934 . . . . 1.0 110.311 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.1 m -164.73 153.54 12.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.354 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.437 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . -100.78 -69.59 0.88 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 109.725 -1.35 . . . . 1.0 109.725 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' SER . . . . . 0.405 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 3.8 m -80.62 144.34 32.43 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.744 -0.465 . . . . 1.0 109.744 178.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.437 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 4.8 m170 -128.06 104.17 7.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.835 -0.166 . . . . 1.0 111.379 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -136.29 139.64 42.8 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.191 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.404 HD12 HG22 ' A' ' 126' ' ' VAL . 19.5 tt -149.6 141.81 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.735 0.302 . . . . 1.0 111.389 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -119.05 98.39 6.15 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.922 -0.581 . . . . 1.0 112.237 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.45 HD11 HD22 ' A' ' 167' ' ' LEU . 22.1 mt -79.88 142.91 34.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.538 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.555 ' CG ' ' HB3' ' A' ' 98' ' ' TYR . 25.2 m-85 -125.41 137.68 54.01 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.822 -0.626 . . . . 1.0 111.923 -179.179 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.505 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 2.3 tm-20 -56.08 -58.14 9.18 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.791 -0.64 . . . . 1.0 111.584 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -107.36 172.34 6.88 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.173 0.511 . . . . 1.0 111.128 -178.657 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.502 ' O ' ' N ' ' A' ' 98' ' ' TYR . 97.4 mt-10 -60.77 164.72 4.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.432 -0.804 . . . . 1.0 110.735 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.535 ' C ' ' CD1' ' A' ' 98' ' ' TYR . 24.3 m-20 39.89 23.68 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.09 -0.505 . . . . 1.0 111.369 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.612 ' O ' ' CD2' ' A' ' 98' ' ' TYR . 37.9 p90 35.4 75.91 0.05 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.769 0.795 . . . . 1.0 111.885 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.464 ' NH1' ' CB ' ' A' ' 97' ' ' ASP . 46.8 mtt85 -111.99 11.13 20.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.584 -0.734 . . . . 1.0 111.385 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -136.54 -141.38 4.28 Favored Glycine 0 N--CA 1.467 0.709 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -69.04 141.55 54.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.006 0.431 . . . . 1.0 110.872 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.515 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 154.36 48.22 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.661 -0.7 . . . . 1.0 111.058 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.6 tt -145.77 139.42 21.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 N-CA-C 109.33 -0.619 . . . . 1.0 109.33 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -113.39 144.73 42.29 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.681 0.753 . . . . 1.0 111.141 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.785 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 85.2 m-85 -130.61 156.3 45.1 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 114.692 -1.14 . . . . 1.0 110.934 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.0 p -143.66 31.57 1.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.477 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -170.85 -169.08 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.628 -0.429 . . . . 1.0 110.796 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.429 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 55.2 p-10 -82.68 149.29 27.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.353 179.268 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.63 101.1 4.38 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.334 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.444 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.1 p -69.14 -19.47 64.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.635 -0.426 . . . . 1.0 111.072 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 33.7 t -149.83 91.07 1.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.155 0.502 . . . . 1.0 109.989 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.785 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 13.6 tp -58.97 -39.68 82.47 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.32 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.654 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 14.4 mp0 -42.75 -14.01 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.971 0.36 . . . . 1.0 111.971 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.519 ' N ' ' O ' ' A' ' 112' ' ' LEU . 55.3 t0 -93.1 0.45 57.26 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.582 0.706 . . . . 1.0 110.401 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 112' ' ' LEU . 36.8 mmt180 -132.16 -39.13 1.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 1.0 113.266 -177.438 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.684 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.91 134.7 55.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 122.19 0.995 . . . . 1.0 110.96 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 118' ' ' PHE . 38.1 mmt180 -71.47 -69.97 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.064 -1.022 . . . . 1.0 110.433 -177.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.625 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -37.29 146.84 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.968 -0.56 . . . . 1.0 110.347 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 p-10 -105.24 11.19 33.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.767 0.318 . . . . 1.0 110.962 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -140.49 141.38 35.37 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.267 0.556 . . . . 1.0 111.173 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.651 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 39.1 mm -121.09 126.91 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-N 115.251 -0.886 . . . . 1.0 109.498 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.453 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.0 m-70 -118.56 26.74 9.37 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.141 -0.481 . . . . 1.0 111.69 -178.417 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' C ' ' A' ' 152' ' ' ARG . 3.8 m 165.21 151.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.449 . . . . 1.0 110.276 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.446 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.4 pp -163.79 158.12 19.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.681 -0.69 . . . . 1.0 110.78 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -123.14 117.97 26.59 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.505 -0.554 . . . . 1.0 109.505 178.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.404 HG22 HD12 ' A' ' 90' ' ' ILE . 23.2 t -101.92 105.01 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-N 116.235 -0.438 . . . . 1.0 110.109 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.874 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.83 -44.2 28.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.82 -0.627 . . . . 1.0 111.177 179.39 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.405 ' CG ' ' O ' ' A' ' 87' ' ' SER . 33.0 tp10 -157.72 150.25 22.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 120.695 -0.402 . . . . 1.0 111.277 -178.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.554 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.6 79.7 0.29 Allowed Glycine 0 C--O 1.229 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.0 112.322 177.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.424 ' O ' ' O ' ' A' ' 129' ' ' GLY . 45.3 t -31.6 148.38 0.01 OUTLIER 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.345 0.593 . . . . 1.0 111.242 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.554 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 41.7 m95 -124.3 163.07 22.44 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.096 -0.956 . . . . 1.0 111.289 -177.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.9 t -132.46 138.34 52.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 N-CA-C 108.754 -0.832 . . . . 1.0 108.754 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.502 ' HG ' HD11 ' A' ' 146' ' ' LEU . 43.4 mt -110.39 141.74 43.04 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.679 -0.489 . . . . 1.0 109.679 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -117.74 135.3 54.13 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.209 0.318 . . . . 1.0 110.896 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -48.35 -42.08 30.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.769 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -131.33 167.27 19.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.208 0.528 . . . . 1.0 110.181 -178.684 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.4 m -72.94 175.22 6.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.858 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 62.0 16.69 8.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.856 -1.065 . . . . 1.0 109.796 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 39.24 77.86 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.533 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.769 ' C ' HD11 ' A' ' 136' ' ' LEU . 73.5 mtp180 -146.57 41.18 1.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.723 0.297 . . . . 1.0 110.48 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.475 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -153.5 -142.8 3.54 Favored Glycine 0 N--CA 1.463 0.485 0 N-CA-C 111.31 -0.716 . . . . 1.0 111.31 -178.647 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -73.5 166.76 22.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 120.786 -0.366 . . . . 1.0 110.154 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -146.27 136.44 23.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.009 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -128.1 130.3 47.95 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 109.557 -0.535 . . . . 1.0 109.557 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 45.4 tp -85.51 126.95 34.25 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.342 0.591 . . . . 1.0 111.219 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.502 HD11 ' HG ' ' A' ' 133' ' ' LEU . 25.6 mt -114.75 106.5 14.28 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.156 -0.929 . . . . 1.0 109.819 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.59 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.7 160.81 65.97 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.291 -179.669 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.75 112.62 1.26 Allowed 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.302 2.001 . . . . 1.0 110.868 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.99 -152.55 12.35 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 110.538 -1.025 . . . . 1.0 110.538 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 49.0 p-10 -125.94 134.72 51.44 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.09 0.472 . . . . 1.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -124.83 124.62 42.48 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.924 -0.58 . . . . 1.0 109.638 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 152' ' ' ARG . . . . . 0.53 ' C ' ' OG ' ' A' ' 123' ' ' SER . 95.2 mtt-85 -112.97 1.8 15.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.626 0.25 . . . . 1.0 110.369 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.9 ptm180 -160.83 162.61 32.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.556 178.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.528 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -75.76 -24.06 56.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.138 -0.937 . . . . 1.0 112.314 -178.233 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.528 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 3.4 mt-30 -63.89 -20.18 65.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.282 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 156' ' ' ASP . . . . . 0.479 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 52.6 t0 -51.22 -49.31 61.32 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.365 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.726 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 26.1 p90 -96.58 19.05 12.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.026 0.441 . . . . 1.0 110.505 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.07 73.95 0.34 Allowed Glycine 0 CA--C 1.52 0.389 0 N-CA-C 111.227 -0.749 . . . . 1.0 111.227 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.726 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -116.45 141.92 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 1.0 111.337 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 160' ' ' THR . . . . . 0.457 HG23 ' N ' ' A' ' 161' ' ' ASN . 15.0 t -66.79 -38.68 87.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.5 -1.227 . . . . 1.0 110.238 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.457 ' N ' HG23 ' A' ' 160' ' ' THR . 78.3 m-20 -145.21 -172.51 3.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.019 0.438 . . . . 1.0 110.265 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.651 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.83 -2.06 18.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.822 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -53.99 118.13 3.76 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.001 0.429 . . . . 1.0 111.239 -178.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.87 131.23 72.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.463 -0.79 . . . . 1.0 109.49 178.08 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.31 -28.57 4.3 Favored Glycine 0 N--CA 1.465 0.605 0 N-CA-C 111.659 -0.576 . . . . 1.0 111.659 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 110' ' ' SER . 7.9 m -159.47 -172.3 3.66 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.938 -0.393 . . . . 1.0 109.938 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.659 HD21 HD13 ' A' ' 112' ' ' LEU . 2.3 pp -173.57 145.06 1.17 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.433 -0.507 . . . . 1.0 111.56 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.467 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 6.2 ptm180 -133.84 164.76 26.54 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.067 0.46 . . . . 1.0 110.285 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.443 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -98.33 147.03 25.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.581 -0.896 . . . . 1.0 108.581 178.45 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.782 ' C ' HD12 ' A' ' 171' ' ' ILE . 61.2 t -79.55 84.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.157 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.782 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.8 mp -133.87 118.03 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 N-CA-C 109.66 -0.496 . . . . 1.0 109.66 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -68.98 -36.19 77.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.58 -0.736 . . . . 1.0 110.473 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -59.54 -79.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.04 -0.527 . . . . 1.0 110.8 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.98 -1.01 . . . . 1.0 110.788 179.594 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.539 ' O ' ' NE2' ' A' ' 84' ' ' HIS . 69.6 tp60 . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.14 -0.689 . . . . 1.0 109.14 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.04 175.27 44.76 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.523 -1.031 . . . . 1.0 110.523 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -171.88 106.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.996 -0.282 . . . . 1.0 110.724 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.73 170.36 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 121.129 0.49 . . . . 1.0 111.059 -178.786 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.5 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.6 m -127.41 120.41 28.38 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.226 -1.027 . . . . 1.0 108.226 177.202 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.4 mt -105.87 133.43 50.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.938 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.5 ' CE1' HG22 ' A' ' 5' ' ' THR . 58.2 m-85 -114.83 129.39 56.69 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.505 -0.771 . . . . 1.0 111.026 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.535 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.5 tt0 -56.03 -23.16 31.45 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.308 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -123.73 155.22 38.25 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.045 0.45 . . . . 1.0 110.465 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.84 -174.48 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.558 -0.746 . . . . 1.0 110.501 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.46 28.64 0.61 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 110.964 -0.855 . . . . 1.0 110.964 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.546 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 6.1 m-85 49.71 67.24 0.93 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.921 -0.4 . . . . 1.0 109.921 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -128.15 -160.83 1.05 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.953 0.406 . . . . 1.0 110.58 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.92 -151.74 0.73 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.535 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.1 mtm180 -69.3 148.95 49.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.705 0.288 . . . . 1.0 110.782 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.9 p80 -135.42 145.71 47.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.308 0.575 . . . . 1.0 110.284 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.9 t80 -140.89 141.95 34.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.127 -0.942 . . . . 1.0 109.809 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.558 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 66.7 tt0 -110.53 120.89 43.88 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.124 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -107.92 126.52 52.78 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.033 0.444 . . . . 1.0 110.747 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -117.58 12.23 14.01 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.55 -0.75 . . . . 1.0 110.385 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 35.5 p -156.94 167.09 31.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.191 0.52 . . . . 1.0 110.425 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 53.8 p-10 -58.1 142.56 46.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.555 -0.748 . . . . 1.0 111.684 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.75 147.17 44.48 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.904 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -115.45 -16.29 11.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.614 -0.721 . . . . 1.0 111.908 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -150.18 109.96 4.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 1.0 109.989 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 20.9 mt -108.43 2.36 22.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.388 -0.823 . . . . 1.0 110.41 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.615 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 10.3 mt-30 -56.89 -41.06 89.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.141 -0.482 . . . . 1.0 110.698 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.3 Cg_exo -59.34 -36.47 94.3 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.058 1.838 . . . . 1.0 111.999 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -94.21 -47.51 6.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.843 0.354 . . . . 1.0 111.24 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -120.09 127.79 52.86 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.338 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -91.26 -6.8 52.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.854 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.557 HH21 HD22 ' A' ' 34' ' ' ASN . 3.4 mmm-85 177.59 120.58 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t -102.09 111.35 23.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 1.0 110.498 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.557 HD22 HH21 ' A' ' 32' ' ' ARG . 89.6 m-20 -106.01 -3.72 21.34 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.247 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.546 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 3.8 t -157.11 155.64 31.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.801 0.334 . . . . 1.0 110.371 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.04 155.25 36.52 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.205 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -132.7 122.04 24.01 Favored 'General case' 0 C--O 1.217 -0.641 0 N-CA-C 108.794 -0.817 . . . . 1.0 108.794 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.67 116.32 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.29 0.567 . . . . 1.0 109.799 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.29 -43.97 31.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.335 -0.848 . . . . 1.0 110.979 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.4 t -161.89 152.79 17.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 109.226 -0.657 . . . . 1.0 109.226 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.82 176.38 49.33 Favored Glycine 0 C--N 1.317 -0.501 0 N-CA-C 111.07 -0.812 . . . . 1.0 111.07 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.1 m -113.02 139.68 48.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 178.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.446 ' CE2' HD13 ' A' ' 81' ' ' LEU . 55.3 m95 -128.18 138.88 52.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.225 0.536 . . . . 1.0 111.268 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.536 ' C ' HD12 ' A' ' 45' ' ' LEU . 1.0 OUTLIER -107.43 127.19 53.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.357 -0.838 . . . . 1.0 109.282 178.501 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.536 HD12 ' C ' ' A' ' 44' ' ' MET . 10.2 mp -108.65 129.84 55.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.536 -0.756 . . . . 1.0 109.297 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -112.23 131.65 55.37 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.631 0.729 . . . . 1.0 111.094 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.642 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.9 pt-20 -58.88 -35.42 72.96 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.067 -0.97 . . . . 1.0 111.072 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -108.57 154.22 41.72 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.689 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -66.05 159.12 50.9 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.843 2.362 . . . . 1.0 112.866 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 62.94 43.3 6.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.917 179.805 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 44.2 72.74 0.18 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.836 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.0 m -141.2 157.77 44.8 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.743 -0.466 . . . . 1.0 109.743 -178.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.36 -146.84 21.16 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.78 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.642 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.7 tp -79.72 144.02 34.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.971 -0.614 . . . . 1.0 110.282 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -120.73 150.7 40.57 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.45 0.167 . . . . 1.0 110.872 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -126.73 126.26 43.18 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-O 120.83 0.348 . . . . 1.0 111.318 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -82.94 122.74 28.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.955 -0.566 . . . . 1.0 109.495 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.6 mp -121.19 146.21 47.02 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.066 -0.516 . . . . 1.0 110.189 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.55 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 36.9 mtp180 -134.09 159.19 41.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.277 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.6 ptm180 -35.09 125.67 0.57 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.804 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 -178.64 32.92 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.683 -0.967 . . . . 1.0 110.683 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 42.2 p-10 -116.4 126.99 54.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.02 0.438 . . . . 1.0 110.608 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -121.43 113.94 20.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.815 -0.63 . . . . 1.0 109.43 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.5 -2.83 53.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.637 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -147.95 140.77 24.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.835 -0.802 . . . . 1.0 108.835 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.474 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.8 p-80 -62.13 -42.03 98.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.06 0.457 . . . . 1.0 110.799 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -52.16 -8.63 0.08 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.606 -0.725 . . . . 1.0 110.665 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.474 ' H ' ' C ' ' A' ' 66' ' ' HIS . 16.9 mm-40 -83.58 -36.06 24.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.552 -0.459 . . . . 1.0 111.363 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.458 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.85 15.93 10.35 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.709 -0.396 . . . . 1.0 111.265 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.495 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 44.3 mtt 84.0 14.22 0.3 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 124.175 0.922 . . . . 1.0 109.574 -178.254 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.8 100.17 0.16 Allowed Glycine 0 C--N 1.339 0.711 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 37.4 mt -79.68 -33.41 41.13 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.659 -0.497 . . . . 1.0 109.659 177.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.7 t -135.67 121.62 19.96 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.471 -0.566 . . . . 1.0 109.471 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.515 ' OD2' ' NH1' ' A' ' 32' ' ' ARG . 56.4 p-10 -64.18 -153.07 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.85 -0.796 . . . . 1.0 108.85 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.509 ' O ' ' C ' ' A' ' 76' ' ' VAL . 1.3 t 91.65 -54.89 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 122.376 0.27 . . . . 1.0 111.034 179.381 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.509 ' C ' ' O ' ' A' ' 75' ' ' SER . 3.6 t 22.74 93.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 O-C-N 123.895 0.747 . . . . 1.0 110.785 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -104.45 4.95 33.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.648 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 p -163.17 162.56 25.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.263 0.554 . . . . 1.0 110.61 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.0 p -157.46 148.45 21.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 1.0 110.058 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.599 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 4.3 ptm180 -127.93 149.86 50.14 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.75 0.31 . . . . 1.0 110.397 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.446 HD13 ' CE2' ' A' ' 43' ' ' TRP . 20.9 tp -99.08 129.11 45.33 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.253 -1.017 . . . . 1.0 108.253 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.416 ' N ' HD12 ' A' ' 81' ' ' LEU . 4.5 mt -90.89 114.17 60.52 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 109.893 -0.41 . . . . 1.0 109.893 -179.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.21 149.67 21.49 Favored 'Trans proline' 0 N--CA 1.5 1.911 0 C-N-CA 121.97 1.78 . . . . 1.0 113.215 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.539 ' NE2' ' O ' ' A' ' 1' ' ' GLN . 40.8 m170 -68.76 -179.76 1.53 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.306 -0.861 . . . . 1.0 110.295 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m -160.48 151.42 18.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.948 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -91.71 -79.73 1.4 Allowed Glycine 0 CA--C 1.52 0.385 0 N-CA-C 109.805 -1.318 . . . . 1.0 109.805 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m -85.65 159.06 19.92 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 109.664 -0.495 . . . . 1.0 109.664 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -129.78 119.26 23.12 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.706 -0.225 . . . . 1.0 110.96 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -147.86 133.78 19.13 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.522 HD12 HG22 ' A' ' 126' ' ' VAL . 17.6 tt -147.51 146.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.962 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -125.71 103.69 7.96 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 123.389 0.43 . . . . 1.0 111.511 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.21 149.1 25.33 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.157 0.503 . . . . 1.0 111.839 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.439 ' CD2' ' CD1' ' A' ' 98' ' ' TYR . 77.3 m-85 -125.44 138.92 54.02 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.823 -0.626 . . . . 1.0 112.396 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.469 ' N ' ' CD ' ' A' ' 94' ' ' GLU . 1.2 mm-40 -57.19 -55.25 37.22 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.803 -0.635 . . . . 1.0 111.2 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.424 ' O ' ' OG ' ' A' ' 123' ' ' SER . 75.7 mtp180 -109.68 173.24 6.42 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.238 -178.106 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -63.91 164.38 10.39 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.61 -0.723 . . . . 1.0 111.27 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.411 ' C ' ' CG ' ' A' ' 98' ' ' TYR . 92.0 m-20 43.43 25.21 0.07 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.614 -0.721 . . . . 1.0 111.256 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.604 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.1 OUTLIER 63.4 28.53 15.53 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.692 -0.685 . . . . 1.0 111.16 178.946 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -72.49 21.39 0.06 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.88 -0.6 . . . . 1.0 111.976 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.495 ' H ' ' C ' ' A' ' 98' ' ' TYR . . . -148.97 -173.73 19.93 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.874 -0.891 . . . . 1.0 110.874 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.525 ' NE2' ' H ' ' A' ' 102' ' ' MET . 53.9 tp60 -56.34 156.43 5.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.231 0.538 . . . . 1.0 110.617 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.525 ' H ' ' NE2' ' A' ' 101' ' ' GLN . 0.4 OUTLIER -127.4 146.06 50.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.954 -0.566 . . . . 1.0 110.651 -179.752 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.6 tt -141.8 140.49 30.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -114.31 143.6 44.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.573 0.701 . . . . 1.0 110.949 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.753 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 86.1 m-85 -130.37 154.38 47.75 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 114.781 -1.1 . . . . 1.0 110.739 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.61 11.23 1.65 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 1.0 111.151 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.964 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.5 pt-20 -160.79 79.11 0.62 Allowed 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 119.221 -0.419 . . . . 1.0 109.918 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.964 ' O ' ' O ' ' A' ' 107' ' ' GLU . 55.5 p30 18.77 167.96 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 122.434 1.112 . . . . 1.0 113.634 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 10.5 t -148.0 109.7 4.45 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 120.737 -1.227 . . . . 1.0 110.505 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.437 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.53 -18.58 64.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.309 -0.405 . . . . 1.0 110.9 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.423 ' SG ' ' O ' ' A' ' 110' ' ' SER . 85.1 m -151.84 88.7 1.42 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 1.0 109.819 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.753 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 11.9 tp -61.01 -41.49 96.64 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.163 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.765 ' NE2' ' H ' ' A' ' 113' ' ' GLN . 3.8 mp0 -43.16 -10.29 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.285 -0.416 . . . . 1.0 112.113 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.564 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.7 t0 -95.13 -22.83 17.61 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 1.0 110.434 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.511 ' N ' ' O ' ' A' ' 112' ' ' LEU . 34.5 mmt180 -107.06 -38.67 5.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.136 0.791 . . . . 1.0 113.136 -178.657 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.66 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -119.11 138.58 52.8 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 122.035 0.922 . . . . 1.0 110.811 -179.828 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 118' ' ' PHE . 32.1 mmt180 -72.21 -73.67 0.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.11 -0.994 . . . . 1.0 110.447 -177.551 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.616 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 98.1 m-85 -33.23 143.22 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.485 0 O-C-N 123.588 0.555 . . . . 1.0 110.515 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 50.1 t30 -103.07 6.49 38.66 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.079 0.466 . . . . 1.0 110.853 -178.152 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -137.68 141.59 41.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.753 -0.658 . . . . 1.0 111.017 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 41.8 mm -121.19 116.94 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.258 -0.883 . . . . 1.0 109.582 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.438 ' O ' ' CB ' ' A' ' 123' ' ' SER . 37.7 m-70 -109.44 29.97 7.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.581 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.8 p 163.33 149.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.095 0.474 . . . . 1.0 110.078 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.9 pp -163.3 157.52 20.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.338 -178.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -124.91 119.62 29.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.792 0.33 . . . . 1.0 110.161 -179.797 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.522 HG22 HD12 ' A' ' 90' ' ' ILE . 44.3 t -103.17 104.01 15.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.918 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -77.91 -40.76 38.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.658 -0.701 . . . . 1.0 111.331 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -137.21 146.37 44.77 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.102 0.477 . . . . 1.0 111.26 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.55 -171.39 2.36 Favored Glycine 0 CA--C 1.519 0.327 0 N-CA-C 111.177 -0.769 . . . . 1.0 111.177 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.3 m -119.37 157.12 28.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.318 0.58 . . . . 1.0 109.877 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -129.98 162.27 29.05 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.452 -0.795 . . . . 1.0 110.753 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 47.0 t -132.32 138.34 52.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 N-CA-C 109.181 -0.674 . . . . 1.0 109.181 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.5 ' HG ' HD11 ' A' ' 146' ' ' LEU . 39.3 mt -110.75 143.18 41.66 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.793 -0.447 . . . . 1.0 109.793 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -117.97 133.35 56.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.756 0.312 . . . . 1.0 110.904 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 -47.41 -30.38 3.28 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.943 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.5 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -140.27 177.13 8.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 1.0 110.493 -179.677 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.464 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -83.37 172.29 12.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.637 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 138' ' ' ASN . . . . . 0.464 ' N ' ' OG ' ' A' ' 137' ' ' SER . 21.3 m-20 64.24 19.21 11.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.17 -0.923 . . . . 1.0 110.078 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 35.59 78.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.706 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.404 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 65.2 ttt180 -147.38 36.79 0.91 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.185 0.516 . . . . 1.0 110.388 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.459 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -149.25 -141.77 3.49 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 111.163 -0.775 . . . . 1.0 111.163 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.25 164.89 25.98 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.058 -0.349 . . . . 1.0 110.058 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.495 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.99 137.59 29.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.791 -179.681 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -127.56 124.2 37.61 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.558 -0.534 . . . . 1.0 109.558 178.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.7 tp -81.0 127.22 32.33 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.806 -0.634 . . . . 1.0 111.048 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.5 HD11 ' HG ' ' A' ' 133' ' ' LEU . 23.1 mt -115.32 105.09 12.46 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.643 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.599 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.8 mtm -80.76 159.84 68.07 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.383 -0.372 . . . . 1.0 110.105 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -56.06 115.99 2.86 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.27 1.98 . . . . 1.0 110.966 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 174.75 -151.29 12.22 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 110.513 -1.035 . . . . 1.0 110.513 -179.112 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.44 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 42.2 p-10 -128.55 131.92 48.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.977 0.417 . . . . 1.0 110.954 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 14.6 m-85 -122.14 127.97 50.72 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.019 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -115.52 -1.1 12.86 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.719 0.295 . . . . 1.0 110.692 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -156.96 163.1 39.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.305 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.564 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.96 -22.34 56.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.055 -0.975 . . . . 1.0 111.827 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.539 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.42 -21.47 66.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.249 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -49.75 -47.32 50.87 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.909 -178.447 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.664 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 30.5 p90 -102.48 17.57 23.3 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.175 0.512 . . . . 1.0 109.95 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.57 74.17 0.32 Allowed Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.467 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.664 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.58 -171.24 2.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.35 0.595 . . . . 1.0 110.907 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.58 -35.58 3.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.985 -1.007 . . . . 1.0 112.277 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.601 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 25.3 t-20 -145.67 -27.4 0.45 Allowed 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 111.696 0.258 . . . . 1.0 111.696 -178.433 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 96.92 0.38 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 124.36 1.038 . . . . 1.0 110.736 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -66.55 116.07 7.12 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.139 -178.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 60.5 t -118.8 128.79 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.198 -0.91 . . . . 1.0 110.415 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -104.65 -26.02 6.65 Favored Glycine 0 N--CA 1.464 0.53 0 N-CA-C 111.393 -0.683 . . . . 1.0 111.393 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 110' ' ' SER . 4.6 m -159.44 -173.69 4.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.787 -0.365 . . . . 1.0 110.03 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.521 HD21 HD13 ' A' ' 112' ' ' LEU . 2.5 pp -171.51 144.32 1.9 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.521 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.55 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 4.9 ptm180 -135.8 164.04 28.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.4 0.619 . . . . 1.0 109.908 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.878 HH11 ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.48 150.02 21.08 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.008 -0.997 . . . . 1.0 109.171 178.329 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.811 ' C ' HD12 ' A' ' 171' ' ' ILE . 44.6 t -82.95 83.59 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.189 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.811 HD12 ' C ' ' A' ' 170' ' ' VAL . 2.0 mp -133.65 124.43 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-N 116.104 -0.498 . . . . 1.0 109.978 179.263 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.534 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 44.4 p-10 -73.86 -36.22 64.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.719 -0.673 . . . . 1.0 110.368 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.534 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 94.2 m-85 -56.67 -77.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.623 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 10.9 t . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 118.044 -0.979 . . . . 1.0 110.616 179.856 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.051 -0.722 . . . . 1.0 109.051 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.678 ' H ' HD11 ' A' ' 81' ' ' LEU . . . -93.73 172.82 33.05 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.599 -1.0 . . . . 1.0 110.599 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -172.02 112.7 0.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 121.145 -0.222 . . . . 1.0 110.79 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.541 HG22 HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -120.07 173.91 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.31 0 O-C-N 123.174 0.296 . . . . 1.0 111.057 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.509 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.4 m -131.36 120.62 23.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.299 -1.0 . . . . 1.0 108.299 177.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -105.12 132.64 51.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.898 -1.046 . . . . 1.0 110.027 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.509 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.2 m-85 -114.89 129.4 56.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.241 -0.89 . . . . 1.0 111.354 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.534 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 80.9 tt0 -55.45 -26.73 43.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.197 -0.911 . . . . 1.0 110.389 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -122.86 154.71 37.92 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.027 0.441 . . . . 1.0 110.209 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 6.5 ptp85 -58.32 -173.92 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.541 -0.754 . . . . 1.0 110.257 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.53 27.24 0.48 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.555 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.8 m-85 49.91 67.45 0.9 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.074 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -127.19 -160.16 0.98 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.991 0.424 . . . . 1.0 110.485 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.61 -149.08 0.75 Allowed Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.882 -0.887 . . . . 1.0 110.882 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.534 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 89.8 mtm-85 -72.49 149.8 43.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.682 0.277 . . . . 1.0 110.78 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -137.48 148.8 46.34 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.279 0.562 . . . . 1.0 110.35 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.525 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.9 t80 -141.86 142.18 33.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.924 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.525 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 77.0 tt0 -110.8 122.56 48.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.121 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.33 126.59 54.38 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.707 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.6 p -118.85 11.47 12.62 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.501 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.2 p -156.1 168.8 26.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.055 -0.52 . . . . 1.0 110.536 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -59.51 138.52 57.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.68 -0.691 . . . . 1.0 111.392 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.08 143.64 48.15 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.224 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.438 HG22 ' CE2' ' A' ' 51' ' ' TYR . 27.6 p -111.35 -18.59 12.87 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.793 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -148.14 110.07 4.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 1.0 110.405 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -108.11 1.0 21.98 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.179 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.569 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 47.1 mt-30 -53.34 -48.21 93.38 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.632 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 21.0 Cg_endo -56.86 -35.24 98.19 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.255 1.303 . . . . 1.0 112.881 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -91.36 -46.9 7.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.244 0.545 . . . . 1.0 110.945 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 mt -119.84 128.18 53.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.329 -0.851 . . . . 1.0 111.469 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -91.0 -15.54 29.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.351 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 59.7 ttm-85 -176.13 120.08 0.16 Allowed 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.706 -0.85 . . . . 1.0 108.706 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.7 t -99.53 109.91 22.4 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.348 -0.241 . . . . 1.0 110.348 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -103.37 -3.29 25.71 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.435 -0.348 . . . . 1.0 110.228 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.555 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.1 t -157.84 156.36 31.3 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.192 -0.299 . . . . 1.0 110.192 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.13 155.36 36.59 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.224 -0.444 . . . . 1.0 110.719 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.3 mtp85 -133.89 122.02 22.56 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.791 -0.818 . . . . 1.0 108.791 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.541 HG13 HG22 ' A' ' 4' ' ' ILE . 22.3 t -107.19 117.55 53.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.27 0.557 . . . . 1.0 110.333 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -78.77 -43.45 25.49 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.064 -0.971 . . . . 1.0 110.874 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.8 t -162.96 162.02 25.9 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.424 -0.584 . . . . 1.0 109.424 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.67 177.17 48.7 Favored Glycine 0 C--N 1.315 -0.637 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.7 m -114.24 132.58 56.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.645 -0.502 . . . . 1.0 109.645 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.648 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 53.4 m95 -120.27 146.49 46.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.898 -0.592 . . . . 1.0 110.661 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.557 ' C ' HD12 ' A' ' 45' ' ' LEU . 22.0 tpp -120.49 131.18 54.6 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.549 -0.751 . . . . 1.0 109.212 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.557 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -109.58 131.27 55.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.664 -0.698 . . . . 1.0 109.838 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.41 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 87.9 m-85 -111.69 133.09 54.16 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.579 0.704 . . . . 1.0 111.687 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -57.65 -36.89 72.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.125 -0.943 . . . . 1.0 111.389 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.7 mt-30 -108.11 153.25 41.91 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.635 -178.771 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -63.6 159.43 40.88 Favored 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.458 2.106 . . . . 1.0 112.172 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 62.53 36.9 13.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.254 -0.884 . . . . 1.0 111.332 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.438 ' CE2' HG22 ' A' ' 24' ' ' THR . 3.2 m-85 50.77 75.96 0.17 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.057 -0.974 . . . . 1.0 111.071 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.3 m -144.07 152.97 41.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.105 0.479 . . . . 1.0 110.244 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.84 -148.16 21.53 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.038 -0.601 . . . . 1.0 111.801 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.629 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.1 tp -75.49 143.58 42.49 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.038 -0.581 . . . . 1.0 110.262 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -120.84 150.79 40.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.482 0.182 . . . . 1.0 110.591 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 26.1 m-85 -124.99 124.12 41.32 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-O 120.841 0.353 . . . . 1.0 110.585 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -83.1 123.07 29.16 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.068 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.0 mp -119.37 144.07 47.08 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.415 -0.812 . . . . 1.0 110.03 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -132.4 158.91 40.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.121 -0.945 . . . . 1.0 110.141 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.7 ttp85 -37.09 125.32 0.94 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.997 -0.547 . . . . 1.0 110.763 -178.75 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.58 -179.97 32.01 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.53 -1.028 . . . . 1.0 110.53 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -114.14 136.23 53.16 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.897 0.379 . . . . 1.0 110.19 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -130.37 112.9 13.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 1.0 109.616 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.83 -3.85 55.59 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.033 -0.531 . . . . 1.0 111.411 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.428 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 78.9 m-20 -147.6 135.7 21.36 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.13 -0.693 . . . . 1.0 109.13 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.471 ' C ' ' H ' ' A' ' 68' ' ' GLN . 11.7 p-80 -56.34 -41.06 75.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.045 0.45 . . . . 1.0 111.057 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -54.52 -6.96 0.13 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.785 -0.643 . . . . 1.0 110.617 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.471 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -82.89 -34.43 26.67 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.152 -0.619 . . . . 1.0 111.606 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.404 ' O ' ' HB2' ' A' ' 70' ' ' MET . 2.3 p90 -94.51 15.68 17.3 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.437 ' C ' ' H ' ' A' ' 72' ' ' LEU . 70.2 mtp 76.18 27.89 0.85 Allowed 'General case' 0 C--O 1.224 -0.252 0 O-C-N 124.341 1.025 . . . . 1.0 109.679 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.592 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.2 39.61 0.84 Allowed Glycine 0 C--N 1.341 0.851 0 C-N-CA 119.974 -1.108 . . . . 1.0 112.073 -179.125 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.483 ' C ' ' O ' ' A' ' 71' ' ' GLY . 11.0 mt -17.12 -47.56 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.573 0.749 . . . . 1.0 110.889 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 71' ' ' GLY . 6.7 t -104.33 116.86 32.9 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.342 -0.845 . . . . 1.0 109.003 177.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -67.49 37.51 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.228 -0.442 . . . . 1.0 110.876 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.519 ' H ' ' C ' ' A' ' 73' ' ' SER . 23.9 t -116.95 126.57 53.14 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 109.557 -0.534 . . . . 1.0 109.557 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p -164.7 113.61 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 123.85 0.719 . . . . 1.0 109.212 -179.143 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -122.2 13.42 10.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.247 -0.433 . . . . 1.0 110.829 -178.668 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.4 p -163.63 162.8 24.43 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.171 0.51 . . . . 1.0 110.644 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -157.55 148.9 21.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.604 -0.726 . . . . 1.0 110.327 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.611 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 2.1 ptm180 -128.23 150.38 50.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.761 -0.459 . . . . 1.0 109.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.724 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -101.43 124.14 46.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.088 -1.079 . . . . 1.0 108.088 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.724 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.0 mt -85.65 115.75 62.83 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 109.796 -0.446 . . . . 1.0 109.796 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -53.31 152.61 19.33 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 122.34 2.027 . . . . 1.0 113.021 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -71.83 -179.44 2.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.479 -0.782 . . . . 1.0 110.464 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.2 t -165.09 140.6 5.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.342 -0.39 . . . . 1.0 110.972 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -85.66 -70.77 1.32 Allowed Glycine 0 CA--C 1.522 0.476 0 N-CA-C 110.146 -1.181 . . . . 1.0 110.146 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 m -89.3 153.45 20.88 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.611 ' NE2' HD11 ' A' ' 171' ' ' ILE . 15.5 m80 -132.3 120.12 21.68 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.486 -0.325 . . . . 1.0 110.914 -179.599 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -145.45 135.3 23.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.838 -0.345 . . . . 1.0 110.178 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.492 HD12 HG22 ' A' ' 126' ' ' VAL . 18.0 tt -148.27 144.86 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.047 -0.261 . . . . 1.0 110.582 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -124.42 99.92 6.43 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.563 0.54 . . . . 1.0 111.471 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.15 152.36 27.8 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.638 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -129.57 137.84 50.96 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.448 -0.796 . . . . 1.0 111.79 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -54.8 -56.85 14.87 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.362 -0.835 . . . . 1.0 110.978 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.596 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 78.0 mtp180 -105.57 173.87 6.12 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 110.107 -0.331 . . . . 1.0 110.107 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.617 ' O ' ' O ' ' A' ' 97' ' ' ASP . 96.1 mt-10 -58.27 159.14 6.34 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 115.829 -0.623 . . . . 1.0 110.163 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.788 ' O ' ' N ' ' A' ' 99' ' ' ARG . 6.6 m-20 53.05 127.18 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.722 0 O-C-N 124.512 1.133 . . . . 1.0 108.484 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 1.6 p90 -43.22 70.14 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.477 0.486 . . . . 1.0 111.473 -177.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.788 ' N ' ' O ' ' A' ' 97' ' ' ASP . 5.6 tpt180 -121.32 -156.14 0.67 Allowed 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.99 -0.374 . . . . 1.0 109.99 -178.277 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 99' ' ' ARG . . . 33.27 -152.54 0.01 OUTLIER Glycine 0 CA--C 1.521 0.445 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.501 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 56.5 tp60 -68.62 145.48 53.89 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.461 0.648 . . . . 1.0 111.26 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.491 ' SD ' ' O ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 151.0 51.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 1.0 111.187 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.429 HG21 ' CD1' ' A' ' 116' ' ' PHE . 9.4 tt -145.15 139.16 22.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -112.38 143.72 43.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.381 0.61 . . . . 1.0 110.578 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.49 ' CD1' ' SG ' ' A' ' 109' ' ' CYS . 88.6 m-85 -129.18 154.81 46.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.514 -1.221 . . . . 1.0 110.522 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.0 p -143.79 9.61 1.55 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.329 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.934 ' O ' ' O ' ' A' ' 108' ' ' ASP . 8.1 pt-20 -160.25 78.33 0.65 Allowed 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 118.851 -0.595 . . . . 1.0 109.424 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.934 ' O ' ' O ' ' A' ' 107' ' ' GLU . 12.9 p-10 22.44 167.7 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 122.491 1.139 . . . . 1.0 113.278 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.49 ' SG ' ' CD1' ' A' ' 105' ' ' PHE . 9.8 m -146.95 106.42 3.92 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 120.342 -1.474 . . . . 1.0 109.548 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.422 ' O ' ' OG ' ' A' ' 166' ' ' SER . 80.9 p -67.46 -22.53 65.49 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.395 -0.522 . . . . 1.0 110.675 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 72.0 m -143.96 95.57 2.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.246 0.546 . . . . 1.0 110.554 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.1 tp -63.62 -44.54 93.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.416 -0.811 . . . . 1.0 110.373 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.582 ' NE2' ' OD1' ' A' ' 119' ' ' ASN . 29.6 mm100 -47.2 -9.15 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.245 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.513 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.1 m-20 -96.8 -24.99 15.65 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.988 0.423 . . . . 1.0 110.381 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.0 mmt-85 -109.41 -36.69 5.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.849 -0.614 . . . . 1.0 111.682 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.5 ' HB2' HD11 ' A' ' 112' ' ' LEU . 3.7 t80 -125.53 120.67 31.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.146 0.498 . . . . 1.0 109.902 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -60.36 -60.06 4.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.488 -0.778 . . . . 1.0 110.942 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -40.39 137.84 1.01 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.803 -0.443 . . . . 1.0 109.803 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 119' ' ' ASN . . . . . 0.582 ' OD1' ' NE2' ' A' ' 113' ' ' GLN . 62.9 m-20 -101.94 2.38 37.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.097 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -135.13 137.88 43.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.227 0.537 . . . . 1.0 110.555 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.555 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.0 mm -120.99 122.2 67.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.025 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -112.31 21.85 15.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.413 -0.812 . . . . 1.0 111.046 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.499 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.8 p 169.29 153.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.064 0.459 . . . . 1.0 109.937 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.428 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.7 pp -165.33 158.31 16.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.523 -0.762 . . . . 1.0 110.079 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -125.09 119.08 27.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.361 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.492 HG22 HD12 ' A' ' 90' ' ' ILE . 29.6 t -102.95 104.92 17.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 115.925 -0.58 . . . . 1.0 109.785 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.899 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.82 -41.14 30.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.516 -0.766 . . . . 1.0 111.315 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -140.59 147.11 38.91 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.511 -0.476 . . . . 1.0 110.745 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 60.51 -175.46 4.56 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.079 -0.809 . . . . 1.0 111.079 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.1 m -117.91 153.15 34.06 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.406 -0.59 . . . . 1.0 109.406 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -126.42 159.39 33.43 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.562 -0.744 . . . . 1.0 110.73 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 41.4 t -130.67 136.44 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.28 -0.637 . . . . 1.0 109.28 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.543 ' HG ' HD11 ' A' ' 146' ' ' LEU . 37.3 mt -107.82 141.42 39.42 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 110.219 -0.289 . . . . 1.0 110.219 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -117.58 134.35 54.97 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.268 0.355 . . . . 1.0 110.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -45.74 -50.75 13.52 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.57 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.72 166.06 16.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.288 0.566 . . . . 1.0 110.279 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.1 m -68.6 177.04 2.62 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.101 -0.954 . . . . 1.0 110.936 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 12.2 m120 58.76 22.16 9.75 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.356 -1.293 . . . . 1.0 110.057 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 36.36 76.94 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.435 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -146.41 41.2 1.14 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.252 0.548 . . . . 1.0 110.166 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.52 -146.64 4.38 Favored Glycine 0 N--CA 1.462 0.386 0 N-CA-C 111.618 -0.593 . . . . 1.0 111.618 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 85.1 mtt85 -69.94 168.39 15.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.86 135.16 21.76 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 123.851 0.719 . . . . 1.0 110.89 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 144' ' ' TYR . . . . . 0.413 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 7.1 m-85 -127.25 137.92 52.98 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.604 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.7 OUTLIER -91.5 126.23 36.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.937 0.399 . . . . 1.0 110.565 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.604 ' N ' HD23 ' A' ' 145' ' ' LEU . 24.0 mt -114.93 102.73 10.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.522 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.611 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -81.62 161.92 59.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 116.374 -0.375 . . . . 1.0 110.708 -178.937 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.61 119.15 5.95 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 121.41 1.406 . . . . 1.0 111.522 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.73 -152.42 19.45 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.344 -1.102 . . . . 1.0 110.344 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -127.15 136.4 52.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.77 0.319 . . . . 1.0 110.352 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.513 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 27.6 m-85 -126.6 129.01 47.71 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.172 -0.467 . . . . 1.0 109.766 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -116.33 -3.1 11.97 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.882 0.373 . . . . 1.0 110.291 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -156.19 159.16 38.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.518 0.675 . . . . 1.0 110.191 179.568 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.474 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.8 p90 -74.68 -20.87 59.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.562 -1.199 . . . . 1.0 112.286 -177.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 -68.44 -19.48 64.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.252 -0.431 . . . . 1.0 111.09 -179.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 156' ' ' ASP . . . . . 0.513 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 54.4 t0 -51.5 -50.13 60.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.101 -0.5 . . . . 1.0 110.914 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.71 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 14.4 p90 -94.43 21.5 7.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.041 0.448 . . . . 1.0 110.443 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.68 75.18 0.23 Allowed Glycine 0 CA--C 1.519 0.343 0 N-CA-C 111.148 -0.781 . . . . 1.0 111.148 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.71 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.82 147.91 42.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.124 0.488 . . . . 1.0 110.03 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 160' ' ' THR . . . . . 0.404 ' O ' ' CG ' ' A' ' 161' ' ' ASN . 15.1 t -76.49 -20.51 56.89 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.003 -0.998 . . . . 1.0 109.91 177.904 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.404 ' CG ' ' O ' ' A' ' 160' ' ' THR . 73.7 m-20 -162.3 -171.04 2.66 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.5 -0.48 . . . . 1.0 110.497 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.82 -10.81 15.1 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.569 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -47.28 117.03 1.59 Allowed 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 120.614 0.245 . . . . 1.0 111.266 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 162' ' ' ALA . 55.8 t -131.14 124.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.76 177.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -100.05 -24.62 9.58 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 111.464 -0.654 . . . . 1.0 111.464 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 110' ' ' SER . 6.0 m -159.82 -171.0 3.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.006 -0.368 . . . . 1.0 110.006 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 pp -172.54 142.17 1.22 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.945 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -132.93 162.66 31.04 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.861 -0.422 . . . . 1.0 109.861 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.496 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -95.49 154.3 17.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.542 -0.754 . . . . 1.0 109.63 178.522 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.733 ' C ' HD12 ' A' ' 171' ' ' ILE . 49.4 t -88.25 88.62 2.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 O-C-N 122.105 -0.372 . . . . 1.0 111.944 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.733 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.8 mp -137.04 123.15 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 121.137 0.494 . . . . 1.0 109.88 179.389 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.524 ' OD1' ' CD2' ' A' ' 173' ' ' PHE . 43.7 p-10 -70.19 -35.04 73.66 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.685 -0.689 . . . . 1.0 110.167 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.524 ' CD2' ' OD1' ' A' ' 172' ' ' ASP . 96.7 m-85 -64.54 173.41 2.15 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.602 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 118.046 -0.978 . . . . 1.0 110.512 -179.979 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.48 ' O ' ' O ' ' A' ' 2' ' ' GLY . 87.9 mt-30 . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.514 -0.55 . . . . 1.0 109.514 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.48 ' O ' ' O ' ' A' ' 1' ' ' GLN . . . 51.59 167.71 0.01 OUTLIER Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.818 -0.913 . . . . 1.0 110.818 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -173.78 98.92 0.11 Allowed 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.829 -0.348 . . . . 1.0 110.571 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.02 164.48 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-O 120.781 0.324 . . . . 1.0 110.487 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.501 HG22 ' CE1' ' A' ' 7' ' ' TYR . 32.9 m -124.17 119.94 30.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.919 -1.141 . . . . 1.0 107.919 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.0 mt -104.17 133.88 48.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.799 -1.091 . . . . 1.0 109.776 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.501 ' CE1' HG22 ' A' ' 5' ' ' THR . 66.4 m-85 -116.12 126.5 53.8 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.383 -0.826 . . . . 1.0 111.067 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.532 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 79.2 tt0 -52.74 -33.63 49.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.657 -0.701 . . . . 1.0 110.289 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -113.35 161.29 17.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.245 0.545 . . . . 1.0 110.655 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 14.6 ptt-85 -65.22 -175.94 0.26 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.271 -0.877 . . . . 1.0 110.673 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.61 26.29 1.04 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 110.662 -0.975 . . . . 1.0 110.662 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 50.53 70.05 0.56 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.346 -0.427 . . . . 1.0 110.102 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -133.43 -159.78 0.99 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.914 0.388 . . . . 1.0 110.319 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.28 -152.1 0.82 Allowed Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.731 -0.947 . . . . 1.0 110.731 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 91.1 mtm-85 -68.83 146.01 53.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.673 0.273 . . . . 1.0 110.998 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -136.64 153.79 50.82 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 121.223 0.535 . . . . 1.0 110.688 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 8.2 t80 -147.4 141.78 26.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.253 -0.885 . . . . 1.0 110.086 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.453 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.2 tt0 -110.21 124.72 52.1 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.571 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -114.42 126.53 55.08 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.337 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t -117.28 9.89 13.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.877 -0.601 . . . . 1.0 110.189 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.3 m -154.4 166.37 33.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.892 -0.594 . . . . 1.0 110.563 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -59.25 138.67 57.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.5 -0.773 . . . . 1.0 111.576 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.28 142.21 48.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.412 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.515 ' O ' ' OG ' ' A' ' 78' ' ' SER . 21.0 p -109.82 -10.07 14.78 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.66 -0.7 . . . . 1.0 112.274 -178.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -156.88 114.4 3.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.291 0.567 . . . . 1.0 110.09 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -116.93 1.26 12.63 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.512 -0.767 . . . . 1.0 110.75 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.6 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 4.4 mt-30 -52.93 -43.24 93.7 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.31 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.6 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 37.6 Cg_exo -58.62 -33.51 98.23 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.063 1.842 . . . . 1.0 111.616 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -95.5 -53.1 3.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 120.734 -0.386 . . . . 1.0 110.754 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 mt -116.81 127.61 54.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 1.0 110.804 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 t -94.74 -7.12 41.47 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.862 -0.608 . . . . 1.0 112.148 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.419 ' CD ' HD21 ' A' ' 34' ' ' ASN . 35.8 ttm180 -151.83 -55.29 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.229 0.455 . . . . 1.0 112.229 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.9 t 62.34 80.03 0.24 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 1.0 110.975 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.419 HD21 ' CD ' ' A' ' 32' ' ' ARG . 94.7 m-20 -94.64 3.44 55.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.733 -0.212 . . . . 1.0 111.551 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 p -157.33 159.09 37.14 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.839 -0.345 . . . . 1.0 110.419 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.15 155.24 33.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 1.0 111.512 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.452 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 26.4 mtp85 -134.89 124.48 25.08 Favored 'General case' 0 C--O 1.211 -0.96 0 N-CA-C 108.801 -0.815 . . . . 1.0 108.801 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.1 t -108.92 134.48 50.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.06 -0.719 . . . . 1.0 109.06 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.25 -43.39 8.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 1.0 110.241 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 p -159.58 156.52 28.16 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.735 -0.839 . . . . 1.0 108.735 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.46 174.18 50.21 Favored Glycine 0 C--N 1.316 -0.547 0 N-CA-C 110.959 -0.856 . . . . 1.0 110.959 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.6 m -111.74 142.55 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.415 -0.587 . . . . 1.0 109.415 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.449 ' CE2' HD13 ' A' ' 81' ' ' LEU . 54.6 m95 -131.06 150.47 52.13 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.45 0.643 . . . . 1.0 111.254 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.598 ' C ' HD23 ' A' ' 45' ' ' LEU . 37.6 ttm -128.47 133.26 48.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.964 -1.016 . . . . 1.0 108.908 178.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.598 HD23 ' C ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -109.92 137.6 47.47 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 -179.405 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.418 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 40.9 m-85 -110.95 132.01 54.57 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.628 0.728 . . . . 1.0 110.277 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -59.36 -35.09 73.25 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.184 -0.916 . . . . 1.0 110.962 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.7 mt-30 -110.44 152.43 43.31 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.602 -178.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.425 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 40.0 Cg_endo -63.05 157.09 50.91 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.592 2.195 . . . . 1.0 113.133 178.806 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 64.33 35.95 9.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.3 -0.864 . . . . 1.0 111.268 179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.418 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.5 m-85 51.89 76.28 0.18 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.01 -0.996 . . . . 1.0 111.119 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.5 m -144.98 154.87 43.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.015 0.436 . . . . 1.0 109.976 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.88 -149.79 22.56 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.97 -0.633 . . . . 1.0 112.143 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.609 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.3 tp -75.24 142.74 43.34 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.023 -0.589 . . . . 1.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 2.9 pt20 -121.1 151.92 39.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -128.77 125.89 38.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.294 -0.412 . . . . 1.0 110.881 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.41 ' C ' HD12 ' A' ' 58' ' ' LEU . 58.2 t80 -84.52 122.69 29.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.986 0.422 . . . . 1.0 110.471 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.41 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.6 mp -117.25 146.1 43.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.329 0.585 . . . . 1.0 110.06 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' C ' ' A' ' 60' ' ' ARG . 40.1 mtp180 -131.76 160.82 34.43 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.374 -0.83 . . . . 1.0 109.896 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.5 ttt180 -37.25 125.51 0.99 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.769 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.7 -178.42 33.14 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.508 -1.037 . . . . 1.0 110.508 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.452 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 70.9 m-20 -117.77 124.63 48.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.902 0.382 . . . . 1.0 110.533 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -117.26 113.27 21.93 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.196 -0.668 . . . . 1.0 109.196 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.413 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.91 -2.89 55.43 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.707 -179.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.413 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.4 m-20 -147.98 139.23 23.48 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.576 -0.898 . . . . 1.0 108.576 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.453 ' C ' ' H ' ' A' ' 68' ' ' GLN . 12.2 p-80 -59.24 -43.52 92.39 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.599 -0.44 . . . . 1.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 26.9 mm100 -50.77 -9.46 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.86 -0.609 . . . . 1.0 111.12 179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.453 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.1 mm-40 -82.36 -35.57 27.66 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.265 -0.574 . . . . 1.0 111.15 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.455 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.53 17.79 7.02 Favored 'General case' 0 CA--C 1.507 -0.673 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.534 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 37.6 mtt 80.37 16.47 0.69 Allowed 'General case' 0 CA--C 1.521 -0.152 0 O-C-N 124.013 0.82 . . . . 1.0 109.94 -178.568 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -61.0 100.88 0.26 Allowed Glycine 0 C--N 1.337 0.624 0 N-CA-C 110.576 -1.009 . . . . 1.0 110.576 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 47.5 mt -78.7 -29.36 45.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.69 -0.485 . . . . 1.0 109.69 177.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 75' ' ' SER . 96.1 p -131.83 121.68 24.5 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 109.964 -0.384 . . . . 1.0 109.964 178.595 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 53.2 p-10 -72.04 35.84 0.06 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.867 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.495 ' H ' ' C ' ' A' ' 73' ' ' SER . 7.2 p -111.67 72.67 0.79 Allowed 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 116.14 -0.482 . . . . 1.0 110.304 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.0 t -99.77 117.93 45.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 N-CA-C 109.301 -0.629 . . . . 1.0 109.301 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.425 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.7 mtm-85 -124.34 5.09 8.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.372 -0.376 . . . . 1.0 111.628 -178.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.515 ' OG ' ' O ' ' A' ' 24' ' ' THR . 30.7 m -165.06 162.23 20.21 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.238 0.542 . . . . 1.0 111.202 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.1 p -154.42 146.72 23.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.285 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.439 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 4.5 ptm180 -128.42 150.58 50.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.415 -0.357 . . . . 1.0 110.192 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.449 HD13 ' CE2' ' A' ' 43' ' ' TRP . 20.7 tp -99.58 134.57 42.28 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.046 -1.094 . . . . 1.0 108.046 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.445 ' H ' HD12 ' A' ' 81' ' ' LEU . 6.4 mt -94.82 131.33 30.7 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.737 -0.468 . . . . 1.0 109.737 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.63 146.74 68.22 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 122.159 1.906 . . . . 1.0 113.158 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 p80 -74.61 -179.66 4.22 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.37 -0.832 . . . . 1.0 110.487 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 40.5 t -172.11 152.63 2.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.299 -0.409 . . . . 1.0 111.489 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -90.46 -68.22 1.2 Allowed Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.512 -1.035 . . . . 1.0 110.512 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m -89.73 153.61 20.57 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.869 -0.419 . . . . 1.0 109.869 179.087 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.591 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 8.2 m80 -134.09 119.79 19.36 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.52 -0.309 . . . . 1.0 111.013 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -142.24 134.01 27.0 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.617 -0.433 . . . . 1.0 110.398 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.482 HD12 HG22 ' A' ' 126' ' ' VAL . 18.5 tt -145.52 140.5 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.83 0.347 . . . . 1.0 110.769 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.546 ' NH2' ' SD ' ' A' ' 102' ' ' MET . 77.0 mtp85 -120.14 98.03 5.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.164 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -79.17 140.89 37.63 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.126 0.489 . . . . 1.0 110.998 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -118.21 134.9 54.61 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-N 115.359 -0.837 . . . . 1.0 111.141 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -55.18 -59.18 5.13 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.688 179.378 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.48 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.3 mtt85 -98.68 162.93 12.86 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.44 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -44.4 156.07 0.08 Allowed 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.677 0.751 . . . . 1.0 111.017 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.577 ' O ' ' CD1' ' A' ' 98' ' ' TYR . 16.5 m-20 61.11 -108.24 0.33 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.525 -1.216 . . . . 1.0 110.371 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.577 ' CD1' ' O ' ' A' ' 97' ' ' ASP . 1.2 m-85 -149.51 40.33 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.599 -0.44 . . . . 1.0 110.392 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -102.5 153.31 20.18 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 109.309 -0.626 . . . . 1.0 109.309 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.55 -168.53 44.06 Favored Glycine 0 CA--C 1.521 0.413 0 N-CA-C 110.835 -0.906 . . . . 1.0 110.835 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.417 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 9.4 tp-100 -65.7 143.85 57.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 1.0 110.926 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.546 ' SD ' ' NH2' ' A' ' 91' ' ' ARG . 2.1 ptm -129.82 152.06 49.72 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.673 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.9 tt -144.38 140.81 24.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.504 -0.554 . . . . 1.0 109.504 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' GLU . . . . . 0.503 ' OE1' ' NH1' ' A' ' 91' ' ' ARG . 80.6 tt0 -115.04 146.81 40.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.637 0.732 . . . . 1.0 111.398 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.471 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 83.4 m-85 -132.17 155.58 47.94 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 114.647 -1.16 . . . . 1.0 110.737 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.8 p -144.04 15.84 1.72 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.526 -0.761 . . . . 1.0 110.314 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.2 pm0 -151.54 -172.97 4.37 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.602 -0.439 . . . . 1.0 110.286 178.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 66.4 t0 -74.76 140.17 43.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.771 0.319 . . . . 1.0 110.865 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.518 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.9 m -133.71 91.38 2.83 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.56 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -64.68 -27.28 68.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.37 -0.377 . . . . 1.0 111.082 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.4 t -137.79 95.66 3.09 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.285 0.564 . . . . 1.0 110.429 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -60.62 -41.24 94.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.156 -0.929 . . . . 1.0 110.423 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.602 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 3.2 mp0 -47.83 -13.37 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.895 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' A' ' 112' ' ' LEU . 82.3 m-20 -91.46 1.41 57.15 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.767 0.794 . . . . 1.0 109.714 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.1 mmt-85 -131.02 -40.11 1.18 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.09 -1.413 . . . . 1.0 113.613 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.654 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.61 137.29 54.39 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 122.29 1.043 . . . . 1.0 111.471 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 118' ' ' PHE . 29.4 mmt180 -69.83 -69.19 0.36 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 121.47 -0.768 . . . . 1.0 111.137 -177.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.601 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 81.3 m-85 -37.86 145.73 0.07 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.313 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 8.8 p-10 -104.21 9.18 36.22 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.77 0.319 . . . . 1.0 111.028 -178.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -138.49 140.22 39.11 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.147 0.498 . . . . 1.0 111.204 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.734 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.8 mm -120.96 124.04 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 115.33 -0.85 . . . . 1.0 109.25 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -112.8 21.26 15.7 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.733 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.5 p 169.77 153.7 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.067 0.461 . . . . 1.0 109.959 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.5 pp -164.2 158.21 18.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.568 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.8 t-20 -126.25 115.11 19.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.659 -179.549 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.482 HG22 HD12 ' A' ' 90' ' ' ILE . 21.5 t -98.72 104.84 16.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 109.458 -0.571 . . . . 1.0 109.458 178.809 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.865 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.86 -39.59 42.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 1.0 111.262 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -146.65 148.83 32.46 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.848 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 66.47 175.13 6.35 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.772 -0.931 . . . . 1.0 110.772 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 m -116.83 150.54 38.21 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.058 -0.719 . . . . 1.0 109.058 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.416 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 43.8 m95 -124.09 167.38 14.3 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.638 -178.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 39.9 t -138.42 105.63 3.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.558 -0.292 . . . . 1.0 110.331 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 13.3 mt -78.62 142.78 36.97 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.068 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -121.55 136.69 54.93 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.711 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -47.88 -46.8 31.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.519 -0.309 . . . . 1.0 110.412 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -127.8 165.27 20.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.421 0.629 . . . . 1.0 110.343 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 55.6 m -69.92 -179.11 1.74 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.96 -1.018 . . . . 1.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 138' ' ' ASN . . . . . 0.45 ' CB ' HH21 ' A' ' 140' ' ' ARG . 15.4 m120 55.92 19.6 3.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.555 -1.202 . . . . 1.0 109.466 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.569 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 17.4 m-85 37.67 77.22 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.593 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.45 HH21 ' CB ' ' A' ' 138' ' ' ASN . 76.9 mtm180 -145.22 41.98 1.28 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.029 0.442 . . . . 1.0 110.637 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -154.5 -145.78 4.25 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 111.397 -0.681 . . . . 1.0 111.397 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.28 164.31 25.95 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.835 -0.432 . . . . 1.0 109.835 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.534 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.43 137.47 30.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.395 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -129.9 139.74 51.08 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.086 -0.709 . . . . 1.0 109.086 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.53 ' C ' HD22 ' A' ' 146' ' ' LEU . 43.1 tp -93.18 125.76 37.94 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.494 0.664 . . . . 1.0 111.959 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.814 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.4 mm? -112.42 98.39 7.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.751 -1.113 . . . . 1.0 108.758 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.516 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -75.8 164.18 62.19 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 109.9 -0.407 . . . . 1.0 109.9 -179.203 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -58.68 118.62 5.53 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 C-N-CA 120.665 0.91 . . . . 1.0 110.445 178.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 171.7 -155.58 24.28 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.59 -1.004 . . . . 1.0 110.59 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -125.56 135.07 51.84 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.805 0.336 . . . . 1.0 110.766 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.487 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.8 m-85 -125.26 130.56 52.3 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.161 -0.472 . . . . 1.0 109.849 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -115.81 -2.74 12.31 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.828 0.347 . . . . 1.0 110.087 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -156.78 159.91 38.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.579 0.704 . . . . 1.0 110.088 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.407 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 7.7 p90 -73.68 -19.85 60.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.639 -1.164 . . . . 1.0 112.201 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.32 -19.6 63.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.368 -0.378 . . . . 1.0 111.402 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -51.33 -47.82 62.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.944 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 27.2 p90 -95.82 22.67 7.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.954 0.406 . . . . 1.0 110.654 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.56 74.4 0.29 Allowed Glycine 0 CA--C 1.52 0.384 0 N-CA-C 111.248 -0.741 . . . . 1.0 111.248 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.644 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.06 148.31 43.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.525 0.678 . . . . 1.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 160' ' ' THR . . . . . 0.459 HG22 ' H ' ' A' ' 160' ' ' THR . 0.0 OUTLIER -75.77 -25.67 56.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.277 -1.329 . . . . 1.0 109.874 177.7 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -158.15 -171.19 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.042 0.449 . . . . 1.0 110.508 179.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.734 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -107.59 -18.17 13.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.693 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -37.71 118.88 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.85 0.357 . . . . 1.0 111.866 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 162' ' ' ALA . 18.9 t -122.36 159.38 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 115.858 -0.61 . . . . 1.0 109.65 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.484 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -136.72 -34.88 0.21 Allowed Glycine 0 N--CA 1.462 0.4 0 N-CA-C 111.207 -0.757 . . . . 1.0 111.207 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.4 p -158.11 -174.06 4.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.847 0.356 . . . . 1.0 110.109 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -169.53 137.56 1.81 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.143 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.569 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 12.4 ptp180 -133.17 154.45 50.61 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.605 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -84.84 152.35 23.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.962 -0.563 . . . . 1.0 109.653 178.428 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.829 ' C ' HD12 ' A' ' 171' ' ' ILE . 47.3 t -88.01 83.13 2.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.262 -0.426 . . . . 1.0 111.559 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.829 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.0 mp -138.62 120.79 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.336 179.014 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -67.35 -39.58 85.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.684 -0.689 . . . . 1.0 110.48 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -70.05 -91.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.655 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 118.067 -0.968 . . . . 1.0 110.465 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.37 -0.604 . . . . 1.0 109.37 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.525 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -173.64 179.2 45.17 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.602 -0.999 . . . . 1.0 110.602 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -169.67 138.63 1.89 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.29 -0.263 . . . . 1.0 110.29 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -147.03 168.77 4.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.337 -0.392 . . . . 1.0 110.786 179.474 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.1 m -128.39 120.67 27.41 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.325 -0.991 . . . . 1.0 108.325 175.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.25 132.77 50.15 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.318 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.49 ' CE1' HG22 ' A' ' 5' ' ' THR . 60.7 m-85 -115.35 125.9 53.77 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.331 -0.849 . . . . 1.0 110.883 -178.669 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -53.96 -27.37 30.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.613 -0.721 . . . . 1.0 110.633 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -119.48 154.57 33.58 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.119 0.485 . . . . 1.0 110.142 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 12' ' ' PHE . 32.4 ptt85 -59.39 -172.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.515 -0.766 . . . . 1.0 110.266 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.65 25.49 0.2 Allowed Glycine 0 N--CA 1.461 0.304 0 N-CA-C 111.008 -0.837 . . . . 1.0 111.008 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 7.8 m-85 51.69 69.01 0.71 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.062 -0.348 . . . . 1.0 110.062 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -131.17 -158.83 0.92 Allowed 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.008 0.432 . . . . 1.0 110.635 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.57 -151.96 0.43 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.875 -0.89 . . . . 1.0 110.875 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -68.97 146.81 52.43 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.961 -0.296 . . . . 1.0 110.621 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -136.48 150.29 48.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.221 0.534 . . . . 1.0 110.196 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -143.78 142.09 30.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.396 -0.82 . . . . 1.0 110.089 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.7 tt0 -110.48 122.18 47.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.958 -0.564 . . . . 1.0 110.313 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.22 127.91 55.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.456 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 79.4 p -118.66 12.99 13.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.407 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 54.9 m -158.63 172.71 17.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.543 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 46.8 p-10 -62.3 137.49 58.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.572 -0.74 . . . . 1.0 111.279 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.82 149.17 52.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.783 -0.644 . . . . 1.0 110.093 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 p -119.46 -18.4 8.51 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.26 -0.882 . . . . 1.0 112.196 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -143.54 109.52 5.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.994 0.426 . . . . 1.0 110.074 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.406 ' O ' ' N ' ' A' ' 30' ' ' LEU . 19.8 mt -116.17 -5.57 11.88 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.735 -0.666 . . . . 1.0 110.421 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.623 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -45.33 -52.45 21.69 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.889 -0.596 . . . . 1.0 109.92 178.631 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.623 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.3 Cg_endo -54.19 -30.29 60.54 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 C-N-CA 121.97 1.78 . . . . 1.0 111.767 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.529 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -96.27 -55.14 3.04 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.843 0.354 . . . . 1.0 110.273 -178.832 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.4 mt -117.4 125.28 50.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.867 -0.606 . . . . 1.0 110.274 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -93.59 -9.77 36.97 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.825 -0.625 . . . . 1.0 111.752 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.476 ' CD ' HD21 ' A' ' 34' ' ' ASN . 43.5 ttm180 -147.32 -63.71 0.28 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.737 -178.228 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 51.8 t 71.01 83.61 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.31 0.381 . . . . 1.0 110.06 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.476 HD21 ' CD ' ' A' ' 32' ' ' ARG . 92.1 m-20 -97.29 5.74 49.47 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.945 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.553 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 2.0 t -160.32 158.05 29.07 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.67 -0.412 . . . . 1.0 109.978 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.99 155.37 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.048 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.6 mtp85 -133.54 121.66 22.44 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 108.506 -0.924 . . . . 1.0 108.506 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -107.51 117.78 53.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.397 0.618 . . . . 1.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -77.24 -43.64 32.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.91 -1.041 . . . . 1.0 110.508 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.4 t -163.38 162.89 25.16 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.31 176.33 48.58 Favored Glycine 0 C--N 1.317 -0.508 0 N-CA-C 110.982 -0.847 . . . . 1.0 110.982 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.4 m -112.09 126.29 55.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.571 -0.529 . . . . 1.0 109.571 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.667 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 50.8 m95 -115.31 149.28 38.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.856 -0.611 . . . . 1.0 111.091 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.695 ' C ' HD23 ' A' ' 45' ' ' LEU . 2.1 ttt -128.46 133.27 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.408 -0.814 . . . . 1.0 109.592 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.695 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -110.84 140.33 45.38 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.761 -178.804 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.401 ' CD1' ' N ' ' A' ' 46' ' ' TYR . 27.5 m-85 -113.48 132.38 55.68 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.269 0.556 . . . . 1.0 110.898 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.572 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.2 pt-20 -60.34 -36.19 77.41 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.539 -0.755 . . . . 1.0 110.263 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -100.87 151.53 37.63 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.286 -0.87 . . . . 1.0 110.038 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -55.32 149.77 44.44 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 121.792 1.662 . . . . 1.0 110.689 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.602 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.5 m-20 71.24 -116.88 0.08 Allowed 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.572 -0.899 . . . . 1.0 108.572 -177.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -151.74 70.92 0.96 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.778 -0.646 . . . . 1.0 109.884 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -138.08 15.4 2.84 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.82 0.343 . . . . 1.0 110.903 -178.271 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.8 -176.66 14.5 Favored Glycine 0 C--N 1.321 -0.285 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.572 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.5 tp -51.75 150.0 4.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -123.87 153.39 41.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.911 0.386 . . . . 1.0 110.877 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -132.46 125.9 31.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.159 178.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.403 ' C ' HD12 ' A' ' 58' ' ' LEU . 52.8 t80 -83.9 124.02 30.55 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.255 -0.429 . . . . 1.0 110.414 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.403 HD12 ' C ' ' A' ' 57' ' ' PHE . 7.3 mp -121.15 146.86 46.32 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.351 0.596 . . . . 1.0 110.383 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.402 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtp180 -132.67 160.41 36.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.108 -0.951 . . . . 1.0 110.562 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 59' ' ' ARG . 79.6 ttt-85 -38.47 125.04 1.34 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.617 -0.719 . . . . 1.0 110.441 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.59 -179.73 32.2 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.382 -1.087 . . . . 1.0 110.382 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -114.63 131.8 56.59 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.866 0.365 . . . . 1.0 110.297 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.11 113.34 17.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.049 -0.523 . . . . 1.0 109.851 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.32 -4.18 56.09 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.416 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 72.1 m-20 -147.43 141.99 26.53 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.534 ' CD2' ' OD1' ' A' ' 74' ' ' ASP . 15.5 p-80 -62.12 -41.75 98.55 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.466 . . . . 1.0 111.215 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -53.73 -6.51 0.08 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.702 -0.681 . . . . 1.0 110.363 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.502 ' H ' ' C ' ' A' ' 66' ' ' HIS . 19.4 mm-40 -83.66 -34.86 24.92 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.613 -0.435 . . . . 1.0 111.354 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.489 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -94.13 18.21 11.19 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.668 -0.413 . . . . 1.0 110.901 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.626 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 4.2 mtt 80.03 17.23 0.72 Allowed 'General case' 0 C--N 1.338 0.096 0 O-C-N 123.593 0.558 . . . . 1.0 110.774 -178.2 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.48 99.17 0.14 Allowed Glycine 0 C--N 1.341 0.855 0 N-CA-C 110.097 -1.201 . . . . 1.0 110.097 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.481 HD12 HD21 ' A' ' 54' ' ' LEU . 27.4 mt -67.41 -34.27 76.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.764 -0.458 . . . . 1.0 109.764 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.538 ' C ' ' H ' ' A' ' 75' ' ' SER . 30.9 t -130.86 129.34 42.18 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.927 -0.398 . . . . 1.0 109.927 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.534 ' OD1' ' CD2' ' A' ' 66' ' ' HIS . 1.8 m-20 -66.84 39.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.363 -0.381 . . . . 1.0 110.817 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.538 ' H ' ' C ' ' A' ' 73' ' ' SER . 40.9 t -115.22 123.8 49.78 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.499 -0.556 . . . . 1.0 109.499 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -149.83 103.12 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -115.65 4.2 14.06 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 120.667 0.27 . . . . 1.0 111.514 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.7 p -162.84 160.93 25.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.058 0.456 . . . . 1.0 110.584 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.77 148.29 22.43 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.577 -0.738 . . . . 1.0 110.605 -178.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.592 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.5 ptm180 -128.18 150.03 50.18 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 110.027 -0.361 . . . . 1.0 110.027 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.77 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.6 tt -101.8 124.27 47.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.887 -0.783 . . . . 1.0 108.887 178.51 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.77 ' N ' HD23 ' A' ' 81' ' ' LEU . 6.4 mt -85.34 116.09 64.07 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 115.99 -0.55 . . . . 1.0 109.974 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -52.59 148.52 27.09 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.364 2.043 . . . . 1.0 113.107 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -71.64 -179.46 2.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.402 -0.817 . . . . 1.0 110.471 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.9 t -167.06 143.0 4.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.797 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -83.92 -69.41 1.38 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 110.086 -1.206 . . . . 1.0 110.086 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.3 m -89.61 157.13 18.16 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.712 -0.477 . . . . 1.0 109.712 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -134.91 120.01 18.74 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 121.116 -0.233 . . . . 1.0 110.932 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -146.55 133.57 20.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.3 tt -147.2 150.53 14.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.605 -0.271 . . . . 1.0 110.494 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -126.5 98.11 5.29 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.947 -0.57 . . . . 1.0 111.697 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.11 129.81 38.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.537 . . . . 1.0 110.136 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.571 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 46.1 m-85 -107.68 136.53 47.28 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.363 -0.835 . . . . 1.0 110.944 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.528 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.91 -69.45 0.16 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.832 -0.622 . . . . 1.0 111.761 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 33.2 mtt-85 -96.85 176.44 5.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.744 -0.662 . . . . 1.0 110.892 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.673 ' O ' ' O ' ' A' ' 97' ' ' ASP . 59.1 mp0 -61.73 158.52 15.42 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.391 -0.822 . . . . 1.0 109.445 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.78 ' O ' ' N ' ' A' ' 99' ' ' ARG . 77.8 m-20 49.15 124.35 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.705 0 O-C-N 124.269 0.981 . . . . 1.0 108.382 -178.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.506 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.4 OUTLIER -44.53 72.8 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.781 -0.645 . . . . 1.0 110.954 -177.056 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.78 ' N ' ' O ' ' A' ' 97' ' ' ASP . 7.4 tpt85 -121.62 -64.59 1.2 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.171 0.51 . . . . 1.0 110.838 -178.157 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.443 ' O ' ' O ' ' A' ' 99' ' ' ARG . . . -51.96 -171.08 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 -179.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -58.42 148.58 27.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.037 -0.357 . . . . 1.0 110.037 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.571 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 7.9 ttp -131.63 152.42 50.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.995 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.475 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.1 tt -146.92 141.67 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.171 -0.678 . . . . 1.0 109.171 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -111.29 141.55 44.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.406 0.622 . . . . 1.0 110.466 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.86 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 79.7 m-85 -129.42 153.53 47.84 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 114.714 -1.13 . . . . 1.0 110.42 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -141.66 29.9 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.641 -0.708 . . . . 1.0 110.738 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -170.94 -167.81 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.461 -0.495 . . . . 1.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.438 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 55.3 p-10 -76.83 144.83 38.82 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.69 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 6.2 m -135.02 89.43 2.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.997 -0.547 . . . . 1.0 109.779 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.1 m -64.46 -36.35 83.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.834 0.349 . . . . 1.0 111.454 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.0 m -131.65 84.96 2.21 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.426 0.631 . . . . 1.0 110.323 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.86 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.4 tp -59.27 -38.95 81.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.097 -0.956 . . . . 1.0 110.019 -178.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.648 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.5 mp0 -43.45 -9.64 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.281 -0.418 . . . . 1.0 111.511 178.652 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.587 ' N ' ' O ' ' A' ' 112' ' ' LEU . 87.2 m-20 -93.89 -21.94 18.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.982 0.42 . . . . 1.0 110.86 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.4 mmt180 -110.11 -38.65 5.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.974 -0.557 . . . . 1.0 112.383 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.729 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -118.95 137.28 53.6 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.756 1.265 . . . . 1.0 111.142 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 118' ' ' PHE . 84.5 mmt-85 -73.78 -74.32 0.19 Allowed 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.275 -1.516 . . . . 1.0 110.364 -178.531 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.686 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 91.5 m-85 -31.53 143.65 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 123.499 0.499 . . . . 1.0 110.598 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -104.73 11.69 33.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 1.0 110.726 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -140.0 139.38 36.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.237 0.541 . . . . 1.0 110.902 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.675 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 44.4 mm -120.41 123.46 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.369 -0.832 . . . . 1.0 109.51 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.447 ' O ' ' CB ' ' A' ' 123' ' ' SER . 20.4 m-70 -110.8 22.25 15.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.516 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.591 ' C ' HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER 165.2 157.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.921 -0.312 . . . . 1.0 110.479 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.699 ' N ' HD13 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -158.91 164.01 36.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.184 179.745 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -130.46 103.4 6.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.284 -0.636 . . . . 1.0 109.284 179.392 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.519 HG13 ' H ' ' A' ' 149' ' ' GLY . 0.6 OUTLIER -101.4 110.42 28.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.7 -0.852 . . . . 1.0 108.7 179.234 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.955 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.3 OUTLIER -81.66 -39.22 24.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.419 -0.809 . . . . 1.0 111.249 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.484 ' O ' ' O ' ' A' ' 129' ' ' GLY . 43.6 mm-40 -121.53 160.34 24.46 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.372 0.606 . . . . 1.0 111.039 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 34.62 -159.4 0.01 OUTLIER Glycine 0 CA--C 1.53 1.016 0 CA-C-N 114.191 -1.368 . . . . 1.0 110.993 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 1.7 t -120.26 -175.93 3.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.994 0.426 . . . . 1.0 109.891 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 130' ' ' SER . 75.0 m95 -150.71 168.97 22.75 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.269 -178.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 57.5 t -137.42 131.44 44.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.534 -0.543 . . . . 1.0 109.534 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.07 143.0 33.86 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 110.205 -0.295 . . . . 1.0 110.205 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 134' ' ' TYR . . . . . 0.526 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 14.2 m-85 -119.17 133.22 55.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.445 -0.343 . . . . 1.0 110.088 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.421 ' OE2' ' O ' ' A' ' 135' ' ' GLU . 4.3 tm-20 -50.89 -29.86 13.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.088 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -139.79 176.7 8.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.119 0.485 . . . . 1.0 110.107 -179.523 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.2 m -82.8 171.76 13.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.329 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 10.1 m120 64.78 18.33 11.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.114 -0.948 . . . . 1.0 110.247 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.455 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 3.2 m-85 37.39 79.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.663 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 50.4 ttm-85 -148.55 37.51 0.83 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.968 0.414 . . . . 1.0 110.422 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -149.36 -144.33 3.93 Favored Glycine 0 CA--C 1.521 0.442 0 N-CA-C 111.333 -0.707 . . . . 1.0 111.333 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -73.01 159.06 34.25 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.077 -0.342 . . . . 1.0 110.077 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.626 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 88.6 mt-30 -138.81 134.6 33.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.007 -0.542 . . . . 1.0 111.047 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -129.65 140.72 51.08 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.291 -0.633 . . . . 1.0 109.291 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.53 ' C ' HD22 ' A' ' 146' ' ' LEU . 43.1 tp -95.95 128.37 42.78 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.725 0.641 . . . . 1.0 110.588 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.862 HD22 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -113.45 96.92 6.14 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.971 -1.013 . . . . 1.0 109.764 179.73 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.592 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.6 OUTLIER -68.89 154.57 94.77 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 114.89 -1.05 . . . . 1.0 110.235 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 148' ' ' PRO . . . . . 0.452 ' HA ' HG13 ' A' ' 126' ' ' VAL . 18.5 Cg_endo -56.55 112.97 1.25 Allowed 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.233 1.955 . . . . 1.0 111.372 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.519 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 176.06 -150.83 10.98 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.421 -1.072 . . . . 1.0 110.421 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -128.66 125.76 38.74 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.298 -0.451 . . . . 1.0 111.175 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.551 ' CD1' ' CD2' ' A' ' 124' ' ' LEU . 3.8 m-85 -117.66 128.38 54.86 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.315 -0.624 . . . . 1.0 109.315 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -107.47 -5.22 17.76 Favored 'General case' 0 CA--C 1.518 -0.25 0 O-C-N 123.685 0.616 . . . . 1.0 110.797 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -154.13 172.22 17.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.688 -0.687 . . . . 1.0 110.545 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.443 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 26.6 p90 -85.21 -21.82 28.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.097 -0.956 . . . . 1.0 112.495 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -64.53 -23.29 67.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.006 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 156' ' ' ASP . . . . . 0.505 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.3 t0 -44.2 -54.33 5.74 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.946 0.403 . . . . 1.0 111.068 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.671 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 28.7 p90 -92.67 24.13 3.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.753 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 50.39 75.23 0.22 Allowed Glycine 0 CA--C 1.52 0.383 0 N-CA-C 111.217 -0.753 . . . . 1.0 111.217 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.671 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.65 145.67 46.26 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.884 -0.413 . . . . 1.0 109.884 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.7 t -76.23 -10.73 59.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.92 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.503 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 30.2 t-20 -171.95 -164.53 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.449 -0.5 . . . . 1.0 110.156 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.871 ' O ' HG23 ' A' ' 164' ' ' VAL . . . -112.13 -16.42 13.03 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 116.37 -0.377 . . . . 1.0 110.328 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.437 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.7 mtt180 -30.12 116.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.285 0.365 . . . . 1.0 111.751 -178.407 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.871 HG23 ' O ' ' A' ' 162' ' ' ALA . 57.6 t -126.43 162.9 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.135 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.609 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -146.07 -34.85 0.06 OUTLIER Glycine 0 CA--C 1.516 0.133 0 N-CA-C 111.604 -0.598 . . . . 1.0 111.604 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 11.6 p -160.19 173.0 16.4 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 120.932 0.396 . . . . 1.0 110.753 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.614 HD21 HD13 ' A' ' 112' ' ' LEU . 1.1 pt? -158.59 154.19 26.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 1.0 112.186 -179.457 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.526 ' NE ' ' OH ' ' A' ' 134' ' ' TYR . 17.0 ptp180 -145.35 153.49 41.29 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.409 -0.517 . . . . 1.0 110.441 178.766 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.441 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -82.04 149.14 28.25 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.43 -0.581 . . . . 1.0 109.43 177.805 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.795 ' C ' HD12 ' A' ' 171' ' ' ILE . 25.9 m -81.73 78.12 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.373 0.606 . . . . 1.0 112.416 -178.412 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.795 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.9 mp -128.42 125.92 64.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 O-C-N 121.834 -0.541 . . . . 1.0 110.181 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.46 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 40.0 p-10 -70.69 -34.04 71.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.522 -0.763 . . . . 1.0 110.241 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.46 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 92.2 m-85 -68.13 -91.7 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.308 -0.406 . . . . 1.0 110.736 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 23.4 p . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.029 -0.986 . . . . 1.0 110.582 -179.99 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.331 -0.618 . . . . 1.0 109.331 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.97 171.91 37.13 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.456 -1.057 . . . . 1.0 110.456 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.553 ' NZ ' ' OE2' ' A' ' 18' ' ' GLU . 59.5 tttm -173.18 102.16 0.13 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.534 0.206 . . . . 1.0 110.66 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.409 HD13 ' O ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER -119.6 169.87 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.853 -178.385 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.489 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.6 m -129.37 123.27 31.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.41 -0.959 . . . . 1.0 108.41 177.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.6 mt -107.83 133.09 52.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.941 -1.027 . . . . 1.0 110.184 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.489 ' CE1' HG22 ' A' ' 5' ' ' THR . 47.9 m-85 -115.36 126.22 54.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.346 -0.843 . . . . 1.0 111.111 -178.846 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -52.9 -32.96 48.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.626 -0.715 . . . . 1.0 110.664 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -115.42 150.0 37.11 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.304 0.574 . . . . 1.0 110.481 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' C ' ' N ' ' A' ' 12' ' ' PHE . 20.1 ptt-85 -54.93 -173.32 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.613 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.32 23.22 0.26 Allowed Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.427 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.3 m-85 52.78 68.24 0.86 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.482 -0.359 . . . . 1.0 110.287 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -130.41 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.0 0.429 . . . . 1.0 110.516 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.82 -150.76 0.25 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.943 -0.863 . . . . 1.0 110.943 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -69.71 146.9 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.804 0.335 . . . . 1.0 110.622 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 19.2 p80 -136.26 144.14 44.64 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.279 0.561 . . . . 1.0 110.433 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.556 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.2 t80 -137.81 141.52 40.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.309 -0.86 . . . . 1.0 109.893 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.556 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 17.2 tt0 -111.22 122.17 47.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.368 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.8 126.3 53.64 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.627 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -117.99 13.33 13.92 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.745 -0.662 . . . . 1.0 110.377 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.0 m -158.21 168.18 27.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.647 -178.693 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.34 140.64 53.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.534 -0.757 . . . . 1.0 111.211 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.88 153.1 49.59 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.534 -0.757 . . . . 1.0 110.601 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.7 p -120.88 -11.46 8.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.437 -0.801 . . . . 1.0 112.4 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 24.4 t-20 -150.15 116.44 5.72 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.42 0.629 . . . . 1.0 110.897 -179.206 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.426 ' O ' ' N ' ' A' ' 30' ' ' LEU . 6.5 mp -110.4 -3.11 16.29 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.483 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.589 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 35.8 mt-30 -52.95 -51.23 76.52 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.948 -0.301 . . . . 1.0 110.597 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.589 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 17.1 Cg_endo -54.76 -35.93 89.23 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 121.274 1.316 . . . . 1.0 112.292 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -94.81 -51.31 4.75 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 120.177 -0.609 . . . . 1.0 111.001 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.426 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.2 mt -118.19 127.61 53.91 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.618 -0.719 . . . . 1.0 110.824 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.3 t -94.24 -10.41 33.03 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.76 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -145.7 -58.79 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.749 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 41.0 t 62.58 80.73 0.22 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 70.5 m-80 -96.57 4.78 51.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.573 -0.285 . . . . 1.0 111.245 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.6 p -155.88 157.6 36.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.864 0.364 . . . . 1.0 110.368 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.71 154.71 34.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.967 -178.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -134.79 123.32 23.4 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.732 -0.84 . . . . 1.0 108.732 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.4 t -108.75 133.5 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -96.74 -41.48 8.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.367 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.8 p -160.85 157.28 26.4 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.99 176.28 49.38 Favored Glycine 0 C--N 1.315 -0.583 0 N-CA-C 110.924 -0.87 . . . . 1.0 110.924 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.9 m -112.55 147.19 37.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.403 ' CE2' HD13 ' A' ' 81' ' ' LEU . 51.8 m95 -132.46 151.28 51.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 1.0 110.776 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.563 ' C ' HD12 ' A' ' 45' ' ' LEU . 13.9 tpp -124.19 129.01 50.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.133 -1.062 . . . . 1.0 108.133 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.564 HD23 HG21 ' A' ' 76' ' ' VAL . 10.4 mp -109.81 131.46 55.04 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.101 -0.499 . . . . 1.0 109.858 -179.051 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -109.19 129.52 55.49 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.899 0.38 . . . . 1.0 111.927 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 19.7 pt-20 -53.61 -32.32 50.68 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.418 -0.81 . . . . 1.0 111.097 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.758 ' CG ' ' H ' ' A' ' 53' ' ' GLY . 20.0 pt20 -113.83 156.72 43.4 Favored Pre-proline 0 CA--C 1.514 -0.404 0 N-CA-C 109.442 -0.577 . . . . 1.0 109.442 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -56.39 147.39 68.28 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 121.127 1.218 . . . . 1.0 111.968 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.527 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 0.9 OUTLIER 82.88 -124.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.279 -1.328 . . . . 1.0 109.588 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.3 m-85 -150.12 75.05 1.23 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.052 179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.459 ' CB ' ' NE2' ' A' ' 48' ' ' GLN . 0.4 OUTLIER -134.78 -56.52 0.83 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 112.455 0.539 . . . . 1.0 112.455 -178.01 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.758 ' H ' ' CG ' ' A' ' 48' ' ' GLN . . . -61.97 -163.05 0.26 Allowed Glycine 0 C--N 1.314 -0.677 0 C-N-CA 120.07 -1.062 . . . . 1.0 111.305 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.497 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.7 tp -59.02 147.61 33.94 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.908 -0.646 . . . . 1.0 110.143 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -121.34 149.8 42.4 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.994 0.184 . . . . 1.0 110.864 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.45 ' O ' ' SD ' ' A' ' 44' ' ' MET . 22.0 m-85 -126.51 127.1 44.81 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.151 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.467 ' C ' HD22 ' A' ' 58' ' ' LEU . 55.9 t80 -81.71 121.63 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.558 0.694 . . . . 1.0 109.692 -179.426 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 ' C ' ' A' ' 57' ' ' PHE . 4.0 mm? -111.87 132.57 54.63 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 114.769 -1.105 . . . . 1.0 109.77 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.7 ttp180 -127.96 156.03 43.32 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.287 -0.869 . . . . 1.0 109.746 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.529 ' NH1' ' O ' ' A' ' 172' ' ' ASP . 36.9 ptt180 -37.35 126.87 1.05 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.763 -0.653 . . . . 1.0 111.454 -178.376 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.9 -178.3 30.09 Favored Glycine 0 CA--C 1.521 0.459 0 N-CA-C 111.166 -0.773 . . . . 1.0 111.166 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.0 p-10 -116.43 127.48 54.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.094 0.474 . . . . 1.0 110.335 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -121.47 113.27 19.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.272 -0.64 . . . . 1.0 109.272 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.432 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.49 -4.6 53.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.381 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 81.9 m-20 -147.89 133.53 18.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.137 -0.69 . . . . 1.0 109.137 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.5 ' C ' ' H ' ' A' ' 68' ' ' GLN . 16.1 p-80 -56.17 -40.97 74.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 1.0 111.127 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLN . . . . . 0.431 ' HG3' ' CE1' ' A' ' 66' ' ' HIS . 93.5 mt-30 -51.93 -8.36 0.07 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.537 179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.2 mm-40 -84.39 -32.93 23.91 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.838 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -96.57 17.94 15.22 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 121.021 -0.272 . . . . 1.0 111.43 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.436 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 41.1 mtt 82.9 9.86 0.62 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 123.941 0.775 . . . . 1.0 109.815 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.406 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -57.85 101.43 0.18 Allowed Glycine 0 C--N 1.343 0.964 0 C-N-CA 120.306 -0.949 . . . . 1.0 111.218 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.4 mt -77.83 -40.78 39.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.429 -0.582 . . . . 1.0 109.429 176.637 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 80.4 p -114.25 113.32 24.45 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 120.902 0.382 . . . . 1.0 110.019 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 55.1 p-10 -71.64 50.65 0.18 Allowed 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.971 -0.559 . . . . 1.0 110.362 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.512 ' O ' ' C ' ' A' ' 76' ' ' VAL . 4.1 m -111.61 -44.65 3.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.511 -0.313 . . . . 1.0 111.195 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.564 HG21 HD23 ' A' ' 45' ' ' LEU . 1.4 p 14.92 95.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 124.129 0.893 . . . . 1.0 111.044 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 26' ' ' LEU . 89.8 mtm180 -110.68 9.43 22.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.271 -0.422 . . . . 1.0 110.692 -177.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.4 p -160.46 159.27 30.67 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.497 0.665 . . . . 1.0 110.968 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.9 p -154.66 146.49 23.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.081 -0.963 . . . . 1.0 110.356 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -127.67 146.4 50.57 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.795 0.331 . . . . 1.0 110.108 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.403 HD13 ' CE2' ' A' ' 43' ' ' TRP . 21.9 tp -94.44 126.76 39.91 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.451 -0.944 . . . . 1.0 108.451 178.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mt -91.32 114.94 63.35 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 109.222 -0.658 . . . . 1.0 109.222 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -51.23 149.4 16.43 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.087 1.858 . . . . 1.0 113.479 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -73.61 179.22 4.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.164 -0.926 . . . . 1.0 110.554 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 41.6 t -173.75 149.8 1.62 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.983 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -98.6 -50.55 1.52 Allowed Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.49 -1.044 . . . . 1.0 110.49 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 m -93.01 146.22 23.78 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.903 0.382 . . . . 1.0 110.157 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -137.26 112.2 8.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.803 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.466 ' HE ' HD23 ' A' ' 127' ' ' LEU . 61.4 ttp180 -140.18 135.02 31.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.699 0.285 . . . . 1.0 110.27 178.667 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.9 tt -148.93 145.76 17.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.929 -0.309 . . . . 1.0 110.813 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -126.14 97.37 5.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.73 -0.668 . . . . 1.0 111.352 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.95 142.57 39.98 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.166 0.508 . . . . 1.0 111.187 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -117.59 134.8 54.48 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.367 -0.833 . . . . 1.0 110.86 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.437 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.2 tm-20 -53.45 -61.79 2.07 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.568 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.442 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.4 mtp85 -100.33 170.48 8.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.364 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -47.46 155.89 0.32 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.713 -0.676 . . . . 1.0 110.43 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.408 ' C ' ' CD2' ' A' ' 98' ' ' TYR . 1.2 m-20 56.43 -96.12 0.06 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.424 -0.807 . . . . 1.0 110.031 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.408 ' CD2' ' C ' ' A' ' 97' ' ' ASP . 2.2 p90 -170.53 33.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.365 -0.534 . . . . 1.0 109.668 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.9 mtt85 -90.46 44.57 1.21 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.677 -0.692 . . . . 1.0 111.183 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -168.48 -169.89 32.48 Favored Glycine 0 C--N 1.313 -0.729 0 CA-C-N 115.258 -0.883 . . . . 1.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.78 145.11 53.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.815 0.34 . . . . 1.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.2 ptm -131.41 157.24 43.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.262 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.7 tt -148.98 142.85 18.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 109.989 -0.374 . . . . 1.0 109.989 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -113.62 142.41 46.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.447 0.642 . . . . 1.0 110.84 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -129.5 156.66 43.78 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 114.556 -1.202 . . . . 1.0 110.331 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.6 p -143.61 26.06 1.61 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.586 -0.734 . . . . 1.0 110.636 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -167.74 -166.82 0.78 Allowed 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.627 -0.429 . . . . 1.0 110.37 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.445 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 54.2 p-10 -77.11 143.92 38.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.792 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.2 m -133.16 92.85 3.08 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.949 -0.569 . . . . 1.0 109.793 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.421 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.0 OUTLIER -67.2 -27.69 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.469 -0.332 . . . . 1.0 111.323 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 13.6 m -136.84 96.45 3.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.25 0.548 . . . . 1.0 110.863 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.519 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.4 tp -64.58 -44.25 91.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.346 -0.843 . . . . 1.0 110.44 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.5 mm100 -47.87 -7.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.348 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.519 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.7 m-20 -96.21 -25.45 15.81 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.061 0.458 . . . . 1.0 110.318 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -108.78 -35.41 6.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.648 -0.705 . . . . 1.0 111.463 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.466 ' HB2' HD11 ' A' ' 112' ' ' LEU . 4.2 t80 -126.12 121.09 31.86 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.001 0.429 . . . . 1.0 109.898 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.3 mtt-85 -60.11 -65.92 0.6 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.225 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.437 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 94.0 m-85 -39.5 142.35 0.29 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -104.18 2.85 32.27 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.715 0.293 . . . . 1.0 111.345 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -131.72 137.4 48.23 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.241 0.543 . . . . 1.0 111.221 -178.073 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.68 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.5 mm -122.75 126.08 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.101 -0.954 . . . . 1.0 109.502 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 23.3 m-70 -113.64 18.13 17.74 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.105 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.0 p 173.84 153.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.987 0.422 . . . . 1.0 110.288 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.471 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.1 pp -162.75 156.71 20.68 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.443 -178.349 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -127.96 108.74 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.88 -0.6 . . . . 1.0 109.846 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.478 HG13 ' H ' ' A' ' 149' ' ' GLY . 0.7 OUTLIER -102.84 110.9 30.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.773 -0.825 . . . . 1.0 108.773 178.92 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.918 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -80.09 -39.25 30.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.033 -0.985 . . . . 1.0 111.158 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.512 ' O ' ' O ' ' A' ' 129' ' ' GLY . 66.3 mm-40 -137.6 169.15 18.27 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-O 121.853 0.835 . . . . 1.0 110.74 -179.011 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.83 177.58 0.01 OUTLIER Glycine 0 C--N 1.311 -0.853 0 CA-C-N 113.622 -1.626 . . . . 1.0 110.828 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -118.64 148.05 43.13 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.261 -0.644 . . . . 1.0 109.261 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.473 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 27.5 m95 -120.17 166.48 13.39 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.479 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.0 p -141.46 98.0 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.889 179.34 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.419 HD23 ' HB3' ' A' ' 167' ' ' LEU . 10.7 mt -66.78 141.1 57.84 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.418 -0.513 . . . . 1.0 111.299 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -117.75 131.65 56.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.636 . . . . 1.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -45.3 -49.76 12.47 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.432 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.784 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -123.82 170.48 10.51 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.206 0.527 . . . . 1.0 110.179 -178.45 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.5 p -75.43 174.79 9.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.236 -0.893 . . . . 1.0 110.898 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 60.01 16.63 6.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.467 -1.242 . . . . 1.0 110.037 -179.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 40.06 78.01 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.718 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.784 ' C ' HD11 ' A' ' 136' ' ' LEU . 96.4 mtt180 -146.58 44.85 1.21 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.73 0.3 . . . . 1.0 110.551 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.521 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -158.39 -139.42 2.69 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 111.187 -0.765 . . . . 1.0 111.187 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -78.19 169.04 18.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.024 0.44 . . . . 1.0 109.942 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.432 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -147.83 139.21 23.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.757 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.7 m-85 -129.07 139.71 51.89 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.363 -0.977 . . . . 1.0 108.363 177.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.635 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -94.35 126.17 39.44 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.056 0.455 . . . . 1.0 110.743 -178.498 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.842 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.4 mm? -112.26 101.82 10.02 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.635 -0.711 . . . . 1.0 109.237 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.584 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.98 159.37 68.59 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.645 -0.707 . . . . 1.0 109.729 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -54.29 120.76 8.52 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.276 1.984 . . . . 1.0 111.844 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.478 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 166.3 -159.09 32.3 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 110.734 -0.947 . . . . 1.0 110.734 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.487 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 67.8 t0 -119.47 135.21 54.86 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.192 -0.504 . . . . 1.0 110.645 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.487 ' N ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 m-85 -126.55 128.45 46.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.017 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -115.4 -5.53 12.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.991 0.424 . . . . 1.0 110.332 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -154.25 161.13 42.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.843 -0.617 . . . . 1.0 110.436 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.419 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -76.18 -20.32 57.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.898 -1.047 . . . . 1.0 112.443 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -68.97 -18.69 64.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.981 0.419 . . . . 1.0 111.021 -179.588 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -51.06 -49.04 61.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.973 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.716 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 16.0 p90 -97.29 21.86 9.46 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.244 -0.434 . . . . 1.0 110.568 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.05 74.83 0.26 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.009 -0.836 . . . . 1.0 111.009 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.716 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.94 149.24 41.23 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 121.034 0.445 . . . . 1.0 110.211 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -80.39 -10.5 59.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.014 178.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.525 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 5.6 t-20 -172.22 -170.52 0.74 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.456 -0.498 . . . . 1.0 110.406 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.68 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.72 -13.31 14.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.493 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 19.1 ptp180 -43.35 121.31 2.18 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.51 0.671 . . . . 1.0 111.504 -178.194 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 162' ' ' ALA . 38.5 t -133.08 131.85 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.422 -0.808 . . . . 1.0 109.876 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.65 -29.29 3.93 Favored Glycine 0 N--CA 1.464 0.529 0 N-CA-C 111.477 -0.649 . . . . 1.0 111.477 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 110' ' ' SER . 21.0 m -162.98 174.42 12.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.905 0.383 . . . . 1.0 110.988 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.419 ' HB3' HD23 ' A' ' 133' ' ' LEU . 0.4 OUTLIER -154.79 139.72 17.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 1.0 111.015 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.555 ' O ' HG12 ' A' ' 132' ' ' VAL . 2.0 ttm180 -129.28 144.81 51.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.59 0.71 . . . . 1.0 109.485 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.811 ' CD ' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -79.27 150.43 31.54 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.314 -1.312 . . . . 1.0 109.083 178.803 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.468 ' C ' HD12 ' A' ' 171' ' ' ILE . 58.3 t -90.21 81.23 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.927 0.394 . . . . 1.0 111.375 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.468 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.1 mp -135.95 120.15 25.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.529 ' O ' ' NH1' ' A' ' 60' ' ' ARG . 42.7 p-10 -71.52 -35.2 70.64 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.599 -0.728 . . . . 1.0 110.403 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.525 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 93.3 m-85 -58.49 -78.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.11 -0.496 . . . . 1.0 110.633 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 174' ' ' SER . . . . . 0.424 ' O ' ' NH2' ' A' ' 169' ' ' ARG . 38.8 m . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 117.977 -1.011 . . . . 1.0 110.557 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.169 -0.678 . . . . 1.0 109.169 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.516 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -174.09 172.97 45.73 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.534 -1.027 . . . . 1.0 110.534 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -171.11 111.32 0.35 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.107 -0.237 . . . . 1.0 110.734 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.441 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 171.18 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.173 0.511 . . . . 1.0 111.493 -178.854 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.46 HG22 ' CE1' ' A' ' 7' ' ' TYR . 31.0 m -128.16 120.34 27.11 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 177.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.5 mt -105.25 133.33 50.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.085 -0.961 . . . . 1.0 110.305 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.46 ' CE1' HG22 ' A' ' 5' ' ' THR . 73.5 m-85 -115.29 130.44 56.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.304 -178.429 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.453 ' O ' ' O ' ' A' ' 32' ' ' ARG . 84.0 tt0 -55.18 -24.22 25.82 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.643 -0.708 . . . . 1.0 110.244 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -124.94 161.81 25.83 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.302 0.572 . . . . 1.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 19.4 ptt180 -65.62 -173.81 0.17 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.47 -0.786 . . . . 1.0 111.048 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.8 25.25 0.57 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.815 -0.914 . . . . 1.0 110.815 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 51.6 67.85 0.89 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.648 -0.276 . . . . 1.0 110.312 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -129.64 -156.8 0.78 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.961 0.41 . . . . 1.0 110.523 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.43 -149.73 0.41 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -71.71 148.26 46.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.717 0.294 . . . . 1.0 110.577 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 7.8 p80 -135.98 149.72 48.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.391 0.615 . . . . 1.0 110.299 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.3 t80 -144.13 141.86 30.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.196 -0.911 . . . . 1.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.557 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.1 tt0 -110.57 121.38 45.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.467 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 t -108.85 126.01 52.6 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.943 0.401 . . . . 1.0 110.734 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 84.4 p -117.75 12.58 13.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.723 -0.672 . . . . 1.0 110.529 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -156.46 172.49 18.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.654 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -62.18 138.85 58.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.574 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.59 143.23 47.23 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.328 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.423 HG22 ' CE2' ' A' ' 51' ' ' TYR . 19.0 p -111.21 -17.41 13.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.774 -0.648 . . . . 1.0 112.067 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.5 t-20 -150.53 112.16 4.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.145 0.498 . . . . 1.0 110.208 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.0 mt -108.84 2.39 21.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 46.0 mt-30 -52.05 -51.57 70.06 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.214 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.3 Cg_endo -55.96 -34.97 93.62 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.509 1.473 . . . . 1.0 112.789 -178.722 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -91.27 -45.91 8.35 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.183 0.516 . . . . 1.0 110.807 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.7 mt -122.66 129.06 51.42 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.509 -0.768 . . . . 1.0 111.305 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -92.4 -14.67 28.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 8' ' ' GLU . 62.2 ttp180 -176.47 119.69 0.14 Allowed 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 108.745 -0.835 . . . . 1.0 108.745 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -99.2 112.97 25.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.677 0.275 . . . . 1.0 110.598 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -105.0 -4.44 22.04 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.598 0.237 . . . . 1.0 110.473 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.6 p -157.1 157.78 35.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.91 0.386 . . . . 1.0 110.552 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 154.79 34.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.069 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -132.81 122.06 23.9 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 108.783 -0.821 . . . . 1.0 108.783 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.18 115.89 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.276 0.56 . . . . 1.0 110.028 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -77.58 -42.18 36.14 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.936 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.5 t -163.6 159.86 22.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 109.223 -0.658 . . . . 1.0 109.223 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.17 177.5 50.91 Favored Glycine 0 C--N 1.315 -0.623 0 N-CA-C 111.057 -0.817 . . . . 1.0 111.057 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.5 m -112.62 141.27 46.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.344 -0.613 . . . . 1.0 109.344 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.613 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 55.0 m95 -130.37 141.01 50.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.145 0.497 . . . . 1.0 110.903 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.549 ' C ' HD12 ' A' ' 45' ' ' LEU . 12.6 tpp -114.86 130.81 56.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.55 -0.75 . . . . 1.0 109.457 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.549 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -109.34 130.25 55.5 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.796 -0.638 . . . . 1.0 109.448 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.426 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 90.2 m-85 -109.71 133.42 53.15 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.429 0.633 . . . . 1.0 111.671 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.625 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.55 -35.57 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.259 -0.882 . . . . 1.0 111.402 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.8 mt-30 -109.42 152.83 42.92 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.562 -179.009 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.439 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 35.0 Cg_endo -63.59 158.68 44.58 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.446 2.097 . . . . 1.0 112.493 178.393 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 63.84 37.03 9.97 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.937 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.426 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.2 m-85 50.06 76.12 0.15 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.306 -0.861 . . . . 1.0 111.108 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.6 m -144.04 153.12 41.87 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.009 0.433 . . . . 1.0 110.313 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 -148.63 21.77 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.053 -0.594 . . . . 1.0 111.88 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.625 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.8 tp -75.58 143.74 42.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.368 -0.416 . . . . 1.0 110.59 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.573 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.6 OUTLIER -120.18 153.25 36.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.581 0.229 . . . . 1.0 110.486 179.543 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.425 ' O ' ' SD ' ' A' ' 44' ' ' MET . 29.6 m-85 -126.45 124.63 40.58 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.932 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -83.8 122.51 28.77 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.178 0.513 . . . . 1.0 110.146 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 mp -119.85 145.36 46.73 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.636 -0.711 . . . . 1.0 109.973 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.642 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 68.4 mtm180 -132.26 158.57 41.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.541 -0.754 . . . . 1.0 109.949 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.413 ' C ' ' O ' ' A' ' 59' ' ' ARG . 61.6 ttp180 -36.1 126.48 0.75 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.032 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.61 -178.89 32.83 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.501 -1.039 . . . . 1.0 110.501 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -115.31 129.46 56.61 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.008 0.432 . . . . 1.0 110.154 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -123.53 113.04 18.2 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.996 -0.547 . . . . 1.0 109.538 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.89 -3.75 54.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.249 -0.432 . . . . 1.0 111.654 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -146.6 137.22 23.94 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.971 -0.751 . . . . 1.0 108.971 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.446 ' C ' ' H ' ' A' ' 68' ' ' GLN . 9.9 p-80 -57.98 -41.64 83.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 1.0 110.694 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.63 -8.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.807 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 66' ' ' HIS . 22.8 mm-40 -81.57 -34.09 31.25 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.647 -0.421 . . . . 1.0 111.317 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.41 ' O ' ' HB2' ' A' ' 70' ' ' MET . 2.5 p90 -94.75 17.41 13.58 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.871 -0.331 . . . . 1.0 110.86 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.45 ' C ' ' H ' ' A' ' 72' ' ' LEU . 58.2 mtt 72.71 28.99 2.04 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 124.209 0.943 . . . . 1.0 110.128 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.599 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -72.54 39.51 0.75 Allowed Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.667 -0.777 . . . . 1.0 111.599 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.487 ' C ' ' O ' ' A' ' 71' ' ' GLY . 12.1 mt -17.87 -46.21 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 124.27 0.63 . . . . 1.0 111.116 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.599 ' N ' ' O ' ' A' ' 71' ' ' GLY . 55.8 m -106.53 116.54 32.11 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.857 -0.794 . . . . 1.0 108.857 177.675 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 55.1 p-10 -67.44 38.14 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.398 -0.365 . . . . 1.0 110.984 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.533 ' H ' ' C ' ' A' ' 73' ' ' SER . 49.9 m -116.09 125.73 52.79 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.714 -0.476 . . . . 1.0 109.714 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.3 p -163.24 115.11 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.981 -0.748 . . . . 1.0 108.981 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.439 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.3 mtm-85 -123.23 12.29 9.51 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.003 -0.544 . . . . 1.0 111.468 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.1 p -163.38 163.13 25.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.182 0.515 . . . . 1.0 110.592 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.4 p -157.58 148.37 21.19 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.489 -0.778 . . . . 1.0 110.546 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -128.08 150.18 50.07 Favored 'General case' 0 CA--C 1.513 -0.442 0 N-CA-C 109.844 -0.428 . . . . 1.0 109.844 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.713 HD23 ' N ' ' A' ' 82' ' ' ILE . 3.7 tt -101.69 121.71 42.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.825 -1.176 . . . . 1.0 107.825 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.713 ' N ' HD23 ' A' ' 81' ' ' LEU . 7.2 mt -86.08 120.41 72.45 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.011 -178.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -50.41 146.08 19.95 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 121.598 1.532 . . . . 1.0 113.077 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.449 ' O ' ' O ' ' A' ' 85' ' ' SER . 27.1 p80 -64.19 -24.39 67.66 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 114.903 -1.044 . . . . 1.0 111.26 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.449 ' O ' ' O ' ' A' ' 84' ' ' HIS . 14.4 t 53.35 165.65 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.374 -0.83 . . . . 1.0 111.059 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.451 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . -106.35 -89.22 2.09 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.529 -1.028 . . . . 1.0 110.529 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.7 p -77.92 158.53 29.34 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 109.881 -0.414 . . . . 1.0 109.881 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.451 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 1.6 m170 -127.58 102.48 6.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.895 0.332 . . . . 1.0 111.895 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 57.1 mtt180 -136.06 138.21 41.9 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.669 -0.413 . . . . 1.0 110.598 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.429 HD12 HG22 ' A' ' 126' ' ' VAL . 19.3 tt -148.44 144.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-N 116.483 -0.326 . . . . 1.0 110.847 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -122.87 97.91 5.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.367 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.47 139.8 39.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.449 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -120.17 135.76 54.86 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.892 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.51 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.42 -62.36 1.77 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.817 -0.629 . . . . 1.0 111.239 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 34.7 mtt-85 -99.18 165.25 11.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.278 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.634 ' O ' ' O ' ' A' ' 97' ' ' ASP . 97.8 mt-10 -52.65 159.13 1.13 Allowed 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.648 -0.705 . . . . 1.0 110.06 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.818 ' O ' ' N ' ' A' ' 99' ' ' ARG . 76.0 m-20 52.06 125.66 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 108.209 -1.034 . . . . 1.0 108.209 -178.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.478 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.2 OUTLIER -36.58 70.71 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.163 -0.472 . . . . 1.0 111.58 -178.13 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.818 ' N ' ' O ' ' A' ' 97' ' ' ASP . 3.5 tpt180 -134.91 178.96 6.61 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.015 0.436 . . . . 1.0 109.928 -178.472 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 61.88 -160.65 29.67 Favored Glycine 0 CA--C 1.519 0.321 0 N-CA-C 110.393 -1.083 . . . . 1.0 110.393 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -66.2 140.23 58.16 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.535 -0.466 . . . . 1.0 110.235 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.8 ptm -132.26 154.19 49.89 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.122 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tt -148.16 140.6 18.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.436 -0.579 . . . . 1.0 109.436 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.53 143.04 44.37 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.717 0.77 . . . . 1.0 110.68 -179.095 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.832 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 88.0 m-85 -129.38 154.25 47.09 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 114.764 -1.107 . . . . 1.0 110.472 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.24 22.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.541 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.61 -170.66 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.625 -0.43 . . . . 1.0 110.552 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.435 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 54.5 p-10 -77.91 144.15 37.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.741 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.8 m -137.0 93.1 2.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.09 -31.21 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.034 0.445 . . . . 1.0 111.086 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.7 m -136.82 90.3 2.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.408 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.832 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.9 tp -60.48 -39.84 89.13 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.19 -178.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.627 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.1 mp0 -43.69 -9.19 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.147 -0.479 . . . . 1.0 112.268 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.8 t0 -94.69 -22.07 18.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.163 0.506 . . . . 1.0 110.215 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 112' ' ' LEU . 82.5 mmt-85 -107.93 -37.14 6.17 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.446 -0.797 . . . . 1.0 112.821 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.664 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.67 136.84 54.73 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 122.51 1.148 . . . . 1.0 110.752 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.444 ' O ' ' C ' ' A' ' 118' ' ' PHE . 71.1 mtp180 -72.55 -71.46 0.29 Allowed 'General case' 0 C--N 1.315 -0.933 0 O-C-N 120.718 -1.239 . . . . 1.0 110.684 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.608 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.1 m-85 -34.61 146.4 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.631 . . . . 1.0 110.31 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -105.14 8.02 33.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.796 0.332 . . . . 1.0 110.713 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -139.02 142.27 38.28 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.238 0.542 . . . . 1.0 110.816 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.71 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.5 mm -121.3 123.2 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 115.566 -0.743 . . . . 1.0 109.267 178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.404 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 19.6 m-70 -112.14 24.54 12.49 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.501 -0.318 . . . . 1.0 111.634 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 1.6 p 166.28 150.54 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.074 0.464 . . . . 1.0 109.94 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.477 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 0.9 OUTLIER -161.29 156.94 24.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.286 -178.78 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 8.0 t-20 -122.76 115.7 22.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.429 HG22 HD12 ' A' ' 90' ' ' ILE . 24.4 t -100.56 105.18 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.111 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.885 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.21 -44.39 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 1.0 110.774 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -159.1 158.56 33.18 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.747 0.308 . . . . 1.0 110.861 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.54 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.16 73.84 0.68 Allowed Glycine 0 CA--C 1.508 -0.348 0 C-N-CA 121.45 -0.405 . . . . 1.0 112.38 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 129' ' ' GLY . 8.1 t -31.87 146.78 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.899 0.381 . . . . 1.0 110.596 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.54 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 30.8 m95 -122.1 169.23 11.07 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.075 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.3 p -141.47 96.86 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 121.017 0.437 . . . . 1.0 110.756 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.4 mt -68.04 142.01 56.01 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.04 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -118.15 130.75 56.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.785 -0.643 . . . . 1.0 109.98 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -44.25 -48.61 9.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.999 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.68 175.28 6.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.442 0.639 . . . . 1.0 110.57 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.8 m -81.45 172.35 13.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.522 -0.763 . . . . 1.0 110.817 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 63.0 t30 64.04 17.24 10.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 37.01 78.88 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.952 -0.567 . . . . 1.0 111.665 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.43 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 49.6 ttp180 -148.52 39.7 0.9 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.12 0.486 . . . . 1.0 110.302 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.448 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -152.83 -137.67 2.57 Favored Glycine 0 N--CA 1.465 0.571 0 N-CA-C 111.157 -0.777 . . . . 1.0 111.157 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -80.27 167.81 19.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.102 0.477 . . . . 1.0 110.308 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.573 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -146.58 141.97 27.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.544 -0.753 . . . . 1.0 111.11 -179.08 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 144' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 9.0 m-85 -130.76 142.27 50.4 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.341 -0.985 . . . . 1.0 108.341 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.57 ' C ' HD22 ' A' ' 146' ' ' LEU . 46.2 tp -94.84 124.2 38.74 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.169 0.509 . . . . 1.0 111.329 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.846 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.7 88.94 2.96 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.529 -0.76 . . . . 1.0 108.951 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 4.5 mtm -70.82 162.66 70.39 Favored Pre-proline 0 CA--C 1.531 0.246 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.22 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.23 116.69 3.22 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 121.621 1.547 . . . . 1.0 111.221 178.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.88 -157.46 22.61 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 110.698 -0.961 . . . . 1.0 110.698 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -128.04 114.52 17.18 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.04 0.447 . . . . 1.0 110.519 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 31.2 m-85 -106.01 130.69 53.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 1.0 109.954 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -116.12 -0.69 12.63 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.792 0.329 . . . . 1.0 110.491 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -158.97 165.7 33.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.362 0.601 . . . . 1.0 110.484 179.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.413 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -77.19 -23.14 51.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.295 -0.866 . . . . 1.0 112.615 -178.384 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 39.6 mt-30 -67.53 -20.36 65.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.447 -179.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -49.97 -48.72 52.06 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.381 -0.372 . . . . 1.0 110.808 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.679 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 23.1 p90 -96.6 20.96 9.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.09 -0.504 . . . . 1.0 110.573 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.59 74.78 0.27 Allowed Glycine 0 CA--C 1.521 0.446 0 N-CA-C 111.204 -0.758 . . . . 1.0 111.204 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.679 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.1 148.53 42.94 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.257 0.551 . . . . 1.0 110.377 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.6 t -77.76 -10.86 59.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.969 -1.014 . . . . 1.0 110.356 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.518 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 32.6 t-20 -171.76 -169.02 0.64 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.45 -0.5 . . . . 1.0 110.366 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.71 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -109.12 -8.69 15.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.625 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -44.3 116.25 0.99 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.891 0.377 . . . . 1.0 111.772 -178.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 162' ' ' ALA . 36.8 t -128.31 131.25 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.814 -0.63 . . . . 1.0 109.677 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -108.65 -28.42 4.55 Favored Glycine 0 N--CA 1.463 0.443 0 N-CA-C 111.694 -0.562 . . . . 1.0 111.694 -179.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.8 p -160.74 -168.58 2.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.704 0.288 . . . . 1.0 110.514 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.604 HD21 HD13 ' A' ' 112' ' ' LEU . 1.8 pp -173.06 137.1 0.69 Allowed 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.532 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.642 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 1.3 ttm180 -131.04 149.77 52.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.559 0.695 . . . . 1.0 109.706 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.598 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -81.87 155.97 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.951 -1.022 . . . . 1.0 109.953 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.685 ' C ' HD12 ' A' ' 171' ' ' ILE . 45.9 t -93.29 79.39 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.879 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.951 HG22 ' H ' ' A' ' 173' ' ' PHE . 3.5 mp -137.39 128.15 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.654 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 174' ' ' SER . 33.5 t70 -82.2 15.6 2.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.869 -0.605 . . . . 1.0 110.025 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.951 ' H ' HG22 ' A' ' 171' ' ' ILE . 4.3 m-85 57.56 -72.36 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.602 -0.727 . . . . 1.0 110.34 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 174' ' ' SER . . . . . 0.582 ' N ' ' O ' ' A' ' 172' ' ' ASP . 0.9 OUTLIER . . . . . 0 C--N 1.322 -0.594 0 CA-C-O 118.014 -0.993 . . . . 1.0 110.78 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.276 -0.639 . . . . 1.0 109.276 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.535 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -82.4 173.96 53.16 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -174.1 101.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.925 -0.31 . . . . 1.0 110.56 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.404 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -120.2 168.78 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 CA-C-N 116.47 -0.332 . . . . 1.0 110.533 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.486 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.6 m -127.44 122.17 32.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 176.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.7 mt -104.79 132.7 50.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.328 -0.851 . . . . 1.0 110.438 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.486 ' CE1' HG22 ' A' ' 5' ' ' THR . 49.8 m-85 -114.82 126.87 55.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.373 -0.83 . . . . 1.0 110.863 -178.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.512 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.2 tt0 -54.49 -32.23 57.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.597 -0.728 . . . . 1.0 110.72 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -115.22 152.16 33.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.217 0.532 . . . . 1.0 110.262 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 12' ' ' PHE . 19.3 ptt-85 -56.83 -171.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.393 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.63 23.97 0.07 OUTLIER Glycine 0 N--CA 1.46 0.292 0 N-CA-C 111.135 -0.786 . . . . 1.0 111.135 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 10' ' ' ARG . 11.8 m-85 52.64 69.02 0.74 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.47 -0.365 . . . . 1.0 110.213 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -129.76 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.917 0.389 . . . . 1.0 110.473 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.33 -151.22 0.11 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.03 -0.828 . . . . 1.0 111.03 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.512 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.6 mtm180 -68.73 146.61 52.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.771 0.32 . . . . 1.0 110.755 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.0 p80 -136.49 143.88 44.04 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.155 0.502 . . . . 1.0 110.261 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE1' ' O ' ' A' ' 18' ' ' GLU . 11.3 t80 -137.39 141.52 41.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.293 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.445 ' O ' ' CE1' ' A' ' 17' ' ' TYR . 19.5 tt0 -110.33 127.84 55.25 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.403 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -115.45 127.11 55.1 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.607 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -118.41 10.31 12.67 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.894 -0.594 . . . . 1.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.0 m -156.45 169.97 23.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 1.0 110.745 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -59.42 137.49 57.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.947 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.58 150.1 51.64 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.774 -0.648 . . . . 1.0 109.924 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.5 p -119.65 -16.8 8.77 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.524 -0.762 . . . . 1.0 112.131 -178.746 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.491 ' OD1' ' NE2' ' A' ' 27' ' ' GLN . 15.2 t30 -144.75 111.04 5.56 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.912 0.387 . . . . 1.0 110.188 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.1 mt -117.73 -5.72 11.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.866 -0.606 . . . . 1.0 110.58 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.64 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -45.1 -53.13 17.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.263 179.202 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.64 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 12.8 Cg_endo -54.17 -29.99 58.94 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 C-N-CA 122.078 1.852 . . . . 1.0 111.96 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -95.17 -51.44 4.62 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 120.751 -0.38 . . . . 1.0 110.43 -178.738 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.6 126.8 52.07 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.5 t -95.89 -11.61 26.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.909 -0.587 . . . . 1.0 111.491 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.549 ' O ' ' O ' ' A' ' 75' ' ' SER . 26.2 mmt180 -142.22 -53.12 0.42 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.612 -178.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' CYS . . . . . 0.464 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 20.3 t 55.97 67.84 0.95 Allowed 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 1.0 109.885 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -89.05 4.54 47.99 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.161 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.2 p -154.85 157.63 38.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.088 -0.338 . . . . 1.0 110.088 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.56 155.51 36.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.858 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.4 mtp85 -135.21 122.77 22.06 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.802 -0.814 . . . . 1.0 108.802 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.5 t -108.26 133.11 54.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.153 0.501 . . . . 1.0 110.133 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.64 -39.5 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.419 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 96.3 p -162.96 155.72 19.03 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 176.06 49.7 Favored Glycine 0 CA--C 1.522 0.474 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.0 m -111.26 147.53 34.86 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.706 -0.479 . . . . 1.0 109.706 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.47 ' CE2' HD13 ' A' ' 81' ' ' LEU . 56.5 m95 -132.1 150.86 52.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.81 -0.632 . . . . 1.0 111.246 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.627 ' C ' HD23 ' A' ' 45' ' ' LEU . 21.4 tpp -127.38 129.58 47.84 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.881 -0.785 . . . . 1.0 108.881 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.627 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -110.15 137.82 47.37 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.105 -0.498 . . . . 1.0 109.757 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -112.73 129.95 56.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.955 0.407 . . . . 1.0 110.554 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 3.2 pt-20 -54.55 -33.93 60.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.791 -0.64 . . . . 1.0 110.295 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -105.7 154.32 39.35 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.174 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -55.43 150.37 42.47 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.23 1.954 . . . . 1.0 111.212 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.57 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.4 m-20 78.61 -120.2 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 124.035 0.834 . . . . 1.0 109.103 -178.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.57 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 13.1 m-85 -141.98 79.06 1.65 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.665 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.9 t -152.73 166.22 32.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.825 -0.435 . . . . 1.0 109.825 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.15 -150.07 31.66 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.289 -0.725 . . . . 1.0 111.289 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.631 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.5 tp -78.73 142.78 36.77 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.255 -0.276 . . . . 1.0 110.255 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.15 150.41 41.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.297 -0.26 . . . . 1.0 110.297 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.503 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.1 m-85 -127.5 127.04 43.34 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.389 -0.369 . . . . 1.0 110.732 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.488 ' C ' HD22 ' A' ' 58' ' ' LEU . 41.8 t80 -82.83 122.96 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.392 0.615 . . . . 1.0 109.719 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.488 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.2 mm? -109.71 136.09 49.6 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.136 -0.938 . . . . 1.0 110.343 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 60' ' ' ARG . 38.5 mtm-85 -127.0 149.14 50.03 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.15 -0.932 . . . . 1.0 109.856 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.459 ' CZ ' ' O ' ' A' ' 172' ' ' ASP . 27.4 ptt180 -34.44 126.93 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.985 -0.552 . . . . 1.0 111.389 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 153.36 -177.38 30.97 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.637 -0.985 . . . . 1.0 110.637 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -115.31 130.81 57.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.869 0.366 . . . . 1.0 110.195 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.89 112.11 16.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 1.0 109.536 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.437 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -89.59 -4.45 57.84 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.827 -0.624 . . . . 1.0 110.991 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 83.2 m-20 -147.3 148.44 31.41 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.723 -0.473 . . . . 1.0 109.723 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.536 ' C ' ' H ' ' A' ' 68' ' ' GLN . 24.9 p80 -67.66 -42.53 82.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.019 0.437 . . . . 1.0 111.338 -179.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -50.79 -8.58 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.734 -0.666 . . . . 1.0 110.519 179.374 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.536 ' H ' ' C ' ' A' ' 66' ' ' HIS . 24.9 mm-40 -82.42 -33.35 28.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.355 -0.384 . . . . 1.0 111.256 -177.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.518 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -98.1 21.72 10.41 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 119.27 -0.395 . . . . 1.0 110.907 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.455 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 57.6 mtp 80.46 10.48 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.58 0.55 . . . . 1.0 110.256 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.42 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -56.88 99.19 0.08 OUTLIER Glycine 0 C--N 1.339 0.704 0 N-CA-C 111.096 -0.801 . . . . 1.0 111.096 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.8 mt -73.0 -39.15 66.3 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.023 -0.362 . . . . 1.0 110.023 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.402 ' O ' ' N ' ' A' ' 75' ' ' SER . 31.5 t -115.44 116.28 27.95 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 109.612 -0.514 . . . . 1.0 109.612 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 50.8 p-10 -67.73 53.18 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.012 -0.54 . . . . 1.0 111.019 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.612 ' C ' HG23 ' A' ' 76' ' ' VAL . 55.7 m -114.57 -114.73 0.33 Allowed 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 109.295 -0.632 . . . . 1.0 109.295 179.156 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.612 HG23 ' C ' ' A' ' 75' ' ' SER . 11.3 t 91.2 108.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 123.66 0.6 . . . . 1.0 109.884 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -122.68 7.62 9.44 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.553 -0.294 . . . . 1.0 111.092 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.434 ' HB3' ' H ' ' A' ' 50' ' ' ASN . 9.7 p -163.76 161.78 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.428 . . . . 1.0 110.653 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.7 p -154.81 146.05 22.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.026 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.2 ptm180 -127.61 146.66 50.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.102 -0.333 . . . . 1.0 110.102 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.535 HD21 ' H ' ' A' ' 2' ' ' GLY . 29.8 tp -96.19 130.0 43.37 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.494 -0.558 . . . . 1.0 109.494 178.166 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.403 ' H ' HD12 ' A' ' 81' ' ' LEU . 3.2 mt -92.05 114.56 62.5 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.017 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -51.32 148.64 18.59 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.439 2.093 . . . . 1.0 112.776 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -72.01 -179.35 2.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.641 -0.709 . . . . 1.0 110.361 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.9 t -166.4 145.09 5.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.843 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -88.44 -70.97 1.27 Allowed Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.322 -1.111 . . . . 1.0 110.322 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m -88.55 153.67 20.95 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 109.787 -0.449 . . . . 1.0 109.787 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.474 ' CD2' HD11 ' A' ' 171' ' ' ILE . 9.6 m80 -132.43 121.78 23.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.548 -0.296 . . . . 1.0 111.032 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -147.92 136.59 21.77 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 1.0 110.288 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 126' ' ' VAL . 20.6 tt -150.94 149.92 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.517 -0.311 . . . . 1.0 110.535 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -130.09 100.55 5.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.389 0.614 . . . . 1.0 111.445 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.2 mt -77.44 139.43 39.66 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.645 -0.707 . . . . 1.0 110.301 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.603 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 54.6 m-85 -115.27 139.28 50.1 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.603 0.716 . . . . 1.0 111.138 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.509 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.6 OUTLIER -59.27 -63.54 1.27 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.395 -0.821 . . . . 1.0 111.512 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.5 mmm-85 -96.07 174.09 7.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.113 0.482 . . . . 1.0 110.955 -178.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -66.32 169.25 7.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.547 -0.751 . . . . 1.0 110.988 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.501 ' C ' ' CG ' ' A' ' 98' ' ' TYR . 66.0 t0 48.1 40.03 12.79 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.066 -0.97 . . . . 1.0 111.307 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER 54.01 35.99 23.41 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.688 -0.687 . . . . 1.0 111.225 178.221 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -101.16 150.36 23.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.164 0.507 . . . . 1.0 110.508 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.74 -166.79 31.66 Favored Glycine 0 CA--C 1.519 0.323 0 CA-C-N 115.803 -0.635 . . . . 1.0 111.527 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -61.4 146.6 47.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.374 . . . . 1.0 110.398 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.603 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 5.9 ttp -133.36 149.1 51.87 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.82 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.458 HG21 ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -141.19 142.46 29.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 109.8 -0.444 . . . . 1.0 109.8 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -112.38 136.71 51.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.417 0.627 . . . . 1.0 110.647 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.55 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 82.3 m-85 -122.41 156.13 34.65 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.844 -1.071 . . . . 1.0 110.256 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -142.82 13.03 1.88 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.396 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -156.33 -168.69 2.8 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 120.616 -0.434 . . . . 1.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -76.63 145.16 39.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.42 . . . . 1.0 110.801 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.453 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 13.5 m -133.47 93.2 3.11 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.04 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 78.2 p -67.75 -28.29 67.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.319 -0.401 . . . . 1.0 111.247 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.2 t -138.26 97.05 3.29 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.328 0.585 . . . . 1.0 111.174 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.55 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 3.5 mt -63.82 -40.49 96.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.172 -0.922 . . . . 1.0 110.505 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.452 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 25.9 mm-40 -46.21 -11.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.896 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 112' ' ' LEU . 38.5 t70 -96.21 -25.83 15.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.804 0.335 . . . . 1.0 110.547 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.3 mmt180 -110.31 -41.05 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 1.0 111.546 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.489 ' CB ' HD22 ' A' ' 112' ' ' LEU . 5.1 t80 -122.41 116.68 24.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.15 0.5 . . . . 1.0 110.408 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 118' ' ' PHE . 23.5 mmm180 -56.67 -67.81 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.444 -0.798 . . . . 1.0 111.16 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.509 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 80.0 m-85 -38.08 139.98 0.31 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.51 -0.313 . . . . 1.0 110.304 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 119' ' ' ASN . . . . . 0.452 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 81.2 m-20 -100.43 2.84 42.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.914 -178.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -132.76 142.27 48.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.191 0.52 . . . . 1.0 111.151 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.8 mm -122.92 120.64 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 CA-C-N 115.518 -0.765 . . . . 1.0 109.52 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.456 ' O ' ' CB ' ' A' ' 123' ' ' SER . 30.7 m-70 -110.94 28.48 8.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 1.0 111.514 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.456 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.7 t 162.27 151.06 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 120.986 0.422 . . . . 1.0 110.695 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.439 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.3 pp -163.73 158.79 20.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.573 -0.74 . . . . 1.0 110.371 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.518 HD22 HD11 ' A' ' 127' ' ' LEU . 3.2 t30 -126.33 119.1 26.49 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.848 -0.427 . . . . 1.0 109.848 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.411 HG22 HD12 ' A' ' 90' ' ' ILE . 26.5 t -100.9 105.42 17.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 109.722 -0.473 . . . . 1.0 109.722 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.931 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.69 -41.67 30.53 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.634 -0.712 . . . . 1.0 111.263 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -140.34 146.29 38.26 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.976 0.417 . . . . 1.0 110.87 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 61.21 -175.39 5.46 Favored Glycine 0 CA--C 1.518 0.242 0 N-CA-C 111.183 -0.767 . . . . 1.0 111.183 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.4 t -117.65 154.38 31.7 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.655 -0.498 . . . . 1.0 109.655 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.3 m95 -127.64 160.21 32.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.808 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 65.7 t -132.26 135.38 58.17 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 N-CA-C 109.659 -0.497 . . . . 1.0 109.659 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.517 ' HG ' HD11 ' A' ' 146' ' ' LEU . 23.5 mt -107.77 143.29 36.52 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.238 -0.282 . . . . 1.0 110.238 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -118.79 133.07 56.1 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.755 0.312 . . . . 1.0 110.629 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -43.27 -52.23 5.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.958 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.592 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -121.99 172.3 8.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.176 0.513 . . . . 1.0 110.181 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.7 m -75.56 170.05 16.9 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.529 -0.76 . . . . 1.0 110.918 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 62.0 t30 66.37 16.94 10.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.279 -0.873 . . . . 1.0 109.982 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.478 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 1.4 m-85 38.55 80.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 1.0 111.679 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.53 ' C ' HD11 ' A' ' 136' ' ' LEU . 51.3 ttp180 -149.48 42.11 0.89 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.983 0.421 . . . . 1.0 109.904 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.44 -135.11 2.17 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 111.309 -0.716 . . . . 1.0 111.309 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -82.98 168.54 16.9 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.962 -0.384 . . . . 1.0 109.962 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.38 137.82 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.116 -0.493 . . . . 1.0 110.919 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -128.22 132.11 48.8 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.162 -0.681 . . . . 1.0 109.162 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.8 OUTLIER -87.53 126.65 35.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.083 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.623 ' N ' HD23 ' A' ' 145' ' ' LEU . 21.8 mt -115.43 99.9 7.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.993 -0.549 . . . . 1.0 109.599 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.451 ' HE2' HD22 ' A' ' 145' ' ' LEU . 5.2 mtm -81.94 156.77 69.66 Favored Pre-proline 0 C--N 1.327 -0.373 0 C-N-CA 120.704 -0.398 . . . . 1.0 110.604 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.39 120.33 3.13 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 C-N-CA 122.081 1.854 . . . . 1.0 111.569 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.54 -154.81 24.9 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.431 -1.068 . . . . 1.0 110.431 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -127.02 135.98 51.59 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.835 0.35 . . . . 1.0 110.458 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.518 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 11.9 m-85 -126.87 130.97 51.21 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.754 -0.461 . . . . 1.0 109.754 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -119.39 -0.37 10.94 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.747 0.308 . . . . 1.0 110.589 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -158.15 163.11 37.9 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 121.173 0.511 . . . . 1.0 109.947 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.627 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -76.19 -18.48 59.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.354 -0.839 . . . . 1.0 111.918 -178.436 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.572 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -67.62 -21.68 65.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 1.0 110.712 -179.028 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -50.27 -48.42 54.86 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.614 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.731 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 21.7 p90 -102.27 19.41 18.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 1.0 110.562 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 76.67 0.16 Allowed Glycine 0 CA--C 1.52 0.354 0 N-CA-C 111.272 -0.731 . . . . 1.0 111.272 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.731 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -94.12 -169.75 2.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.037 0.446 . . . . 1.0 110.115 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 1.2 t -123.49 -36.31 2.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.542 -0.754 . . . . 1.0 111.776 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.659 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 25.7 t-20 -145.64 -24.1 0.47 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 1.0 111.61 -178.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 93.23 0.8 0.09 Allowed 'General case' 0 N--CA 1.465 0.305 0 O-C-N 124.031 0.832 . . . . 1.0 110.68 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -67.98 116.07 8.22 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.849 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.2 125.28 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.115 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -102.07 -24.59 8.41 Favored Glycine 0 N--CA 1.464 0.503 0 N-CA-C 111.507 -0.637 . . . . 1.0 111.507 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.9 p -161.51 171.21 18.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.88 0.371 . . . . 1.0 110.68 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.73 148.5 24.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.98 -0.555 . . . . 1.0 111.617 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.478 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 15.4 ptp180 -138.17 154.2 49.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.363 . . . . 1.0 110.094 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -86.66 155.94 20.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.043 -0.526 . . . . 1.0 110.053 178.035 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.07 85.62 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 1.0 111.191 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.492 HG23 ' CE2' ' A' ' 173' ' ' PHE . 3.5 mp -137.25 133.68 46.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.034 -0.53 . . . . 1.0 110.436 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.459 ' O ' ' CZ ' ' A' ' 60' ' ' ARG . 19.2 p-10 -104.01 -7.37 20.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.846 -0.616 . . . . 1.0 110.805 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.492 ' CE2' HG23 ' A' ' 171' ' ' ILE . 33.0 p90 -107.38 -172.06 2.0 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.015 0.436 . . . . 1.0 110.629 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 117.947 -1.025 . . . . 1.0 110.526 179.915 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.21 -0.663 . . . . 1.0 109.21 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.545 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -87.32 173.33 44.19 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.694 -0.963 . . . . 1.0 110.694 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.9 tttt -172.91 106.24 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.891 -0.324 . . . . 1.0 110.321 179.134 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.26 168.48 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 116.468 -0.333 . . . . 1.0 110.595 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.491 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.0 m -127.63 121.72 31.23 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 177.191 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.8 mt -105.67 132.97 51.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.047 -0.979 . . . . 1.0 110.262 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.491 ' CE1' HG22 ' A' ' 5' ' ' THR . 49.9 m-85 -115.06 127.26 55.51 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.307 -0.86 . . . . 1.0 110.909 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.426 ' OE1' ' OD1' ' A' ' 9' ' ' ASP . 6.9 tm-20 -53.94 -32.86 55.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.557 -0.747 . . . . 1.0 110.588 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' OD1' ' OE1' ' A' ' 8' ' ' GLU . 90.4 m-20 -115.74 152.14 33.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.292 0.568 . . . . 1.0 110.292 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.44 ' C ' ' N ' ' A' ' 12' ' ' PHE . 32.5 ptt85 -57.04 -172.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.494 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.81 22.65 0.3 Allowed Glycine 0 CA--C 1.517 0.207 0 N-CA-C 110.918 -0.873 . . . . 1.0 110.918 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.44 ' N ' ' C ' ' A' ' 10' ' ' ARG . 10.3 m-85 53.23 67.37 1.01 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.26 -0.274 . . . . 1.0 110.26 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' A' ' 12' ' ' PHE . 10.9 mm100 -129.8 -158.65 0.9 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.138 0.494 . . . . 1.0 110.594 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.67 -149.97 0.67 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -70.83 147.13 49.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.681 0.277 . . . . 1.0 110.701 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.6 p80 -136.49 146.6 46.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.187 0.518 . . . . 1.0 110.299 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -139.63 141.43 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.383 -0.826 . . . . 1.0 109.978 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 62.1 tt0 -111.07 122.92 49.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.336 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.6 126.83 54.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.464 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.3 p -117.43 10.29 13.55 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.345 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.8 m -156.88 169.02 25.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.732 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.8 139.68 56.03 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.639 -0.709 . . . . 1.0 111.244 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.61 155.33 49.3 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.64 -0.709 . . . . 1.0 110.409 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -123.66 -15.03 7.14 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.382 -0.826 . . . . 1.0 112.326 -179.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -138.08 112.97 9.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.954 0.406 . . . . 1.0 110.408 -178.285 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 mp -115.95 -9.74 11.73 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.063 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.613 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -48.61 -52.53 43.84 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.46 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 16.8 Cg_endo -55.39 -33.69 86.46 Favored 'Trans proline' 0 C--N 1.316 -1.181 0 C-N-CA 121.848 1.699 . . . . 1.0 112.103 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -95.0 -49.43 5.55 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 120.388 -0.525 . . . . 1.0 110.68 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 mt -121.66 126.32 48.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.668 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 t -95.01 -12.85 25.92 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.909 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.559 ' O ' ' O ' ' A' ' 75' ' ' SER . 99.7 mtt180 -143.39 -51.17 0.34 Allowed 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 116.167 -0.469 . . . . 1.0 111.737 -178.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.5 t 56.88 78.5 0.22 Allowed 'General case' 0 C--N 1.314 -0.955 0 O-C-N 122.134 -0.354 . . . . 1.0 110.099 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.442 ' OD1' ' OD1' ' A' ' 74' ' ' ASP . 34.2 m-20 -95.19 5.69 51.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.294 -178.703 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.6 p -158.13 158.32 34.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 1.0 110.254 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.79 154.3 32.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.942 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.9 mtp85 -133.05 121.95 23.45 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.598 -0.89 . . . . 1.0 108.598 178.847 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.8 133.19 53.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.627 -0.509 . . . . 1.0 109.627 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.59 -43.94 7.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.744 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.2 t -160.82 154.09 21.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.95 177.59 50.99 Favored Glycine 0 C--N 1.317 -0.5 0 N-CA-C 111.194 -0.762 . . . . 1.0 111.194 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.1 m -112.16 134.05 53.93 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.589 -0.522 . . . . 1.0 109.589 178.565 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.45 ' CE2' HD13 ' A' ' 81' ' ' LEU . 58.4 m95 -121.96 142.41 50.33 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.017 -0.538 . . . . 1.0 111.179 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.69 ' C ' HD23 ' A' ' 45' ' ' LEU . 10.4 tpp -120.15 130.29 54.53 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.546 -0.752 . . . . 1.0 109.172 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.69 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -111.49 138.96 47.33 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.084 -0.507 . . . . 1.0 109.808 -178.823 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -111.58 130.99 55.57 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.322 0.582 . . . . 1.0 110.979 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 54' ' ' LEU . 16.0 pt-20 -55.39 -30.7 60.88 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.12 -0.945 . . . . 1.0 110.532 -178.812 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.437 ' NE2' ' HB3' ' A' ' 52' ' ' SER . 19.1 pt20 -114.87 156.29 45.25 Favored Pre-proline 0 N--CA 1.465 0.297 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -52.94 152.38 17.96 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 121.753 1.635 . . . . 1.0 111.911 -179.665 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.548 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.5 m-20 70.32 -120.48 0.11 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.747 -1.115 . . . . 1.0 109.313 -178.448 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER -153.64 76.28 1.08 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.648 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.437 ' HB3' ' NE2' ' A' ' 48' ' ' GLN . 30.7 t -143.29 16.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.541 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -133.11 -168.93 12.05 Favored Glycine 0 N--CA 1.464 0.549 0 N-CA-C 111.33 -0.708 . . . . 1.0 111.33 179.039 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' A' ' 54' ' ' LEU . 48.4 tp -55.34 145.54 21.82 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 109.522 -0.547 . . . . 1.0 109.522 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -122.33 152.49 40.07 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.903 0.383 . . . . 1.0 110.624 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.48 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.0 m-85 -130.52 125.92 35.52 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.945 -0.57 . . . . 1.0 110.731 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -84.15 123.93 30.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.885 -0.598 . . . . 1.0 110.26 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.0 mp -121.26 145.91 47.37 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.582 -0.735 . . . . 1.0 110.686 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.406 ' O ' ' C ' ' A' ' 60' ' ' ARG . 43.8 mtp180 -132.51 158.66 41.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.293 179.616 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 59' ' ' ARG . 40.5 ptt180 -35.14 127.56 0.54 Allowed 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.701 -0.681 . . . . 1.0 111.116 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.79 -178.3 30.0 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 110.873 -0.891 . . . . 1.0 110.873 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.442 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.5 p-10 -116.92 128.01 54.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.08 0.467 . . . . 1.0 110.435 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -120.46 112.72 19.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 1.0 109.6 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.86 -3.71 57.15 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.283 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -148.28 141.34 24.93 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.49 -0.559 . . . . 1.0 109.49 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.494 ' C ' ' H ' ' A' ' 68' ' ' GLN . 25.6 p-80 -62.57 -40.1 95.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.096 0.474 . . . . 1.0 111.166 -179.099 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -54.56 -6.78 0.12 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.355 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -84.5 -34.65 23.31 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.779 -0.368 . . . . 1.0 111.363 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -95.1 18.42 12.21 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 119.225 -0.417 . . . . 1.0 111.063 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 39.9 mtt 82.37 12.92 0.54 Allowed 'General case' 0 N--CA 1.463 0.225 0 O-C-N 123.884 0.74 . . . . 1.0 110.128 -178.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.416 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -59.97 100.87 0.22 Allowed Glycine 0 C--N 1.343 0.926 0 C-N-CA 120.526 -0.845 . . . . 1.0 111.311 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.9 mt -71.56 -40.57 69.91 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.814 -0.439 . . . . 1.0 109.814 177.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.8 m -115.78 116.96 28.94 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 109.486 -0.561 . . . . 1.0 109.486 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.442 ' OD1' ' OD1' ' A' ' 34' ' ' ASN . 54.1 t0 -68.09 53.6 0.07 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.978 -0.555 . . . . 1.0 111.271 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.619 ' C ' HG23 ' A' ' 76' ' ' VAL . 8.5 t -113.75 -113.37 0.34 Allowed 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 108.798 -0.816 . . . . 1.0 108.798 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.619 HG23 ' C ' ' A' ' 75' ' ' SER . 7.5 t 90.69 109.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 O-C-N 123.646 0.592 . . . . 1.0 110.362 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -126.09 8.51 7.33 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.742 0.306 . . . . 1.0 110.928 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 p -163.45 161.21 24.14 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.144 0.497 . . . . 1.0 110.789 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 27.4 p -154.75 146.98 23.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.456 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.7 ptm180 -127.84 148.01 50.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.224 -0.288 . . . . 1.0 110.224 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.545 HD21 ' H ' ' A' ' 2' ' ' GLY . 19.9 tp -98.64 127.3 44.52 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.858 -0.793 . . . . 1.0 108.858 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.436 ' N ' HD12 ' A' ' 81' ' ' LEU . 2.8 mt -93.16 120.49 66.8 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.189 -0.459 . . . . 1.0 109.827 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -48.34 140.47 20.57 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.145 1.897 . . . . 1.0 112.884 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.497 ' O ' ' O ' ' A' ' 85' ' ' SER . 90.5 m-70 -61.89 -30.87 71.16 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.955 -1.021 . . . . 1.0 110.993 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' ' O ' ' A' ' 84' ' ' HIS . 1.3 m 53.59 154.73 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.75 -0.659 . . . . 1.0 111.302 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -97.28 -79.02 1.44 Allowed Glycine 0 CA--C 1.522 0.486 0 N-CA-C 109.941 -1.264 . . . . 1.0 109.941 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.3 m -87.27 158.93 18.97 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.752 -0.462 . . . . 1.0 109.752 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.773 ' CD2' HD11 ' A' ' 171' ' ' ILE . 5.8 m-70 -132.52 128.43 37.3 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.887 0.375 . . . . 1.0 110.926 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -155.1 133.91 12.11 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.679 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.567 HD12 HG22 ' A' ' 126' ' ' VAL . 16.6 tt -146.21 150.12 15.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.442 -0.344 . . . . 1.0 110.754 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.4 98.28 5.0 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.25 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.24 137.63 38.22 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.326 0.584 . . . . 1.0 111.43 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.45 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 56.9 m-85 -111.93 134.42 53.49 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 115.11 -0.95 . . . . 1.0 110.841 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.466 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.9 tm-20 -52.98 -56.93 12.35 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.511 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -104.1 171.5 7.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.564 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -47.78 156.96 0.29 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.63 -0.714 . . . . 1.0 110.311 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.436 ' C ' ' CD2' ' A' ' 98' ' ' TYR . 13.5 m-20 55.36 -97.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.878 -0.601 . . . . 1.0 109.92 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.436 ' CD2' ' C ' ' A' ' 97' ' ' ASP . 0.8 OUTLIER -167.83 30.19 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.305 -0.558 . . . . 1.0 109.697 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -88.63 50.51 1.98 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.789 -0.641 . . . . 1.0 111.219 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -173.03 -172.52 38.7 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.32 -0.854 . . . . 1.0 111.407 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -58.31 146.83 32.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.988 -0.375 . . . . 1.0 109.988 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.47 ' HG2' ' N ' ' A' ' 103' ' ' ILE . 11.7 ttp -131.54 153.06 50.22 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.897 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.483 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.9 tt -146.51 142.12 20.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.5 -0.556 . . . . 1.0 109.5 177.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -112.54 143.41 43.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.47 0.653 . . . . 1.0 110.427 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -129.52 156.96 43.31 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 114.814 -1.084 . . . . 1.0 110.567 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.6 p -143.73 15.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.433 -0.803 . . . . 1.0 110.592 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.413 ' C ' ' NE ' ' A' ' 169' ' ' ARG . 16.8 pt-20 -156.6 -168.55 2.73 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.202 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.631 ' N ' ' NE ' ' A' ' 169' ' ' ARG . 49.1 p30 -79.87 147.98 31.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.805 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.408 ' O ' ' OG ' ' A' ' 166' ' ' SER . 2.2 t -138.03 93.95 2.83 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.013 -0.54 . . . . 1.0 109.996 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.3 p -65.04 -22.28 66.96 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.809 -0.357 . . . . 1.0 111.209 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 16.4 t -140.56 94.23 2.71 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.311 0.577 . . . . 1.0 110.618 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.534 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.0 tp -62.62 -43.5 98.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.342 -0.845 . . . . 1.0 110.299 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.449 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 22.5 mp0 -48.93 -7.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.925 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.534 ' H ' ' C ' ' A' ' 112' ' ' LEU . 45.7 t0 -94.88 -26.49 16.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.945 0.402 . . . . 1.0 110.346 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.8 mmt180 -108.31 -34.46 6.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.191 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.483 ' CD1' HG21 ' A' ' 103' ' ' ILE . 5.3 t80 -124.23 118.48 26.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.12 0.486 . . . . 1.0 109.871 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -54.51 -67.62 0.25 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.529 -0.76 . . . . 1.0 111.12 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.466 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 92.6 m-85 -40.14 141.66 0.45 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.233 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.6 t30 -102.22 2.32 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.809 0.338 . . . . 1.0 111.35 -178.863 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -130.24 138.86 50.76 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.219 0.533 . . . . 1.0 111.045 -178.146 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.717 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 37.4 mm -122.2 125.9 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 CA-C-N 115.303 -0.862 . . . . 1.0 109.358 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.5 m-70 -114.06 17.57 17.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.473 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.584 ' C ' HD13 ' A' ' 124' ' ' LEU . 3.2 m 170.5 156.08 0.06 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.997 0.427 . . . . 1.0 110.965 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.684 HD11 ' CZ3' ' A' ' 157' ' ' TRP . 0.0 OUTLIER -160.11 162.08 33.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.818 179.466 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.8 t-20 -125.57 112.31 16.04 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.045 -0.724 . . . . 1.0 109.045 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.567 HG22 HD12 ' A' ' 90' ' ' ILE . 40.4 t -101.72 103.95 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.634 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.932 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.55 -37.45 36.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.75 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 129' ' ' GLY . 31.1 tp10 -138.87 158.34 44.39 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.875 0.369 . . . . 1.0 110.416 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.433 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.08 -173.2 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 111.078 -0.809 . . . . 1.0 111.078 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.497 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.7 OUTLIER -115.71 176.18 5.2 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.384 -0.598 . . . . 1.0 109.384 179.545 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.497 ' CD1' ' C ' ' A' ' 130' ' ' SER . 67.3 m95 -147.12 161.1 41.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.694 -0.684 . . . . 1.0 110.346 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 60.1 t -132.05 134.01 60.13 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 116.058 -0.519 . . . . 1.0 109.771 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.48 143.53 37.32 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 134' ' ' TYR . . . . . 0.536 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 13.6 m-85 -119.43 131.9 55.72 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.041 0.448 . . . . 1.0 110.306 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -47.69 -23.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.945 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.479 HD12 ' C ' ' A' ' 136' ' ' LEU . 0.3 OUTLIER -147.75 179.67 7.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.061 0.458 . . . . 1.0 110.199 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.5 p -84.8 170.58 13.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.023 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 66.01 16.37 10.44 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.049 -0.978 . . . . 1.0 110.262 -179.563 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.545 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 5.1 m-85 40.37 78.66 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.801 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 90.9 mtt-85 -147.94 37.38 0.87 Allowed 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 120.905 0.383 . . . . 1.0 110.658 179.345 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.456 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -148.3 -145.64 4.19 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.428 -0.669 . . . . 1.0 111.428 -178.407 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -74.34 157.45 35.72 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 110.18 -0.304 . . . . 1.0 110.18 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.472 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 66.1 mt-30 -133.75 133.66 42.02 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.538 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -128.5 133.3 48.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.305 -0.628 . . . . 1.0 109.305 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.618 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.6 OUTLIER -91.54 128.72 37.48 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.363 0.602 . . . . 1.0 110.587 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.639 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.34 90.55 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.194 -0.912 . . . . 1.0 109.103 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -68.86 150.72 97.54 Favored Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 114.857 -1.065 . . . . 1.0 111.097 -178.657 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -44.93 119.22 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 C-N-CA 121.404 1.403 . . . . 1.0 111.298 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 166.2 -151.0 19.02 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.405 -1.078 . . . . 1.0 110.405 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -136.01 125.54 25.19 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.676 0.274 . . . . 1.0 110.614 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 3.1 m-85 -116.43 129.41 56.21 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.325 -0.62 . . . . 1.0 109.325 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 152' ' ' ARG . . . . . 0.411 ' C ' ' OG ' ' A' ' 123' ' ' SER . 72.9 mtm-85 -107.24 -1.54 21.69 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.02 0.438 . . . . 1.0 110.432 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -156.99 163.03 39.56 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.474 0.654 . . . . 1.0 110.867 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.542 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 9.1 p90 -78.28 -21.08 50.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.905 -1.043 . . . . 1.0 112.565 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -68.8 -20.03 64.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.93 -0.577 . . . . 1.0 111.167 -179.604 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -51.96 -48.42 64.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.86 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.708 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 16.8 p90 -95.77 20.92 9.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.84 75.76 0.2 Allowed Glycine 0 CA--C 1.521 0.429 0 N-CA-C 111.212 -0.755 . . . . 1.0 111.212 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.708 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.85 149.24 41.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.086 0.469 . . . . 1.0 110.146 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 13.4 t -76.93 -21.3 55.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.254 -0.884 . . . . 1.0 110.207 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -163.33 -170.1 2.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.879 0.371 . . . . 1.0 110.492 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.717 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.91 -7.12 15.5 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.102 -0.499 . . . . 1.0 110.577 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -49.23 119.56 3.39 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.067 0.461 . . . . 1.0 111.121 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.9 t -135.05 121.25 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.372 -0.831 . . . . 1.0 109.382 177.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.438 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -100.54 -23.09 10.48 Favored Glycine 0 N--CA 1.467 0.717 0 N-CA-C 111.716 -0.554 . . . . 1.0 111.716 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.537 ' OG ' ' N ' ' A' ' 167' ' ' LEU . 5.2 t -156.77 179.94 8.8 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.266 -0.573 . . . . 1.0 110.314 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.537 ' N ' ' OG ' ' A' ' 166' ' ' SER . 1.5 pp -166.29 142.65 4.92 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.002 -0.544 . . . . 1.0 111.165 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.545 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 13.4 ptp180 -136.15 152.57 50.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.836 0.351 . . . . 1.0 110.123 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.631 ' NE ' ' N ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -81.01 159.16 24.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.193 -0.669 . . . . 1.0 109.193 177.792 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 170' ' ' VAL . 27.1 m -92.41 66.14 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.791 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.773 HD11 ' CD2' ' A' ' 88' ' ' HIS . 19.5 mt -121.77 131.43 73.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.441 0.639 . . . . 1.0 110.948 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -95.18 -26.79 15.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.886 -1.052 . . . . 1.0 110.58 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.504 ' CE2' HG23 ' A' ' 171' ' ' ILE . 51.3 p90 -89.33 -165.47 1.35 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.9 0.381 . . . . 1.0 110.747 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 46.4 t . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.989 -1.005 . . . . 1.0 110.635 -179.995 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.488 ' O ' ' O ' ' A' ' 2' ' ' GLY . 86.9 mt-30 . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.461 -0.57 . . . . 1.0 109.461 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 1' ' ' GLN . . . 51.18 168.17 0.01 OUTLIER Glycine 0 C--N 1.333 0.393 0 N-CA-C 110.726 -0.95 . . . . 1.0 110.726 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -174.77 100.4 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.673 -0.411 . . . . 1.0 110.24 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.99 164.8 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 CA-C-N 116.264 -0.426 . . . . 1.0 110.278 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.522 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.8 m -124.16 118.6 27.25 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.29 -1.004 . . . . 1.0 108.29 177.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.8 mt -102.79 133.14 48.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.853 -1.067 . . . . 1.0 109.853 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.522 ' CE1' HG22 ' A' ' 5' ' ' THR . 66.0 m-85 -115.92 126.1 53.45 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.499 -0.773 . . . . 1.0 111.005 -178.575 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.533 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 82.0 tt0 -53.51 -31.57 46.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.608 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -115.16 153.67 30.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.283 0.564 . . . . 1.0 110.439 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' C ' ' N ' ' A' ' 12' ' ' PHE . 4.4 ptm180 -58.63 -173.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.609 -0.723 . . . . 1.0 110.265 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.47 26.84 0.25 Allowed Glycine 0 N--CA 1.462 0.388 0 N-CA-C 110.956 -0.858 . . . . 1.0 110.956 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.5 m-85 50.28 70.94 0.45 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.362 -0.419 . . . . 1.0 110.279 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -132.0 -158.81 0.92 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.92 0.391 . . . . 1.0 110.532 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.89 -151.93 0.3 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.533 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 89.0 mtm180 -68.77 146.57 52.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 1.0 110.768 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.3 p-80 -136.03 152.66 51.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.247 0.546 . . . . 1.0 110.377 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.531 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -146.69 141.51 26.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.494 -0.776 . . . . 1.0 110.294 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.531 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.0 tt0 -110.2 123.1 49.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.057 -0.52 . . . . 1.0 110.177 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.423 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.1 t -112.69 126.92 55.92 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.86 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -117.49 10.85 13.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.353 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.0 p -154.34 165.95 34.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.61 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.437 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 47.1 p-10 -58.32 141.65 50.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.549 -0.75 . . . . 1.0 111.446 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.423 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -136.19 146.22 46.59 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.389 -0.823 . . . . 1.0 110.484 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.6 p -112.78 -16.17 12.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.738 -0.664 . . . . 1.0 111.651 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -151.03 117.48 5.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.271 0.558 . . . . 1.0 110.667 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.4 mt -118.24 -0.41 11.54 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.283 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.608 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 45.6 mt-30 -46.39 -53.44 23.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.795 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.608 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.4 Cg_endo -54.35 -30.35 62.45 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.842 1.695 . . . . 1.0 111.977 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.433 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -96.27 -54.32 3.32 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.586 -0.446 . . . . 1.0 110.664 -179.062 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -117.74 126.95 53.4 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.756 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.2 t -95.28 -9.45 33.07 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.746 -0.661 . . . . 1.0 111.499 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 94.4 mtm-85 -146.36 -59.56 0.3 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t 64.8 76.37 0.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 1.0 110.004 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -92.55 3.78 54.85 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.999 -0.546 . . . . 1.0 111.383 -178.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.0 p -158.67 158.76 34.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.818 0.342 . . . . 1.0 110.274 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.92 155.73 34.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.995 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -134.67 123.62 24.01 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 108.96 -0.756 . . . . 1.0 108.96 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.06 132.66 56.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.364 -0.606 . . . . 1.0 109.364 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -93.92 -43.59 8.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.627 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.7 t -160.99 151.84 18.46 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.269 -0.423 . . . . 1.0 109.874 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.26 175.78 47.58 Favored Glycine 0 C--N 1.319 -0.405 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.4 m -113.02 137.52 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.509 -0.552 . . . . 1.0 109.509 178.403 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.448 ' CE2' HD13 ' A' ' 81' ' ' LEU . 46.8 m95 -124.02 155.98 37.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.242 0.544 . . . . 1.0 110.904 -178.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.424 ' C ' HD23 ' A' ' 45' ' ' LEU . 1.4 tpt -127.78 129.1 46.47 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.694 -0.854 . . . . 1.0 108.694 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.424 HD23 ' C ' ' A' ' 44' ' ' MET . 2.7 mt -108.69 130.33 55.35 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.451 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 73.3 m-85 -108.26 131.61 54.53 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.665 0.745 . . . . 1.0 110.758 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 4.7 pt-20 -59.25 -35.11 73.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.711 -1.131 . . . . 1.0 110.347 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.3 mt-30 -111.0 153.41 43.85 Favored Pre-proline 0 N--CA 1.462 0.146 0 CA-C-N 116.446 -0.343 . . . . 1.0 110.49 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.93 159.17 43.44 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.443 2.095 . . . . 1.0 112.623 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 62.64 39.21 11.53 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.731 -0.668 . . . . 1.0 111.023 179.754 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.451 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 5.2 m-85 48.17 74.22 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 1.0 110.746 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.8 m -141.5 153.15 44.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.063 0.459 . . . . 1.0 110.168 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.42 -147.26 19.95 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.91 -0.662 . . . . 1.0 111.675 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.629 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 37.2 tp -80.31 146.0 31.82 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.388 -0.406 . . . . 1.0 110.647 -179.309 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.429 ' NE2' ' H ' ' A' ' 145' ' ' LEU . 12.1 pt20 -121.78 150.86 41.26 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.839 0.352 . . . . 1.0 110.537 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.425 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 24.7 m-85 -127.53 132.54 49.9 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.236 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.491 ' C ' HD22 ' A' ' 58' ' ' LEU . 57.5 t80 -80.77 118.3 22.18 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.576 0.703 . . . . 1.0 109.961 -178.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.491 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.5 mm? -111.71 133.89 53.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.131 -0.94 . . . . 1.0 109.704 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.4 ptt85 -133.65 162.12 32.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.441 -0.799 . . . . 1.0 110.204 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -41.06 123.88 2.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.322 -0.399 . . . . 1.0 110.91 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.08 178.63 33.27 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.86 -0.896 . . . . 1.0 110.86 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.4 p-10 -115.29 124.43 51.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.206 0.527 . . . . 1.0 110.222 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -119.32 112.46 19.48 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.244 -0.651 . . . . 1.0 109.244 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.24 -4.04 54.65 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.496 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.9 m-20 -147.58 138.34 23.37 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.398 -0.593 . . . . 1.0 109.398 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.75 ' CD2' ' OD1' ' A' ' 74' ' ' ASP . 15.7 p-80 -58.48 -40.96 84.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.133 0.492 . . . . 1.0 110.969 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -54.3 -7.82 0.17 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.709 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -81.89 -34.82 29.79 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.386 -0.526 . . . . 1.0 111.05 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.75 13.19 18.91 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.963 -0.295 . . . . 1.0 110.311 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.424 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 52.6 mtt 74.51 35.98 0.66 Allowed 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.915 0.759 . . . . 1.0 109.967 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -72.67 42.91 0.9 Allowed Glycine 0 CA--C 1.531 1.057 0 C-N-CA 120.158 -1.02 . . . . 1.0 111.463 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.475 ' C ' ' O ' ' A' ' 71' ' ' GLY . 14.9 mt -25.13 -44.36 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.761 0.424 . . . . 1.0 111.094 -178.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 71' ' ' GLY . 47.1 t -119.42 114.09 21.78 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 108.563 -0.902 . . . . 1.0 108.563 177.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.75 ' OD1' ' CD2' ' A' ' 66' ' ' HIS . 91.2 m-20 -62.43 -161.89 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.73 -0.471 . . . . 1.0 109.73 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.55 ' O ' ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER 83.48 69.0 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.905 0 CA-C-O 120.836 0.35 . . . . 1.0 111.387 178.975 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -100.02 114.4 38.39 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 N-CA-C 108.607 -0.886 . . . . 1.0 108.607 178.173 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -121.49 4.12 10.19 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.867 -0.606 . . . . 1.0 111.566 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.2 p -163.22 162.69 25.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.177 0.513 . . . . 1.0 110.543 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 25.2 p -155.55 147.26 23.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 1.0 110.188 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.08 146.46 50.36 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.933 -0.395 . . . . 1.0 109.933 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.448 HD13 ' CE2' ' A' ' 43' ' ' TRP . 24.0 tp -96.41 136.15 37.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.485 -0.932 . . . . 1.0 108.485 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.443 ' H ' HD12 ' A' ' 81' ' ' LEU . 2.2 mt -96.41 112.91 61.42 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.606 -0.516 . . . . 1.0 109.606 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -51.77 148.62 21.55 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 122.143 1.895 . . . . 1.0 113.224 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -71.03 179.44 2.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.452 -0.795 . . . . 1.0 110.301 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.2 t -171.91 153.24 3.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.906 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -100.59 -58.35 0.85 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.471 -1.052 . . . . 1.0 110.471 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 m -88.04 147.65 24.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 1.0 110.244 179.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -136.06 114.69 11.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 1.0 110.94 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -142.29 133.76 26.55 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.195 -0.298 . . . . 1.0 110.195 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.515 HD12 HG22 ' A' ' 126' ' ' VAL . 16.9 tt -145.93 143.29 21.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.387 -0.37 . . . . 1.0 111.007 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -121.58 101.75 7.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.447 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.9 mt -82.89 139.29 33.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.964 -0.562 . . . . 1.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.471 ' CE1' ' CG ' ' A' ' 102' ' ' MET . 67.7 m-85 -115.15 136.96 52.55 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.527 0.679 . . . . 1.0 111.276 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.614 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 17.4 pt-20 -58.48 -47.12 85.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.278 -0.874 . . . . 1.0 110.354 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.493 ' N ' ' CG ' ' A' ' 94' ' ' GLU . 24.7 mtt85 -115.22 165.91 12.42 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.086 -0.506 . . . . 1.0 111.089 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.641 ' O ' ' O ' ' A' ' 97' ' ' ASP . 95.7 mt-10 -52.91 159.07 1.22 Allowed 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 115.312 -0.858 . . . . 1.0 110.354 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.791 ' O ' ' N ' ' A' ' 99' ' ' ARG . 53.3 t0 50.66 124.94 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.703 0 O-C-N 124.235 0.959 . . . . 1.0 108.686 -179.104 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.2 OUTLIER -35.0 73.51 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.292 -0.413 . . . . 1.0 111.501 -177.868 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.791 ' N ' ' O ' ' A' ' 97' ' ' ASP . 10.3 ptm180 -139.68 169.99 16.72 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 120.636 -0.426 . . . . 1.0 109.917 -178.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 69.94 -161.98 52.82 Favored Glycine 0 CA--C 1.521 0.413 0 N-CA-C 110.828 -0.909 . . . . 1.0 110.828 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.614 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 11.6 tp-100 -61.39 139.45 58.19 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.917 -0.313 . . . . 1.0 110.205 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.724 ' SD ' ' N ' ' A' ' 103' ' ' ILE . 4.3 tmm? -131.73 137.66 48.32 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.585 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.724 ' N ' ' SD ' ' A' ' 102' ' ' MET . 8.3 tt -134.37 137.41 51.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.094 -0.706 . . . . 1.0 109.094 178.134 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -111.33 146.88 36.3 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.526 0.679 . . . . 1.0 110.362 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.838 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 89.0 m-85 -130.27 155.67 45.93 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.037 -0.983 . . . . 1.0 110.466 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.6 p -143.77 27.76 1.47 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.681 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.408 ' CD ' ' N ' ' A' ' 107' ' ' GLU . 1.4 pm0 -168.08 -167.68 0.86 Allowed 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.713 -0.395 . . . . 1.0 110.47 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -81.64 147.34 29.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.419 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.521 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 3.2 m -139.16 97.05 3.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.44 -30.88 71.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.901 0.382 . . . . 1.0 110.983 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 51.5 m -137.74 93.14 2.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.982 -0.553 . . . . 1.0 110.511 -179.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.838 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 13.4 tp -60.59 -39.19 87.19 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.448 -0.796 . . . . 1.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.634 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.3 mp0 -43.86 -13.49 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.634 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 112' ' ' LEU . 93.6 m-20 -93.82 2.07 56.29 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.189 0.519 . . . . 1.0 110.751 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.3 mmt180 -133.59 -39.87 0.89 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.886 -1.052 . . . . 1.0 112.654 -177.019 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.727 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -123.1 136.08 54.65 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 122.061 0.934 . . . . 1.0 111.136 -179.036 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 118' ' ' PHE . 20.3 mmm180 -72.44 -70.09 0.36 Allowed 'General case' 0 C--N 1.315 -0.898 0 O-C-N 121.059 -1.026 . . . . 1.0 110.367 -178.438 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.672 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 61.0 m-85 -31.51 143.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.618 0.574 . . . . 1.0 110.187 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 88.8 m-20 -105.03 6.79 33.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.998 0.428 . . . . 1.0 110.522 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -139.74 139.86 36.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.937 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.726 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.0 mm -120.11 120.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.385 -0.825 . . . . 1.0 109.108 178.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -110.59 22.29 15.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 1.0 111.584 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.478 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.8 p 169.08 151.71 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.071 0.463 . . . . 1.0 110.015 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.475 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.0 OUTLIER -161.96 157.11 23.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 1.0 110.183 -178.528 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 -125.01 117.67 24.53 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.515 HG22 HD12 ' A' ' 90' ' ' ILE . 22.0 t -101.59 105.07 17.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 109.597 -0.52 . . . . 1.0 109.597 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.902 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.8 OUTLIER -78.54 -40.95 33.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.787 -0.642 . . . . 1.0 111.494 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.7 mm-40 -139.69 167.3 22.42 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.443 0.639 . . . . 1.0 110.633 -178.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 44.26 -179.49 0.01 OUTLIER Glycine 0 C--N 1.315 -0.637 0 CA-C-N 113.911 -1.495 . . . . 1.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 20.2 m -119.4 149.63 41.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.358 -0.608 . . . . 1.0 109.358 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.459 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 37.2 m95 -121.61 167.19 13.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.822 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.613 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.0 p -141.8 96.5 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.911 -0.315 . . . . 1.0 110.917 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 7.7 mt -66.53 142.63 57.45 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.389 -0.524 . . . . 1.0 110.966 -178.115 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -117.8 129.96 55.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.773 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -43.21 -49.11 6.62 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.053 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.39 175.45 7.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.197 0.522 . . . . 1.0 110.559 -179.122 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -81.81 172.78 12.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.562 -0.745 . . . . 1.0 110.508 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 38.4 m-20 63.44 17.65 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.29 -0.868 . . . . 1.0 110.278 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.419 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 7.4 m-85 36.29 77.89 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.174 -0.467 . . . . 1.0 111.71 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.45 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 52.9 ttm-85 -147.0 39.87 1.04 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.953 0.406 . . . . 1.0 110.64 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.452 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -154.51 -138.62 2.65 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.105 -0.798 . . . . 1.0 111.105 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -79.27 169.59 17.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.93 0.395 . . . . 1.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.94 137.91 21.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.747 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 17.8 m-85 -125.48 137.97 53.98 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 108.609 -0.886 . . . . 1.0 108.609 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.585 ' C ' HD22 ' A' ' 146' ' ' LEU . 38.5 tp -95.05 126.37 40.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.339 0.59 . . . . 1.0 111.149 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.838 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.6 mm? -114.33 109.31 18.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.208 -0.905 . . . . 1.0 109.832 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -83.26 166.66 33.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 116.295 -0.411 . . . . 1.0 110.1 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -62.01 114.03 2.13 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.979 1.786 . . . . 1.0 111.223 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.43 -150.87 11.3 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.587 -1.005 . . . . 1.0 110.587 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 66.6 t0 -128.56 134.62 48.68 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.815 0.34 . . . . 1.0 110.551 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.6 m-85 -125.95 131.4 52.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.209 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -117.22 -1.31 11.86 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.952 0.406 . . . . 1.0 110.419 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 13.4 ptm180 -157.16 165.3 36.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.892 -0.595 . . . . 1.0 110.402 179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.458 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 14.4 p90 -79.39 -20.77 46.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.261 -0.881 . . . . 1.0 112.253 -177.772 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 -68.6 -19.61 64.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 1.0 111.218 -179.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -51.37 -48.81 62.42 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.894 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.723 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 17.8 p90 -97.64 20.74 11.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.714 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.92 75.57 0.21 Allowed Glycine 0 CA--C 1.518 0.223 0 N-CA-C 111.125 -0.79 . . . . 1.0 111.125 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.723 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.84 149.59 40.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 121.069 0.461 . . . . 1.0 110.274 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.3 t -79.11 -12.46 60.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.354 -0.839 . . . . 1.0 110.238 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.53 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 9.0 t-20 -170.5 -171.25 1.04 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.996 0.427 . . . . 1.0 110.486 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.726 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.98 -8.83 15.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.624 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -48.37 123.88 7.18 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 121.498 0.666 . . . . 1.0 111.171 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 41.5 t -131.28 133.78 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.924 178.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -111.19 -31.18 2.92 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 111.715 -0.554 . . . . 1.0 111.715 -179.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 9.3 p -158.84 -169.46 2.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.763 0.316 . . . . 1.0 110.462 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.547 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -173.03 138.1 0.74 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.794 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.613 ' O ' HG12 ' A' ' 132' ' ' VAL . 0.3 OUTLIER -129.6 141.96 50.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.57 0.7 . . . . 1.0 109.878 179.414 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.84 ' CD ' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -77.22 145.91 37.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.155 178.135 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.476 ' C ' HD12 ' A' ' 171' ' ' ILE . 48.7 t -82.52 88.32 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.691 -0.404 . . . . 1.0 111.839 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.476 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.1 mp -144.27 111.61 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.187 -0.46 . . . . 1.0 110.496 179.368 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -68.4 -35.52 77.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.512 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -59.34 -78.48 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.951 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 63.3 m . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.942 -1.028 . . . . 1.0 110.532 179.956 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLN . . . . . 0.497 ' O ' ' O ' ' A' ' 2' ' ' GLY . 12.9 pt20 . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.586 -0.524 . . . . 1.0 109.586 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.497 ' O ' ' O ' ' A' ' 1' ' ' GLN . . . 50.4 168.63 0.01 OUTLIER Glycine 0 C--N 1.334 0.463 0 N-CA-C 110.752 -0.939 . . . . 1.0 110.752 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 tttt -176.34 100.87 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.498 -0.481 . . . . 1.0 110.319 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -118.89 165.38 14.26 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.659 -179.401 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.472 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.9 m -124.0 120.3 32.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.542 -0.91 . . . . 1.0 108.542 177.48 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.4 mt -104.11 132.87 49.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.94 -1.027 . . . . 1.0 109.845 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.472 ' CE1' HG22 ' A' ' 5' ' ' THR . 67.1 m-85 -115.05 124.99 53.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.938 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -52.71 -29.85 29.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.596 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -117.23 154.96 30.26 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.112 0.482 . . . . 1.0 110.298 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 12' ' ' PHE . 11.5 ptm180 -59.86 -172.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.548 -0.751 . . . . 1.0 110.362 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.11 25.71 0.27 Allowed Glycine 0 N--CA 1.461 0.336 0 N-CA-C 111.086 -0.805 . . . . 1.0 111.086 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.55 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 51.44 69.17 0.69 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.527 -0.337 . . . . 1.0 110.25 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -131.28 -156.58 0.76 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.032 0.444 . . . . 1.0 110.521 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.12 -153.15 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.071 -0.812 . . . . 1.0 111.071 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -69.25 148.33 49.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.74 0.305 . . . . 1.0 110.712 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -136.64 152.57 50.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.138 0.494 . . . . 1.0 110.453 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.526 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -145.13 140.98 28.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.2 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.526 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.8 tt0 -110.3 123.63 50.17 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.269 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.499 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.2 t -112.58 127.0 55.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.737 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.7 t -118.06 15.52 14.16 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.026 -0.533 . . . . 1.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.1 p -158.89 167.58 29.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.458 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.458 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 54.1 p-10 -57.75 141.36 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.502 -0.772 . . . . 1.0 111.388 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.499 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.43 145.14 44.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.198 179.693 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 p -112.16 -16.66 12.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.735 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 29.1 t-20 -150.8 120.34 6.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.1 0.476 . . . . 1.0 110.624 -179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.3 mt -119.1 0.11 11.19 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 31.5 mt-30 -48.41 -52.13 45.62 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.784 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.617 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.8 Cg_endo -54.55 -32.58 74.92 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.933 1.756 . . . . 1.0 112.22 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -94.37 -52.37 4.37 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 120.527 -0.469 . . . . 1.0 110.555 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.2 mt -116.95 127.07 53.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.714 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -95.13 -10.56 30.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.47 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.529 ' NH2' ' OD1' ' A' ' 74' ' ' ASP . 3.0 tpt85 -145.55 -61.97 0.34 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.28 -0.418 . . . . 1.0 111.475 -178.333 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.8 t 66.83 81.32 0.2 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.779 -0.452 . . . . 1.0 109.779 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.517 ' OD1' ' CE1' ' A' ' 66' ' ' HIS . 2.4 t30 -96.93 1.78 50.84 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 120.687 0.28 . . . . 1.0 110.966 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.55 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.9 t -155.2 156.51 35.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.835 0.35 . . . . 1.0 110.087 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.4 153.72 34.15 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.912 -0.585 . . . . 1.0 110.926 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.409 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.5 mtp180 -136.05 123.41 21.94 Favored 'General case' 0 C--O 1.206 -1.189 0 N-CA-C 109.347 -0.612 . . . . 1.0 109.347 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.542 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.5 p -109.66 132.0 59.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.036 0.446 . . . . 1.0 110.259 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -85.41 -42.59 14.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.231 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 t -163.95 150.42 11.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.937 -0.394 . . . . 1.0 109.937 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.56 177.81 42.73 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 110.745 -0.942 . . . . 1.0 110.745 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -111.85 140.8 46.2 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.594 -0.521 . . . . 1.0 109.594 178.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.409 ' CE2' HD13 ' A' ' 81' ' ' LEU . 57.2 m95 -128.46 133.75 48.58 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.495 0.664 . . . . 1.0 111.355 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.572 ' C ' HD12 ' A' ' 45' ' ' LEU . 27.5 tpp -107.45 129.37 54.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.294 -0.866 . . . . 1.0 109.233 178.49 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.572 HD12 ' C ' ' A' ' 44' ' ' MET . 9.9 mp -109.32 130.86 55.48 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.868 -0.605 . . . . 1.0 109.832 -179.239 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -111.09 130.65 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 1.0 111.402 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.634 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 9.3 pt-20 -56.69 -37.26 70.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.767 -0.651 . . . . 1.0 111.214 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 5.2 mt-30 -106.29 153.53 40.33 Favored Pre-proline 0 C--O 1.233 0.203 0 CA-C-N 115.83 -0.623 . . . . 1.0 110.688 -178.661 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.26 159.23 48.21 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.386 2.058 . . . . 1.0 112.208 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.5 m-20 62.4 45.04 6.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.744 -0.662 . . . . 1.0 111.149 179.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 42.96 74.93 0.1 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.419 -0.81 . . . . 1.0 110.837 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 m -145.38 157.31 44.05 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.061 0.458 . . . . 1.0 109.867 -178.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.7 -148.15 23.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.732 -0.746 . . . . 1.0 111.683 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.634 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.7 tp -76.83 142.41 40.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.44 -0.38 . . . . 1.0 110.202 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -119.41 150.42 40.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.487 -0.19 . . . . 1.0 110.487 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.43 ' C ' ' SD ' ' A' ' 44' ' ' MET . 18.5 m-85 -126.18 124.15 39.82 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 116.52 -0.309 . . . . 1.0 110.771 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.406 ' C ' HD12 ' A' ' 58' ' ' LEU . 46.6 t80 -84.23 123.64 30.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.255 -0.43 . . . . 1.0 109.893 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.5 mp -118.32 147.33 43.59 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.82 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' A' ' 60' ' ' ARG . 31.4 mtm-85 -134.74 155.02 51.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.89 -178.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' A' ' 59' ' ' ARG . 27.7 tpt85 -32.41 125.46 0.31 Allowed 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.542 0.526 . . . . 1.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.542 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 153.62 -177.34 31.2 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.242 -1.143 . . . . 1.0 110.242 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -115.6 136.18 53.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.825 0.345 . . . . 1.0 110.186 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -128.25 112.41 14.46 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.819 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.51 -4.57 55.34 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.677 -0.692 . . . . 1.0 111.339 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 19.6 m-20 -147.14 141.94 26.81 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.417 -0.586 . . . . 1.0 109.417 179.361 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.517 ' CE1' ' OD1' ' A' ' 34' ' ' ASN . 29.9 p-80 -63.6 -39.92 95.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.979 0.419 . . . . 1.0 111.367 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -54.43 -6.77 0.12 Allowed 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.244 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.496 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.3 mm-40 -83.65 -35.28 24.7 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.676 -0.41 . . . . 1.0 111.402 -177.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.477 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -95.92 19.53 11.36 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 119.229 -0.415 . . . . 1.0 110.978 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.45 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 48.6 mtt 81.46 12.15 0.73 Allowed 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.91 0.756 . . . . 1.0 110.35 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.403 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -60.14 102.39 0.35 Allowed Glycine 0 C--N 1.342 0.88 0 C-N-CA 120.548 -0.834 . . . . 1.0 111.152 179.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 44.9 mt -80.55 -34.69 35.23 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.79 -0.448 . . . . 1.0 109.79 177.096 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 86.8 p -121.34 109.73 15.26 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.978 -0.749 . . . . 1.0 108.978 178.607 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.529 ' OD1' ' NH2' ' A' ' 32' ' ' ARG . 50.9 p-10 -69.58 50.84 0.1 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.964 -0.562 . . . . 1.0 110.496 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.525 ' O ' ' C ' ' A' ' 76' ' ' VAL . 2.1 m -111.31 -47.13 3.22 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.548 -0.297 . . . . 1.0 111.336 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' VAL . . . . . 0.525 ' C ' ' O ' ' A' ' 75' ' ' SER . 1.4 p 19.6 92.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 123.979 0.799 . . . . 1.0 110.487 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -102.24 8.74 40.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.795 -0.362 . . . . 1.0 110.656 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.2 p -163.81 162.69 23.89 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.068 0.461 . . . . 1.0 110.828 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.3 p -155.34 146.88 23.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.689 -0.687 . . . . 1.0 110.273 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.3 ptm180 -128.4 150.05 50.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.455 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.409 HD13 ' CE2' ' A' ' 43' ' ' TRP . 38.0 tp -96.99 133.94 41.0 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.033 -0.729 . . . . 1.0 109.033 177.833 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.0 mt -97.18 112.7 61.6 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.6 149.92 12.84 Favored 'Trans proline' 0 N--CA 1.499 1.817 0 C-N-CA 122.353 2.035 . . . . 1.0 112.983 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -71.82 -178.07 2.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.515 -0.766 . . . . 1.0 110.32 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.0 m -163.98 157.93 19.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.207 -0.452 . . . . 1.0 110.747 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.98 -76.62 1.33 Allowed Glycine 0 CA--C 1.52 0.37 0 N-CA-C 110.229 -1.149 . . . . 1.0 110.229 179.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 m -85.96 156.53 20.44 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 109.718 -0.475 . . . . 1.0 109.718 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -128.94 109.02 10.88 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 121.061 -0.256 . . . . 1.0 111.166 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -138.46 141.9 39.46 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 120.384 -0.526 . . . . 1.0 110.516 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.486 HD12 HG22 ' A' ' 126' ' ' VAL . 19.4 tt -155.52 149.86 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.491 -0.322 . . . . 1.0 110.637 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.518 ' HE ' ' CB ' ' A' ' 125' ' ' ASN . 22.8 ptt180 -131.47 103.94 6.7 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.558 0.694 . . . . 1.0 111.048 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.59 150.15 26.11 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.598 -0.728 . . . . 1.0 111.801 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.443 ' CG ' ' HA ' ' A' ' 98' ' ' TYR . 99.6 m-85 -122.55 136.93 55.01 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.26 -0.882 . . . . 1.0 111.371 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.23 -52.95 61.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.276 -0.875 . . . . 1.0 111.017 179.55 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.631 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 74.5 mtp180 -109.12 177.02 4.88 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 120.843 0.354 . . . . 1.0 110.138 -178.378 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.627 ' O ' ' O ' ' A' ' 97' ' ' ASP . 57.6 mp0 -61.1 161.17 8.97 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 115.45 -0.796 . . . . 1.0 110.229 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.767 ' O ' ' N ' ' A' ' 99' ' ' ARG . 33.9 t70 50.31 125.2 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.736 0 O-C-N 124.305 1.003 . . . . 1.0 108.843 -179.223 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.485 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.6 OUTLIER -40.58 73.63 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.312 -177.69 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.767 ' N ' ' O ' ' A' ' 97' ' ' ASP . 13.8 ptm180 -127.18 -159.75 0.96 Allowed 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.922 -0.399 . . . . 1.0 109.922 -178.257 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 100' ' ' GLY . . . . . 0.404 ' O ' ' O ' ' A' ' 99' ' ' ARG . . . 36.91 -157.19 0.01 OUTLIER Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.076 -0.809 . . . . 1.0 111.076 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.466 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 66.4 tp60 -65.91 148.67 51.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.554 0.692 . . . . 1.0 111.174 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.64 149.17 47.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.34 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.519 HG21 ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -140.5 140.46 34.09 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 109.437 -0.579 . . . . 1.0 109.437 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -113.71 132.09 55.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.369 0.604 . . . . 1.0 110.935 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.485 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 96.9 m-85 -116.06 155.87 27.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 114.658 -1.155 . . . . 1.0 110.106 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.2 p -144.38 20.18 1.71 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.532 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -159.43 -170.8 3.07 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.595 -0.442 . . . . 1.0 110.109 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.452 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 53.6 p-10 -73.82 141.83 46.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 1.0 111.2 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.414 ' O ' ' OH ' ' A' ' 139' ' ' TYR . 2.8 m -131.17 118.91 21.14 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.259 -0.645 . . . . 1.0 109.259 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.6 p -95.86 -22.42 17.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 1.0 111.006 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 50.3 t -146.07 96.82 2.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.299 0.571 . . . . 1.0 111.839 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.572 HD11 HD22 ' A' ' 167' ' ' LEU . 8.3 mt -62.45 -41.19 98.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.025 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 9.4 mm100 -45.15 -12.58 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.139 -0.482 . . . . 1.0 111.098 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 112' ' ' LEU . 64.5 t0 -96.77 -27.18 14.85 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.958 0.409 . . . . 1.0 110.508 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.4 mmt180 -108.77 -40.64 4.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.103 -0.498 . . . . 1.0 111.497 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.519 ' CD1' HG21 ' A' ' 103' ' ' ILE . 5.9 t80 -121.94 118.52 29.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.208 0.528 . . . . 1.0 110.341 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -56.51 -69.07 0.16 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.215 -0.902 . . . . 1.0 111.079 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -39.72 138.46 0.74 Allowed 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 110.059 -0.348 . . . . 1.0 110.059 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 38.1 t30 -99.81 -0.41 39.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.515 -0.312 . . . . 1.0 111.038 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -125.52 138.36 53.97 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.538 0.685 . . . . 1.0 110.854 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.5 mm -121.17 119.01 58.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 CA-C-N 114.973 -1.012 . . . . 1.0 109.617 178.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.417 ' O ' ' CB ' ' A' ' 123' ' ' SER . 23.0 m-70 -110.92 22.02 15.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.694 -0.685 . . . . 1.0 111.675 -178.802 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.565 ' C ' HD13 ' A' ' 124' ' ' LEU . 1.8 p 166.97 152.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.865 0.364 . . . . 1.0 110.651 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.653 ' N ' HD13 ' A' ' 124' ' ' LEU . 0.0 OUTLIER -162.32 163.94 27.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.557 -179.518 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.518 ' CB ' ' HE ' ' A' ' 91' ' ' ARG . 4.5 t-20 -126.92 116.06 20.24 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.009 -0.737 . . . . 1.0 109.009 179.634 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.486 HG22 HD12 ' A' ' 90' ' ' ILE . 58.0 t -99.72 106.38 19.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 O-C-N 123.553 0.533 . . . . 1.0 110.649 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.896 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.99 -42.74 23.3 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 124.025 0.828 . . . . 1.0 110.556 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -157.77 145.38 18.54 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.457 -0.497 . . . . 1.0 110.625 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.516 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 72.6 82.83 0.29 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 115.827 -0.624 . . . . 1.0 113.061 177.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.461 ' O ' ' O ' ' A' ' 129' ' ' GLY . 13.7 t -31.51 150.24 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.162 0.506 . . . . 1.0 110.616 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.516 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 53.3 m95 -124.12 163.49 21.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.13 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 46.4 t -134.22 137.93 50.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-N 115.881 -0.6 . . . . 1.0 109.479 179.188 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.641 ' HG ' HD11 ' A' ' 146' ' ' LEU . 28.5 mt -109.02 140.39 42.6 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 109.166 -0.679 . . . . 1.0 109.166 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 134' ' ' TYR . . . . . 0.624 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 30.8 m-85 -117.27 132.36 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.89 0.376 . . . . 1.0 110.875 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.439 ' OE2' ' CZ ' ' A' ' 163' ' ' ARG . 84.6 tt0 -40.7 -55.18 2.45 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.053 -0.522 . . . . 1.0 111.08 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.575 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -121.26 172.84 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.122 0.487 . . . . 1.0 110.098 -178.87 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.42 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -74.7 169.5 17.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.546 179.297 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 138' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.9 t30 66.96 15.77 10.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.231 -0.895 . . . . 1.0 110.019 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 109' ' ' CYS . 2.5 m-85 40.21 80.66 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 1.0 111.698 179.224 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.548 ' C ' HD11 ' A' ' 136' ' ' LEU . 61.8 ttt180 -149.89 40.57 0.81 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.2 0.524 . . . . 1.0 109.786 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -150.84 -140.43 3.18 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.281 -0.728 . . . . 1.0 111.281 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.442 ' C ' HE21 ' A' ' 143' ' ' GLN . 80.7 mtp85 -76.25 171.25 14.86 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 110.121 -0.325 . . . . 1.0 110.121 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.442 HE21 ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -150.3 137.42 19.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.012 -179.706 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 144' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 6.8 m-85 -127.52 141.28 51.69 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.195 -0.668 . . . . 1.0 109.195 178.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 59.1 tp -93.83 126.78 39.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.422 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.641 HD11 ' HG ' ' A' ' 133' ' ' LEU . 13.4 mt -116.33 90.46 3.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.83 -0.623 . . . . 1.0 109.397 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.6 mtm -73.59 161.61 78.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.939 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -49.94 113.58 1.05 Allowed 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.934 1.756 . . . . 1.0 111.31 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 173.08 -152.28 15.68 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.454 -1.058 . . . . 1.0 110.454 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.462 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 p-10 -135.48 127.19 29.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.831 0.348 . . . . 1.0 111.248 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 1.8 m-85 -118.58 133.66 55.7 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 109.385 -0.598 . . . . 1.0 109.385 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -112.85 -4.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.814 0.34 . . . . 1.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -153.42 162.81 40.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.251 0.548 . . . . 1.0 110.208 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.615 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.04 -19.83 59.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.134 -0.939 . . . . 1.0 112.202 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.557 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -67.48 -20.88 65.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.85 -179.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -51.64 -47.94 63.54 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 120.252 -0.579 . . . . 1.0 110.793 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.637 ' CZ3' HD11 ' A' ' 124' ' ' LEU . 37.9 p90 -101.9 18.53 20.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 1.0 110.305 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.69 77.85 0.13 Allowed Glycine 0 C--N 1.331 0.265 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.615 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . . . -96.12 -170.42 2.11 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.093 0.473 . . . . 1.0 109.995 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -34.92 2.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.462 -0.79 . . . . 1.0 111.621 -179.16 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.673 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 20.8 t-20 -150.17 -15.81 0.25 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.85 0.315 . . . . 1.0 111.85 -178.86 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.745 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 88.52 -23.61 0.11 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.787 -0.642 . . . . 1.0 110.827 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.439 ' CZ ' ' OE2' ' A' ' 135' ' ' GLU . 34.2 ptt180 -42.17 119.4 1.35 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.568 0.699 . . . . 1.0 110.866 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.745 HG23 ' O ' ' A' ' 162' ' ' ALA . 30.4 t -121.33 132.09 71.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.504 -0.771 . . . . 1.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -108.73 -26.87 5.15 Favored Glycine 0 N--CA 1.465 0.608 0 N-CA-C 111.338 -0.705 . . . . 1.0 111.338 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.7 p -163.88 169.02 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.961 0.41 . . . . 1.0 110.784 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.572 HD22 HD11 ' A' ' 112' ' ' LEU . 0.5 OUTLIER -153.32 146.38 24.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.899 -0.592 . . . . 1.0 111.552 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.624 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 7.0 ptp180 -136.94 148.8 47.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.615 -0.513 . . . . 1.0 109.615 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.873 HH11 ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -82.06 152.59 26.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.219 -0.901 . . . . 1.0 109.622 177.735 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.793 ' C ' HD12 ' A' ' 171' ' ' ILE . 59.2 t -85.67 85.23 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.935 0.398 . . . . 1.0 111.453 -179.22 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.793 HD12 ' C ' ' A' ' 170' ' ' VAL . 2.3 mp -136.65 117.86 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.35 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' A' ' 172' ' ' ASP . 64.0 t0 -66.9 -39.91 87.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.43 -0.805 . . . . 1.0 110.32 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -58.43 -81.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.364 -0.38 . . . . 1.0 110.937 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.932 -1.032 . . . . 1.0 110.472 179.698 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 109.268 -0.642 . . . . 1.0 109.268 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.568 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -91.95 178.71 40.8 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.504 -1.038 . . . . 1.0 110.504 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -172.92 106.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.062 -0.255 . . . . 1.0 110.698 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.454 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.55 173.31 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 120.813 0.34 . . . . 1.0 111.264 -179.311 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.543 HG22 ' CE1' ' A' ' 7' ' ' TYR . 33.5 m -130.24 120.96 25.27 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.456 -0.942 . . . . 1.0 108.456 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -105.91 133.09 51.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.044 -0.98 . . . . 1.0 110.058 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.543 ' CE1' HG22 ' A' ' 5' ' ' THR . 56.9 m-85 -114.29 129.55 56.64 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.553 -0.749 . . . . 1.0 111.231 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 79.4 tt0 -56.15 -20.98 19.95 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.789 . . . . 1.0 110.324 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -127.14 154.56 44.6 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.146 0.498 . . . . 1.0 110.086 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 12' ' ' PHE . 29.0 ptt85 -58.95 -172.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.619 -0.719 . . . . 1.0 110.299 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.15 26.1 0.16 Allowed Glycine 0 N--CA 1.463 0.44 0 N-CA-C 111.083 -0.807 . . . . 1.0 111.083 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.436 ' N ' ' O ' ' A' ' 10' ' ' ARG . 5.7 m-85 50.54 66.99 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.934 -0.395 . . . . 1.0 109.934 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -126.15 -155.84 0.7 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.825 0.345 . . . . 1.0 110.469 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 39.78 -149.1 0.14 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -71.19 149.0 46.75 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.906 0.384 . . . . 1.0 110.497 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.1 p80 -135.01 144.78 47.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.353 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.561 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.5 t80 -140.94 142.34 34.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 1.0 110.039 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.561 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 40.5 tt0 -110.82 122.1 47.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.269 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.46 127.21 54.24 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.187 -0.461 . . . . 1.0 110.513 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -117.56 14.6 14.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 95.5 p -159.62 169.17 24.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.538 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 81' ' ' LEU . 47.7 m-20 -57.82 139.88 53.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.722 -0.672 . . . . 1.0 110.884 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.83 148.58 50.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.552 -0.749 . . . . 1.0 110.146 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -118.84 -18.84 8.8 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.654 -0.703 . . . . 1.0 112.07 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -143.87 108.66 4.91 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.197 0.522 . . . . 1.0 109.954 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 26.0 mt -111.78 0.41 16.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.747 -0.661 . . . . 1.0 110.172 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.8 mt-30 -55.28 -42.97 98.71 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.621 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.3 Cg_exo -58.85 -36.89 96.22 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.277 1.985 . . . . 1.0 112.029 -179.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -93.33 -44.61 8.21 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.962 0.41 . . . . 1.0 111.067 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.74 127.8 49.67 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.766 -0.652 . . . . 1.0 111.444 -178.438 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -91.44 -11.41 37.69 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.143 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 42.0 ttm180 -176.16 120.39 0.16 Allowed 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t -101.49 107.42 18.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.115 -0.366 . . . . 1.0 110.394 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -103.56 -4.71 23.54 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.375 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.6 p -156.18 156.41 34.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.965 0.412 . . . . 1.0 110.333 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.84 155.14 36.54 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.897 -0.592 . . . . 1.0 110.997 -179.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.3 mtt-85 -136.03 122.34 20.51 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.74 -0.664 . . . . 1.0 109.567 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.481 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.4 p -110.47 129.39 65.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.981 0.42 . . . . 1.0 110.948 179.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -81.06 -46.02 15.63 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.453 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.5 t -162.37 153.33 17.55 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.018 -0.364 . . . . 1.0 110.018 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.54 175.27 43.17 Favored Glycine 0 C--N 1.32 -0.357 0 N-CA-C 110.876 -0.89 . . . . 1.0 110.876 179.385 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 84.5 m -111.0 132.36 54.27 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.209 -0.663 . . . . 1.0 109.209 178.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.526 ' CE2' HD13 ' A' ' 81' ' ' LEU . 50.3 m95 -118.62 146.93 44.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 1.0 111.195 -179.075 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.587 ' C ' HD12 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -117.99 127.18 53.57 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 109.246 -0.649 . . . . 1.0 109.246 178.876 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.587 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -108.27 127.38 53.8 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.53 -0.544 . . . . 1.0 109.53 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -103.88 131.12 51.4 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.579 0.704 . . . . 1.0 111.429 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.593 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.1 pt-20 -60.53 -35.34 75.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.908 -1.042 . . . . 1.0 109.557 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.418 ' O ' ' OG ' ' A' ' 78' ' ' SER . 6.8 mt-30 -102.24 152.59 38.3 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.066 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 18.1 Cg_endo -56.94 151.16 51.01 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.752 1.635 . . . . 1.0 110.796 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.584 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.6 m120 70.26 -116.11 0.1 Allowed 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.241 -1.022 . . . . 1.0 108.241 -177.711 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -152.83 70.94 0.9 Allowed 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 178.298 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.7 t -137.18 18.08 2.97 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 120.785 0.326 . . . . 1.0 110.888 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -134.68 -171.18 12.42 Favored Glycine 0 CA--C 1.519 0.341 0 N-CA-C 111.069 -0.812 . . . . 1.0 111.069 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.593 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.2 tp -58.54 151.03 21.32 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.524 -0.338 . . . . 1.0 110.153 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -121.08 149.24 43.03 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.631 0.253 . . . . 1.0 111.196 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -126.09 129.18 48.6 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 116.42 -0.355 . . . . 1.0 110.849 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.515 ' C ' HD22 ' A' ' 58' ' ' LEU . 21.8 t80 -82.94 120.43 25.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.419 0.628 . . . . 1.0 110.138 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.515 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.9 mm? -110.79 133.78 53.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.135 -0.939 . . . . 1.0 109.678 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.707 ' NH1' HH12 ' A' ' 168' ' ' ARG . 76.6 mtm180 -127.92 145.67 50.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.266 -0.879 . . . . 1.0 109.534 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.466 ' HA ' HG13 ' A' ' 38' ' ' VAL . 73.1 ttt-85 -31.71 126.8 0.22 Allowed 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.447 0.467 . . . . 1.0 111.323 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.481 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 152.09 -174.34 31.1 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.472 -1.051 . . . . 1.0 110.472 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.63 133.36 56.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.004 0.43 . . . . 1.0 110.353 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -127.39 113.33 16.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.042 -0.526 . . . . 1.0 109.646 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.39 -3.68 54.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.302 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -146.63 143.48 28.84 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.395 -0.594 . . . . 1.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.521 ' C ' ' H ' ' A' ' 68' ' ' GLN . 22.7 p-80 -66.03 -42.43 89.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 1.0 110.928 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -52.01 -7.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.802 -0.635 . . . . 1.0 110.449 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.521 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.5 mm-40 -82.38 -36.14 27.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.825 -0.35 . . . . 1.0 111.212 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.7 p90 -93.53 19.58 8.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 119.391 -0.338 . . . . 1.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.591 ' C ' ' H ' ' A' ' 72' ' ' LEU . 66.6 mtp 79.88 17.19 0.75 Allowed 'General case' 0 C--O 1.233 0.209 0 O-C-N 123.942 0.776 . . . . 1.0 109.749 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.573 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -64.23 29.81 0.09 OUTLIER Glycine 0 C--N 1.343 0.972 0 C-N-CA 120.898 -0.668 . . . . 1.0 112.123 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.591 ' H ' ' C ' ' A' ' 70' ' ' MET . 2.0 pp -22.47 -43.46 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.087 0.555 . . . . 1.0 110.891 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.573 ' N ' ' O ' ' A' ' 71' ' ' GLY . 12.2 t -116.12 118.07 31.84 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.532 -0.914 . . . . 1.0 108.532 177.609 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.534 ' CG ' ' H ' ' A' ' 75' ' ' SER . 32.8 t0 -70.23 -158.05 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.687 -0.405 . . . . 1.0 110.028 -179.035 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.548 ' O ' ' O ' ' A' ' 47' ' ' GLU . 0.8 OUTLIER 81.78 67.2 0.02 OUTLIER 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 120.741 0.305 . . . . 1.0 111.395 178.9 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 5.4 t -103.66 121.35 54.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 109.053 -0.721 . . . . 1.0 109.053 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.8 mtm180 -127.94 6.25 6.02 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.477 -178.576 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 11.5 p -161.65 159.98 28.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.147 0.498 . . . . 1.0 110.305 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.6 p -155.8 146.98 22.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.109 -178.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -127.26 145.51 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.862 -0.421 . . . . 1.0 109.862 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.568 HD21 ' H ' ' A' ' 2' ' ' GLY . 34.3 tp -95.04 134.36 37.81 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.052 -0.722 . . . . 1.0 109.052 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.497 HD11 ' SD ' ' A' ' 44' ' ' MET . 2.2 mt -95.33 113.53 61.83 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 109.543 -0.54 . . . . 1.0 109.543 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -51.24 147.54 20.76 Favored 'Trans proline' 0 N--CA 1.498 1.763 0 C-N-CA 122.257 1.971 . . . . 1.0 112.968 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.445 ' N ' ' ND1' ' A' ' 84' ' ' HIS . 2.1 m-70 -71.82 179.93 2.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.413 -0.812 . . . . 1.0 110.39 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.0 t -172.15 156.75 4.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.716 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -102.75 -59.04 0.75 Allowed Glycine 0 N--CA 1.466 0.665 0 N-CA-C 110.494 -1.043 . . . . 1.0 110.494 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m -85.89 148.06 25.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.767 0.318 . . . . 1.0 110.377 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.537 ' CD2' HD11 ' A' ' 171' ' ' ILE . 5.5 m80 -136.54 111.9 9.18 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.341 -0.39 . . . . 1.0 110.981 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 43.5 mtm-85 -142.32 139.21 31.75 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.755 -0.378 . . . . 1.0 110.425 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.4 tt -152.81 153.63 8.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.063 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -133.36 112.96 12.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.294 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.82 ' N ' HD22 ' A' ' 92' ' ' LEU . 1.5 mm? -88.92 123.47 33.3 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.419 -0.809 . . . . 1.0 109.821 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.585 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 26.6 m-85 -100.04 135.43 41.47 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 115.308 -0.86 . . . . 1.0 110.757 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.486 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.5 tm-20 -57.2 -60.58 3.4 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.585 -0.734 . . . . 1.0 111.394 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.466 ' O ' ' OG ' ' A' ' 123' ' ' SER . 84.4 mtp180 -102.2 166.8 10.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.748 -178.708 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -46.78 157.66 0.15 Allowed 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.641 -0.709 . . . . 1.0 110.711 178.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.65 ' O ' ' CD1' ' A' ' 98' ' ' TYR . 37.4 t70 58.03 -111.3 0.57 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.749 -1.114 . . . . 1.0 110.624 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.65 ' CD1' ' O ' ' A' ' 97' ' ' ASP . 3.9 m-85 -150.82 30.58 0.65 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.89 -0.411 . . . . 1.0 109.89 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -102.17 79.78 1.9 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.102 0.477 . . . . 1.0 110.412 -178.635 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 161.15 -172.14 37.34 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-N 115.469 -0.787 . . . . 1.0 111.142 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -62.12 143.15 57.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 121.071 -0.251 . . . . 1.0 110.392 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.585 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 11.3 ttp -133.38 149.57 51.84 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.814 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.411 ' N ' ' HG2' ' A' ' 102' ' ' MET . 11.0 tt -143.0 141.8 26.48 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 N-CA-C 109.57 -0.53 . . . . 1.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -113.93 143.98 43.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 1.0 110.715 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.66 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 82.6 m-85 -131.36 154.83 48.18 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.011 -0.995 . . . . 1.0 110.489 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.6 p -144.52 19.85 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.805 -0.634 . . . . 1.0 111.137 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 1.019 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.0 pt-20 -167.45 83.35 0.21 Allowed 'General case' 0 C--O 1.213 -0.865 0 CA-C-O 118.025 -0.988 . . . . 1.0 109.967 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 1.019 ' O ' ' O ' ' A' ' 107' ' ' GLU . 51.9 p30 16.49 163.0 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 122.359 1.076 . . . . 1.0 113.358 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 108' ' ' ASP . 8.8 m -146.66 107.17 4.07 Favored 'General case' 0 C--N 1.308 -1.235 0 O-C-N 120.18 -1.575 . . . . 1.0 109.545 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.416 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.6 p -66.33 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.317 -0.401 . . . . 1.0 110.969 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 15.7 t -142.52 88.9 2.1 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.13 0.491 . . . . 1.0 110.208 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.66 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 11.7 tp -61.55 -41.71 97.77 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 115.553 -0.749 . . . . 1.0 110.265 -178.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.644 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.5 mp0 -43.15 -10.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.258 -0.428 . . . . 1.0 111.719 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 112' ' ' LEU . 62.7 t0 -95.29 -21.81 18.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.055 0.455 . . . . 1.0 110.748 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 112' ' ' LEU . 25.2 mmt85 -108.86 -36.71 6.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.899 0.703 . . . . 1.0 112.899 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.706 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.16 138.37 54.24 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 122.2 1.0 . . . . 1.0 110.861 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.3 mmt-85 -75.33 -73.72 0.24 Allowed 'General case' 0 C--N 1.312 -1.041 0 O-C-N 120.641 -1.287 . . . . 1.0 110.62 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.683 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.4 m-85 -31.31 144.77 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.564 0 O-C-N 123.508 0.505 . . . . 1.0 110.314 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -105.6 9.25 33.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.826 0.346 . . . . 1.0 111.075 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -137.85 138.75 39.43 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.008 -0.542 . . . . 1.0 111.173 -178.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.734 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.6 mm -120.98 121.35 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.426 -0.807 . . . . 1.0 109.183 178.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -111.24 20.74 17.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.883 -0.599 . . . . 1.0 111.634 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 3.1 p 169.85 153.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.069 0.461 . . . . 1.0 110.273 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.434 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.5 pp -165.94 161.59 17.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.662 -0.699 . . . . 1.0 110.788 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 125' ' ' ASN . . . . . 0.471 HD22 HD11 ' A' ' 127' ' ' LEU . 3.0 t30 -128.55 120.85 27.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.368 -0.378 . . . . 1.0 110.152 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.0 t -100.93 105.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.1 -0.704 . . . . 1.0 109.1 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.915 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.44 -42.2 30.62 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.932 -0.576 . . . . 1.0 111.212 -179.507 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.0 mm-40 -138.8 166.97 23.03 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.534 0.683 . . . . 1.0 110.498 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 42.96 -176.99 0.01 OUTLIER Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.953 -1.476 . . . . 1.0 111.007 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.36 152.9 35.99 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.379 -0.6 . . . . 1.0 109.379 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 39.6 m95 -125.25 168.09 13.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.697 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 132' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 168' ' ' ARG . 1.9 p -141.83 99.27 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.733 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.57 141.08 56.93 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 120.275 -0.57 . . . . 1.0 110.789 -178.155 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -118.51 131.63 56.23 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.843 -0.617 . . . . 1.0 109.703 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -46.93 -49.17 20.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.033 -0.53 . . . . 1.0 111.679 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.53 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.2 175.63 6.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.318 0.58 . . . . 1.0 110.383 -178.957 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.7 p -82.7 170.68 14.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.437 -0.801 . . . . 1.0 110.355 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 138' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 138' ' ' ASN . 41.1 t-20 66.22 17.34 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.261 -179.431 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 37.13 79.25 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.0 111.751 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 28.2 ttm180 -149.59 39.24 0.79 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.026 0.441 . . . . 1.0 110.508 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.448 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -152.93 -143.11 3.61 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.374 -0.691 . . . . 1.0 111.374 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -74.41 168.45 19.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.985 0.421 . . . . 1.0 110.24 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.486 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 6.6 pt20 -150.57 141.35 22.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.77 -0.65 . . . . 1.0 111.449 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 144' ' ' TYR . . . . . 0.449 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.8 m-85 -131.02 139.33 49.95 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.494 -0.928 . . . . 1.0 108.494 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.617 ' C ' HD22 ' A' ' 146' ' ' LEU . 49.4 tp -92.67 126.47 37.77 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.634 0.584 . . . . 1.0 111.617 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.826 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.7 mm? -114.83 102.71 10.25 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.437 -0.802 . . . . 1.0 109.608 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 3.6 mtm -81.99 164.82 46.68 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.451 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.62 119.28 6.44 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 121.968 1.779 . . . . 1.0 111.312 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.65 -153.17 21.22 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.536 -1.026 . . . . 1.0 110.536 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -128.36 132.63 48.56 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.755 0.312 . . . . 1.0 110.387 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.466 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 33.5 m-85 -123.26 132.07 53.89 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.003 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -117.03 -6.72 11.39 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -153.05 163.96 38.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.34 0.591 . . . . 1.0 110.03 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.4 p90 -76.76 -20.55 56.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.061 -0.972 . . . . 1.0 112.239 -178.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -68.82 -19.64 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 1.0 111.065 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.76 -49.56 57.76 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.934 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.689 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 17.3 p90 -96.84 22.54 8.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.317 -0.402 . . . . 1.0 110.713 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 75.56 0.21 Allowed Glycine 0 CA--C 1.517 0.195 0 N-CA-C 111.223 -0.751 . . . . 1.0 111.223 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.689 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.37 147.05 43.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 110.26 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.9 t -78.21 -10.09 59.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.097 178.231 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.514 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 8.1 t-20 -171.99 -169.15 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.583 -0.447 . . . . 1.0 110.259 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.734 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -110.28 -18.86 13.18 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.375 -0.375 . . . . 1.0 110.659 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 162' ' ' ALA . 20.0 ptp180 -37.22 123.69 0.93 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.309 0.576 . . . . 1.0 111.695 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 162' ' ' ALA . 22.0 t -127.32 159.84 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.02 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.52 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -135.27 -35.7 0.23 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.689 -0.687 . . . . 1.0 111.543 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.416 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.6 m -158.88 -168.36 2.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.702 0.287 . . . . 1.0 110.278 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.521 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -173.36 134.24 0.52 Allowed 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.472 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.707 HH12 ' NH1' ' A' ' 59' ' ' ARG . 1.8 ttm180 -129.32 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.409 0.623 . . . . 1.0 109.643 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.421 ' H ' ' HG2' ' A' ' 169' ' ' ARG . 10.4 ptt180 -80.27 153.44 28.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.841 -1.072 . . . . 1.0 110.075 178.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.742 ' C ' HD12 ' A' ' 171' ' ' ILE . 47.9 t -90.33 86.03 2.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.861 0.363 . . . . 1.0 111.851 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.742 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.0 mp -140.29 115.92 7.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.264 179.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -66.89 -39.12 87.36 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.712 -0.677 . . . . 1.0 110.488 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -55.77 -79.75 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.133 -0.485 . . . . 1.0 110.747 -179.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 30.5 t . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 118.026 -0.988 . . . . 1.0 110.713 179.739 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 109.225 -0.657 . . . . 1.0 109.225 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.575 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -88.61 176.3 44.53 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.39 -1.084 . . . . 1.0 110.39 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -171.7 105.06 0.2 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.021 -0.271 . . . . 1.0 110.398 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 167.8 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.111 0.481 . . . . 1.0 111.399 -178.966 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.5 m -124.87 121.4 34.4 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.029 -1.1 . . . . 1.0 108.029 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -106.39 133.82 50.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.015 -0.993 . . . . 1.0 110.364 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.479 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.6 m-85 -115.8 126.85 54.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.539 -0.755 . . . . 1.0 111.256 -178.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -53.88 -28.07 34.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 1.0 110.515 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -119.45 151.4 38.61 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.433 0.635 . . . . 1.0 110.621 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.8 ptt-85 -56.87 -175.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 1.0 110.847 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.3 25.54 0.78 Allowed Glycine 0 N--CA 1.462 0.397 0 N-CA-C 110.912 -0.875 . . . . 1.0 110.912 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 51.61 67.16 1.0 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.198 -0.297 . . . . 1.0 110.198 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -128.86 -157.91 0.85 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.085 0.469 . . . . 1.0 110.555 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.59 -151.31 0.31 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.822 -0.911 . . . . 1.0 110.822 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -70.14 148.36 48.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.871 -0.332 . . . . 1.0 110.87 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -136.0 149.48 48.86 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.37 0.605 . . . . 1.0 110.374 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.4 t80 -143.95 142.45 30.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.255 -0.884 . . . . 1.0 110.014 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 70.5 tt0 -110.83 121.43 45.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.264 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -108.71 126.79 53.38 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.739 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.0 m -117.61 12.08 13.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.751 -0.659 . . . . 1.0 110.56 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.5 m -157.48 168.46 27.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.177 0.513 . . . . 1.0 110.447 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -58.51 140.7 53.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.054 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.71 148.99 49.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.966 -0.561 . . . . 1.0 110.338 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.6 p -118.79 -13.54 9.54 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.748 -0.66 . . . . 1.0 112.047 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -150.28 111.99 4.51 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.314 0.578 . . . . 1.0 109.773 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.3 mt -116.02 -0.55 12.73 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.402 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.2 mt-30 -53.16 -42.28 90.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.3 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 34.3 Cg_exo -58.23 -34.91 99.04 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.03 1.82 . . . . 1.0 111.548 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -95.98 -52.82 3.89 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 121.037 -0.265 . . . . 1.0 111.072 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -118.57 127.41 53.59 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.976 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -95.06 -7.52 39.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.794 -0.639 . . . . 1.0 111.955 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -146.75 -60.46 0.29 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.418 0.525 . . . . 1.0 112.418 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 50.3 t 64.99 75.38 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 122.499 0.319 . . . . 1.0 110.158 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -92.01 4.33 53.29 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.305 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -156.9 157.58 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.969 0.414 . . . . 1.0 110.19 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.81 154.46 32.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.813 -0.631 . . . . 1.0 111.336 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -132.1 121.0 23.1 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.83 -0.804 . . . . 1.0 108.83 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -107.21 114.82 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.63 0.582 . . . . 1.0 110.424 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.37 -44.37 45.34 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.101 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.1 p -160.91 159.07 29.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 109.38 -0.6 . . . . 1.0 109.38 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.14 175.79 50.8 Favored Glycine 0 C--N 1.315 -0.586 0 N-CA-C 111.026 -0.83 . . . . 1.0 111.026 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 85.6 m -113.46 136.99 52.19 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.0 -0.741 . . . . 1.0 109.0 178.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.528 ' CE2' HD13 ' A' ' 81' ' ' LEU . 58.2 m95 -124.66 142.42 51.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.247 0.546 . . . . 1.0 111.415 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.537 ' C ' HD23 ' A' ' 45' ' ' LEU . 10.4 tpp -115.91 129.01 56.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.331 -0.85 . . . . 1.0 109.164 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.537 HD23 ' C ' ' A' ' 44' ' ' MET . 1.0 OUTLIER -107.97 130.17 55.07 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -104.81 131.87 51.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.674 0.75 . . . . 1.0 111.17 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.547 ' O ' ' O ' ' A' ' 75' ' ' SER . 0.4 OUTLIER -60.33 -33.82 72.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 1.0 110.808 -178.159 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.611 ' NE2' ' O ' ' A' ' 49' ' ' PRO . 0.0 OUTLIER -108.54 154.64 41.46 Favored Pre-proline 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 1.0 108.861 -179.61 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.611 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 20.9 Cg_endo -56.38 148.76 60.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 121.372 1.381 . . . . 1.0 111.621 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.536 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.1 m-20 74.83 -123.92 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.812 -0.81 . . . . 1.0 108.812 -178.685 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -150.83 74.65 1.17 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.198 0.523 . . . . 1.0 110.695 179.061 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.493 ' H ' ' CD ' ' A' ' 48' ' ' GLN . 1.4 t -142.72 20.59 2.0 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.764 -0.653 . . . . 1.0 111.893 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -139.2 -159.53 8.03 Favored Glycine 0 N--CA 1.46 0.282 0 N-CA-C 111.181 -0.768 . . . . 1.0 111.181 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.596 HD21 HD21 ' A' ' 72' ' ' LEU . 46.5 tp -64.77 146.47 54.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.818 -0.353 . . . . 1.0 110.499 -178.795 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -122.73 150.5 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 1.0 110.971 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.574 ' OH ' HD23 ' A' ' 54' ' ' LEU . 63.7 m-85 -125.61 123.66 39.5 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.569 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.629 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 46.1 t80 -83.94 121.73 27.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.237 0.541 . . . . 1.0 110.201 -178.643 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.414 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.5 mp -117.22 143.46 45.85 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.586 -0.734 . . . . 1.0 109.972 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.436 ' O ' ' C ' ' A' ' 60' ' ' ARG . 28.6 mtt85 -129.67 153.67 47.9 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.58 -0.736 . . . . 1.0 109.398 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 59' ' ' ARG . 17.0 ptm180 -32.69 127.58 0.27 Allowed 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.294 0.371 . . . . 1.0 111.431 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 151.4 -175.47 30.26 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.814 -0.914 . . . . 1.0 110.814 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.8 p-10 -116.2 134.2 55.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.085 0.469 . . . . 1.0 110.696 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -127.57 114.56 17.56 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.937 -0.574 . . . . 1.0 109.792 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.414 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.58 -3.78 52.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.152 -0.477 . . . . 1.0 111.605 -179.264 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -147.64 142.74 27.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.979 -0.749 . . . . 1.0 108.979 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.511 ' C ' ' H ' ' A' ' 68' ' ' GLN . 11.6 p-80 -62.11 -46.06 90.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.119 0.485 . . . . 1.0 111.116 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -49.22 -8.97 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.945 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.511 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.4 mm-40 -82.84 -35.32 26.43 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.513 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -91.49 19.73 5.94 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 118.956 -0.545 . . . . 1.0 111.571 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.513 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 61.6 mtp 87.38 8.33 0.19 Allowed 'General case' 0 N--CA 1.461 0.111 0 O-C-N 124.22 0.95 . . . . 1.0 109.368 -178.215 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.47 97.54 0.1 OUTLIER Glycine 0 C--N 1.341 0.813 0 N-CA-C 110.238 -1.145 . . . . 1.0 110.238 178.405 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.596 HD21 HD21 ' A' ' 54' ' ' LEU . 2.2 pp -93.36 -26.87 17.08 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.274 -0.639 . . . . 1.0 109.274 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.3 t -133.65 120.89 21.23 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 178.013 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.484 ' O ' ' CB ' ' A' ' 75' ' ' SER . 47.3 p-10 -65.65 -162.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.454 -0.498 . . . . 1.0 110.029 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.547 ' O ' ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER 84.23 67.64 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 O-C-N 123.342 0.401 . . . . 1.0 111.919 178.948 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 t -99.46 114.03 36.33 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 N-CA-C 108.836 -0.802 . . . . 1.0 108.836 178.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -120.32 1.95 10.78 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.796 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 6.1 p -161.44 160.69 29.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.404 0.621 . . . . 1.0 110.808 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.0 p -154.32 146.33 23.6 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.177 -0.919 . . . . 1.0 110.034 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.86 146.05 50.74 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.889 -0.411 . . . . 1.0 109.889 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.575 HD21 ' H ' ' A' ' 2' ' ' GLY . 31.1 tp -96.96 134.79 39.86 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.815 -0.809 . . . . 1.0 108.815 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.45 ' H ' HD12 ' A' ' 81' ' ' LEU . 2.3 mt -96.24 111.26 55.99 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.485 -0.561 . . . . 1.0 109.485 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -50.62 151.41 10.57 Favored 'Trans proline' 0 N--CA 1.501 1.948 0 C-N-CA 121.872 1.715 . . . . 1.0 113.285 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -70.34 -178.9 1.84 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.24 -0.891 . . . . 1.0 110.44 179.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.8 m -166.84 150.33 6.8 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.035 -0.529 . . . . 1.0 111.156 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -91.64 -73.32 1.25 Allowed Glycine 0 CA--C 1.523 0.546 0 N-CA-C 109.82 -1.312 . . . . 1.0 109.82 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.9 m -82.96 150.42 26.42 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.667 -0.494 . . . . 1.0 109.667 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.589 ' CD2' HD11 ' A' ' 171' ' ' ILE . 4.5 m80 -130.28 104.73 7.45 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 121.124 -0.23 . . . . 1.0 110.999 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -137.06 141.15 42.41 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.804 -0.359 . . . . 1.0 110.951 179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.445 HD12 HG22 ' A' ' 126' ' ' VAL . 19.9 tt -150.63 144.25 17.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.157 -0.474 . . . . 1.0 111.272 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -120.11 97.85 5.79 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.948 -0.569 . . . . 1.0 111.626 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 28.6 mt -78.54 142.67 37.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.966 -0.561 . . . . 1.0 109.936 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.511 ' CG ' ' HB3' ' A' ' 98' ' ' TYR . 38.3 m-85 -121.18 138.93 53.98 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.339 0.59 . . . . 1.0 111.801 -178.275 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.524 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 8.9 tp10 -63.1 -37.72 88.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.649 -0.705 . . . . 1.0 110.829 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -128.2 169.27 14.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.364 0.602 . . . . 1.0 111.075 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.421 ' O ' ' N ' ' A' ' 98' ' ' TYR . 93.6 mt-10 -61.38 163.42 6.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.928 -1.033 . . . . 1.0 110.717 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.53 ' C ' ' CD1' ' A' ' 98' ' ' TYR . 9.9 m-20 41.53 25.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.989 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.547 ' O ' ' CD2' ' A' ' 98' ' ' TYR . 26.4 p90 33.54 76.97 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.539 -0.755 . . . . 1.0 110.958 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -116.67 -5.46 11.62 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.554 -0.748 . . . . 1.0 111.108 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -118.27 -144.42 7.57 Favored Glycine 0 N--CA 1.47 0.954 0 CA-C-N 115.422 -0.808 . . . . 1.0 111.189 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 67.9 tp60 -68.16 142.91 55.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 1.0 110.878 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.9 ptm -133.27 155.25 49.73 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.612 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.511 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.8 tt -147.97 142.0 19.25 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 N-CA-C 109.817 -0.438 . . . . 1.0 109.817 178.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -112.8 142.39 45.5 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.809 0.814 . . . . 1.0 110.811 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.12 157.05 40.73 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.441 -1.254 . . . . 1.0 110.506 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.6 p -142.27 19.11 2.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.3 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -164.13 -167.18 1.27 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.938 0.399 . . . . 1.0 110.87 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 51.2 p30 -78.9 148.4 32.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.262 0.553 . . . . 1.0 111.021 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.439 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.8 t -135.65 93.98 3.02 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.592 -0.731 . . . . 1.0 109.759 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -65.31 -27.68 68.78 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.618 -0.433 . . . . 1.0 111.274 -179.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' CYS . . . . . 0.501 ' SG ' ' O ' ' A' ' 111' ' ' CYS . 28.2 p -139.28 95.67 2.97 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.415 0.626 . . . . 1.0 110.849 -179.042 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 114' ' ' ASP . 19.3 tp -62.47 -41.22 98.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.285 -0.87 . . . . 1.0 110.121 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.595 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 27.8 mp0 -45.23 -11.96 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.327 -0.397 . . . . 1.0 111.435 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.535 ' C ' ' HE ' ' A' ' 115' ' ' ARG . 21.8 m-20 -95.07 -25.11 16.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.095 0.474 . . . . 1.0 110.73 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.535 ' HE ' ' C ' ' A' ' 114' ' ' ASP . 6.4 mmp_? -107.87 -41.73 4.9 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.785 -0.643 . . . . 1.0 111.937 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.511 ' CD1' HG21 ' A' ' 103' ' ' ILE . 2.3 t80 -123.54 122.24 37.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.217 0.532 . . . . 1.0 109.68 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.2 mtt-85 -61.64 -46.16 90.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.514 -0.766 . . . . 1.0 111.059 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.524 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 97.3 m-85 -58.05 139.67 54.12 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.691 -0.686 . . . . 1.0 109.616 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 43.1 t30 -100.89 4.14 42.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.886 -179.29 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -135.11 141.41 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.193 0.52 . . . . 1.0 110.913 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.5 mm -122.94 117.25 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.658 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 123' ' ' SER . 27.2 m-70 -105.9 27.56 8.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.188 -0.46 . . . . 1.0 112.03 -178.354 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 10.3 t 163.39 152.65 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 123.495 0.497 . . . . 1.0 109.818 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.48 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.0 OUTLIER -163.58 158.09 20.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.476 -178.69 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 11.4 t-20 -122.74 116.98 24.67 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 109.411 -0.588 . . . . 1.0 109.411 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.445 HG22 HD12 ' A' ' 90' ' ' ILE . 39.1 t -101.63 105.58 18.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 116.143 -0.481 . . . . 1.0 109.791 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.865 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.78 -45.1 21.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.725 179.633 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -156.99 149.94 23.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.745 -0.382 . . . . 1.0 111.043 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 70.07 79.57 0.32 Allowed Glycine 0 C--N 1.329 0.163 0 CA-C-N 116.198 -0.456 . . . . 1.0 112.384 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.431 ' C ' ' O ' ' A' ' 129' ' ' GLY . 45.7 p -32.17 149.44 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 121.219 0.533 . . . . 1.0 111.202 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.512 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 44.1 m95 -123.38 164.99 17.77 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.466 -0.788 . . . . 1.0 111.521 -178.066 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 29.0 t -131.88 133.99 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 178.791 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.47 142.22 39.17 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -120.54 136.82 54.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.084 0.24 . . . . 1.0 110.917 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -48.94 -44.93 41.09 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.474 -0.49 . . . . 1.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.494 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.7 178.01 5.67 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.321 0.582 . . . . 1.0 110.684 -178.905 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.2 m -82.52 171.71 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.523 -0.762 . . . . 1.0 111.022 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 62.78 20.43 12.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 1.0 110.18 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 139' ' ' TYR . 1.0 OUTLIER 35.59 78.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.067 -0.515 . . . . 1.0 111.644 179.056 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.41 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 30.5 ttm180 -148.3 38.58 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.02 0.438 . . . . 1.0 110.408 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.438 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -153.6 -137.67 2.52 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.13 -0.788 . . . . 1.0 111.13 -178.672 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? -72.42 164.38 26.46 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.658 0.266 . . . . 1.0 110.439 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.629 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 5.7 pt20 -149.31 139.2 21.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.886 -0.597 . . . . 1.0 110.839 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -131.09 135.94 47.95 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.698 -0.852 . . . . 1.0 108.698 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.681 HD22 ' SD ' ' A' ' 147' ' ' MET . 0.8 OUTLIER -91.13 129.45 37.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.382 0.61 . . . . 1.0 109.649 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.627 ' N ' HD23 ' A' ' 145' ' ' LEU . 1.6 mm? -114.43 102.92 10.54 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.212 -1.033 . . . . 1.0 108.212 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.681 ' SD ' HD22 ' A' ' 145' ' ' LEU . 1.8 mpp? -80.53 165.95 42.76 Favored Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 109.72 -0.474 . . . . 1.0 109.72 -179.096 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -60.53 122.99 12.15 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.624 1.55 . . . . 1.0 111.406 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.31 -154.14 23.78 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 -179.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -126.46 133.4 51.22 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.893 0.378 . . . . 1.0 110.327 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.1 m-85 -122.94 128.25 50.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.549 -0.537 . . . . 1.0 109.549 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -114.08 -5.13 13.09 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 110.341 -0.244 . . . . 1.0 110.341 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -154.96 163.22 40.62 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.494 0.664 . . . . 1.0 110.513 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.02 -22.01 58.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.175 -0.92 . . . . 1.0 111.807 -178.582 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.23 -22.39 66.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.134 -0.485 . . . . 1.0 111.361 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 156' ' ' ASP . . . . . 0.498 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.2 t0 -47.59 -50.03 25.16 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.333 -178.651 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.599 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.3 p90 -99.59 19.32 16.0 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.029 0.442 . . . . 1.0 110.131 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.93 72.72 0.47 Allowed Glycine 0 CA--C 1.522 0.481 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.43 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.599 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.25 -171.66 2.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.689 0.757 . . . . 1.0 110.84 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.13 -35.69 3.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.696 -1.138 . . . . 1.0 112.089 -178.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.597 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 23.7 t-20 -146.58 -25.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.006 -0.278 . . . . 1.0 111.64 -178.709 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.819 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 97.96 -19.87 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 124.301 1.001 . . . . 1.0 110.255 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -42.15 116.29 0.8 Allowed 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 115.145 -0.934 . . . . 1.0 111.345 -178.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 162' ' ' ALA . 60.8 t -123.3 124.41 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.393 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.454 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -103.42 -24.76 7.7 Favored Glycine 0 N--CA 1.462 0.407 0 N-CA-C 111.055 -0.818 . . . . 1.0 111.055 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 109' ' ' CYS . 5.7 t -160.14 171.34 19.43 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.644 -0.422 . . . . 1.0 110.311 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 166' ' ' SER . 0.9 OUTLIER -157.92 144.29 17.58 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.524 . . . . 1.0 111.699 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -133.42 162.35 32.1 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.604 -0.517 . . . . 1.0 109.604 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.465 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.42 153.9 17.57 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.446 -0.797 . . . . 1.0 109.261 178.922 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.424 HG21 ' OG ' ' A' ' 130' ' ' SER . 48.1 t -89.7 82.05 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.969 -0.457 . . . . 1.0 111.788 -178.366 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.589 HD11 ' CD2' ' A' ' 88' ' ' HIS . 1.2 mp -134.37 128.38 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.166 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 23.6 p-10 -97.79 -11.19 23.61 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.705 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.432 ' CD2' HG23 ' A' ' 171' ' ' ILE . 49.5 p90 -102.64 -171.81 2.02 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.155 -0.475 . . . . 1.0 110.758 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.003 -0.998 . . . . 1.0 110.625 -179.896 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.327 -0.62 . . . . 1.0 109.327 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.28 174.02 42.46 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.609 -0.997 . . . . 1.0 110.609 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -171.76 105.81 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.856 -0.338 . . . . 1.0 110.589 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.18 168.8 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-O 120.908 0.385 . . . . 1.0 110.942 -178.841 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.489 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.3 m -126.28 120.73 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.263 -1.014 . . . . 1.0 108.263 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -105.4 132.91 50.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.1 -0.954 . . . . 1.0 110.242 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.489 ' CE1' HG22 ' A' ' 5' ' ' THR . 70.6 m-85 -115.58 126.55 54.35 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.224 -0.898 . . . . 1.0 111.201 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.13 -31.66 31.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.487 -0.779 . . . . 1.0 110.464 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -116.75 160.26 21.05 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.285 0.564 . . . . 1.0 110.486 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' C ' ' N ' ' A' ' 12' ' ' PHE . 11.2 ptm180 -63.87 -173.16 0.07 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.338 -0.846 . . . . 1.0 110.702 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.43 24.66 0.4 Allowed Glycine 0 N--CA 1.459 0.224 0 N-CA-C 110.732 -0.947 . . . . 1.0 110.732 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 8.3 m-85 50.43 70.09 0.55 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.527 -0.336 . . . . 1.0 110.275 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -131.83 -155.37 0.68 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.045 0.45 . . . . 1.0 110.309 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.64 -150.06 0.16 Allowed Glycine 0 CA--C 1.526 0.764 0 N-CA-C 111.036 -0.826 . . . . 1.0 111.036 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -69.36 145.92 52.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.774 0.321 . . . . 1.0 110.682 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -135.86 149.86 49.18 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.179 0.514 . . . . 1.0 110.296 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.1 t80 -144.32 141.57 29.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.36 -0.837 . . . . 1.0 110.204 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 33.0 tt0 -110.53 122.63 48.21 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.304 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -109.89 126.23 53.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.638 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.9 p -117.99 9.55 12.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.934 -0.576 . . . . 1.0 110.475 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.5 p -154.91 167.1 31.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.713 -178.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -58.08 137.45 56.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.557 -0.747 . . . . 1.0 111.512 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.37 141.47 47.91 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.685 -0.689 . . . . 1.0 110.156 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.9 p -108.92 -14.49 14.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.679 -0.691 . . . . 1.0 111.841 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -152.6 118.16 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.103 0.478 . . . . 1.0 110.602 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.437 HD11 ' SG ' ' A' ' 79' ' ' CYS . 11.0 mt -117.46 0.84 12.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.582 -0.736 . . . . 1.0 110.266 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.609 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 41.1 mt-30 -48.8 -51.4 54.44 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.124 -0.489 . . . . 1.0 110.759 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.609 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.8 Cg_endo -55.93 -32.94 87.46 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 121.544 1.496 . . . . 1.0 112.33 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -94.27 -52.02 4.54 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.296 -0.562 . . . . 1.0 110.644 -178.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -117.28 127.73 54.37 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.0 110.551 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.1 t -95.51 -10.23 30.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.527 -0.761 . . . . 1.0 111.631 -179.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -147.12 -55.32 0.24 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.392 -0.367 . . . . 1.0 111.824 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 t 59.96 75.48 0.4 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -92.88 4.12 54.46 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.339 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.543 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -154.69 155.44 34.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.906 0.384 . . . . 1.0 110.036 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.2 154.53 35.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.153 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -134.46 122.41 22.45 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 108.554 -0.906 . . . . 1.0 108.554 178.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.9 t -107.61 117.39 53.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.276 0.56 . . . . 1.0 109.869 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -79.81 -43.33 22.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.395 -0.821 . . . . 1.0 110.76 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 t -161.64 155.91 22.43 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.48 173.87 50.0 Favored Glycine 0 C--N 1.317 -0.523 0 N-CA-C 110.97 -0.852 . . . . 1.0 110.97 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.2 m -110.28 140.77 44.1 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.456 -0.572 . . . . 1.0 109.456 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.418 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 56.1 m95 -128.3 155.76 44.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.322 0.582 . . . . 1.0 111.063 -179.168 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.661 ' SD ' ' NE2' ' A' ' 55' ' ' GLN . 15.7 ttm -131.17 131.28 43.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.827 -0.805 . . . . 1.0 108.827 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.495 HD23 ' C ' ' A' ' 44' ' ' MET . 0.8 OUTLIER -108.62 131.1 55.22 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 108.948 -0.76 . . . . 1.0 108.948 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.427 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 61.6 m-85 -107.37 131.54 54.14 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.725 0.774 . . . . 1.0 110.667 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.616 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.1 pt-20 -58.35 -36.35 73.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.917 -1.038 . . . . 1.0 110.974 -178.243 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.452 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.6 mt-30 -109.88 152.81 43.19 Favored Pre-proline 0 C--O 1.232 0.153 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.47 -178.759 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 157.28 54.02 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.378 2.052 . . . . 1.0 112.591 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 64.86 36.57 7.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.871 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.427 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.7 m-85 50.83 75.1 0.2 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.051 -0.977 . . . . 1.0 111.038 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.4 m -142.61 154.27 44.25 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.884 0.373 . . . . 1.0 110.139 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.2 -148.13 22.06 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.854 -0.688 . . . . 1.0 111.728 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.616 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.8 tp -77.9 146.81 35.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.466 -0.367 . . . . 1.0 110.597 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.661 ' NE2' ' SD ' ' A' ' 44' ' ' MET . 7.3 pt20 -122.86 153.72 39.24 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.065 -0.346 . . . . 1.0 110.065 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.457 ' CE1' ' O ' ' A' ' 70' ' ' MET . 20.6 m-85 -129.38 129.67 45.05 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.923 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.427 ' C ' HD22 ' A' ' 58' ' ' LEU . 45.6 t80 -82.53 121.22 26.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.389 0.614 . . . . 1.0 109.814 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.427 HD22 ' C ' ' A' ' 57' ' ' PHE . 2.8 mm? -109.94 136.75 48.73 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.56 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 60' ' ' ARG . 23.0 mtm-85 -129.05 154.89 46.22 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.485 -0.779 . . . . 1.0 109.934 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 78.8 ttt-85 -38.29 125.9 1.33 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.668 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.0 -177.84 32.85 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.625 -0.99 . . . . 1.0 110.625 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.1 p-10 -116.16 125.38 52.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.151 0.501 . . . . 1.0 110.517 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -119.23 112.49 19.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 1.0 109.35 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.428 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.46 -2.43 56.27 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.923 -0.58 . . . . 1.0 111.762 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -149.48 131.86 15.63 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.201 -0.666 . . . . 1.0 109.201 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.482 ' CB ' ' CZ2' ' A' ' 69' ' ' TRP . 17.3 p-80 -53.67 -37.68 63.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.974 0.416 . . . . 1.0 110.963 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -56.4 -7.89 0.45 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.948 -0.569 . . . . 1.0 110.537 179.406 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.6 mm-40 -82.31 -32.91 29.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 120.546 -0.461 . . . . 1.0 111.107 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.2 p90 -96.21 13.47 27.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.868 -0.333 . . . . 1.0 110.586 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.457 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 58.3 mtt 74.77 31.61 0.91 Allowed 'General case' 0 C--O 1.225 -0.211 0 O-C-N 124.481 1.113 . . . . 1.0 110.306 -179.215 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.552 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -72.26 43.13 0.84 Allowed Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.448 -0.882 . . . . 1.0 111.877 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.489 ' C ' ' O ' ' A' ' 71' ' ' GLY . 55.0 mt -20.27 -47.06 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 O-C-N 124.167 0.569 . . . . 1.0 110.704 -178.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 71' ' ' GLY . 5.0 t -106.54 112.05 24.87 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.595 -0.729 . . . . 1.0 109.619 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 49.8 p-10 -72.57 38.56 0.08 Allowed 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.676 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.503 ' O ' ' HA ' ' A' ' 47' ' ' GLU . 5.2 m -113.3 74.75 0.88 Allowed 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.189 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.7 t -100.37 121.24 50.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 109.585 -0.524 . . . . 1.0 109.585 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -128.38 4.58 5.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.241 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.4 p -163.38 162.66 25.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.051 0.453 . . . . 1.0 110.851 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' CYS . . . . . 0.437 ' SG ' HD11 ' A' ' 26' ' ' LEU . 19.2 p -153.66 144.85 22.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.752 -0.658 . . . . 1.0 109.744 -178.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -127.37 150.08 49.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.411 HD13 ' CE2' ' A' ' 43' ' ' TRP . 17.2 tp -95.37 125.84 40.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.461 -1.311 . . . . 1.0 107.461 177.506 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.403 ' N ' HD12 ' A' ' 81' ' ' LEU . 22.9 mt -78.43 114.75 45.64 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 120.539 -0.464 . . . . 1.0 110.812 -178.294 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.477 ' C ' ' CG ' ' A' ' 84' ' ' HIS . 47.9 Cg_endo -81.63 175.68 9.24 Favored 'Trans proline' 0 N--CA 1.49 1.274 0 C-N-CA 122.017 1.811 . . . . 1.0 111.755 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.578 ' CD2' ' CD ' ' A' ' 148' ' ' PRO . 22.9 m-70 84.75 127.55 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 O-C-N 123.993 0.808 . . . . 1.0 112.759 177.041 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.6 p -158.24 16.74 0.22 Allowed 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.622 -0.431 . . . . 1.0 111.154 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.529 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . -86.07 -124.38 1.56 Allowed Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.897 -0.881 . . . . 1.0 110.897 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 m -72.84 155.28 40.07 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.967 -0.383 . . . . 1.0 109.967 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.529 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 1.1 m170 -124.31 99.51 6.25 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.898 -0.321 . . . . 1.0 111.736 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -135.4 137.67 42.52 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 120.558 -0.457 . . . . 1.0 110.359 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.522 HG22 ' CH2' ' A' ' 131' ' ' TRP . 16.8 tt -149.18 145.48 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.604 -0.271 . . . . 1.0 111.026 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.61 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.4 mtp180 -124.39 98.83 5.92 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.051 -0.522 . . . . 1.0 111.633 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 20.5 mt -79.01 137.79 37.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.873 -0.603 . . . . 1.0 110.878 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 44.6 m-85 -116.5 135.29 53.95 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.638 -0.71 . . . . 1.0 110.711 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.527 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 1.0 OUTLIER -53.97 -67.01 0.3 Allowed 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.516 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 123' ' ' SER . 77.0 mtp85 -96.03 169.45 9.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.465 -179.222 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -46.31 156.82 0.15 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.495 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 54.57 -94.75 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.849 -0.614 . . . . 1.0 109.44 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.432 ' CB ' ' CE1' ' A' ' 93' ' ' TYR . 3.6 p90 -171.99 36.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.3 -0.56 . . . . 1.0 110.303 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -87.39 16.42 5.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.096 -0.502 . . . . 1.0 110.908 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -139.7 -175.53 14.31 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 111.013 -0.835 . . . . 1.0 111.013 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.55 147.95 13.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.356 . . . . 1.0 110.348 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.61 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 8.1 ttp -130.88 151.17 51.6 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.352 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.462 ' N ' ' HG2' ' A' ' 102' ' ' MET . 10.7 tt -146.42 141.06 20.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 177.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.41 143.96 42.66 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.677 0.751 . . . . 1.0 110.506 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.768 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 88.2 m-85 -130.52 156.49 44.72 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 114.742 -1.117 . . . . 1.0 110.678 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.2 p -143.93 32.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.731 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -171.14 -166.71 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.557 178.001 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 51.8 t0 -81.78 148.11 29.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.503 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.494 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.7 t -136.96 98.61 3.8 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.165 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.77 -23.84 64.36 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.878 0.371 . . . . 1.0 111.554 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.2 p -144.48 88.86 1.95 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.388 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.768 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.9 tp -60.65 -40.91 93.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.368 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.63 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 3.8 mp0 -43.85 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.999 -0.546 . . . . 1.0 112.072 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 112' ' ' LEU . 95.9 m-20 -94.78 -22.08 18.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.191 0.519 . . . . 1.0 110.42 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.5 mmt180 -107.93 -36.28 6.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.346 -0.843 . . . . 1.0 112.448 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.677 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.55 136.52 54.95 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 122.47 1.129 . . . . 1.0 110.812 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 15.0 mmp_? -73.43 -71.16 0.33 Allowed 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.609 -1.307 . . . . 1.0 110.669 -178.292 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.633 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.9 m-85 -34.2 147.88 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.295 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -106.98 8.19 30.31 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.758 0.313 . . . . 1.0 110.949 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -138.0 139.1 39.48 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.307 0.575 . . . . 1.0 111.118 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.73 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.7 mm -120.96 119.64 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 115.438 -0.801 . . . . 1.0 109.029 177.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -110.02 20.86 17.49 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.433 -178.505 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.2 p 170.94 150.76 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.089 0.471 . . . . 1.0 109.859 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.463 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.0 OUTLIER -162.11 157.26 23.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.659 -0.7 . . . . 1.0 110.313 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -122.57 112.95 18.62 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.349 -0.612 . . . . 1.0 109.349 179.109 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.515 HG22 HD12 ' A' ' 90' ' ' ILE . 21.4 t -100.34 105.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.048 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.882 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.6 OUTLIER -78.36 -43.04 28.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.981 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 26.0 tp10 -160.54 158.82 29.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.913 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.521 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 68.23 76.25 0.44 Allowed Glycine 0 CA--C 1.509 -0.324 0 CA-C-N 115.796 -0.638 . . . . 1.0 112.359 178.188 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.487 ' OG ' HD11 ' A' ' 145' ' ' LEU . 30.8 t -31.71 149.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.074 0.464 . . . . 1.0 111.021 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.522 ' CH2' HG22 ' A' ' 90' ' ' ILE . 33.0 m95 -124.42 169.14 12.14 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.72 -0.673 . . . . 1.0 110.835 -178.367 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 25.1 t -138.2 103.52 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.364 -0.38 . . . . 1.0 109.995 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.7 mt -77.38 141.77 39.65 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.787 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -120.54 133.82 55.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.618 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.564 ' CD ' HH21 ' A' ' 142' ' ' ARG . 48.0 tp10 -44.91 -49.95 10.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.453 -0.34 . . . . 1.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.77 171.06 10.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.411 0.624 . . . . 1.0 110.186 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.6 m -75.76 179.47 5.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.086 -0.961 . . . . 1.0 111.12 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 138' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 139' ' ' TYR . 10.3 m120 58.16 21.99 8.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.42 -1.264 . . . . 1.0 109.555 -179.088 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.445 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.4 m-85 33.82 77.67 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.21 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -148.75 44.1 1.0 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.245 0.545 . . . . 1.0 109.859 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.44 -135.15 2.1 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 111.423 -0.671 . . . . 1.0 111.423 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.628 HH12 ' CG2' ' A' ' 160' ' ' THR . 84.0 mtm180 -84.19 166.59 17.44 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.936 -0.394 . . . . 1.0 109.936 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.75 137.4 26.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.912 -0.586 . . . . 1.0 110.841 -179.385 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -128.69 145.01 51.28 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.109 -0.7 . . . . 1.0 109.109 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.554 ' C ' HD22 ' A' ' 146' ' ' LEU . 39.5 tp -94.28 122.56 36.95 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.479 0.487 . . . . 1.0 111.937 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.851 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.1 mm? -112.87 100.29 8.54 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.52 -0.764 . . . . 1.0 109.483 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 163.42 62.44 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 114.914 -1.039 . . . . 1.0 109.904 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 148' ' ' PRO . . . . . 0.578 ' CD ' ' CD2' ' A' ' 84' ' ' HIS . 27.6 Cg_endo -63.67 107.23 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.301 2.001 . . . . 1.0 111.532 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -175.73 -153.04 9.95 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.598 -1.001 . . . . 1.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.453 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.0 p-10 -124.8 125.82 44.63 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.054 0.454 . . . . 1.0 110.61 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.4 m-85 -117.84 129.59 55.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.953 -0.567 . . . . 1.0 109.83 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -115.66 -4.24 12.22 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.809 0.338 . . . . 1.0 110.134 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -155.54 161.62 40.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.618 0.723 . . . . 1.0 110.148 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.429 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.8 p90 -75.02 -19.2 60.17 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.654 -1.157 . . . . 1.0 112.227 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -70.05 -19.36 63.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.279 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -50.62 -49.14 57.44 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.048 -179.044 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.616 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 19.4 p90 -96.81 22.45 8.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.483 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.77 75.92 0.2 Allowed Glycine 0 CA--C 1.521 0.457 0 N-CA-C 111.326 -0.71 . . . . 1.0 111.326 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.616 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -122.0 145.52 48.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.06 0.457 . . . . 1.0 110.327 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 160' ' ' THR . . . . . 0.628 ' CG2' HH12 ' A' ' 142' ' ' ARG . 14.7 t -74.15 -15.06 61.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.144 -0.934 . . . . 1.0 110.028 177.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.451 HD22 HH22 ' A' ' 142' ' ' ARG . 14.9 p30 -166.44 -167.4 1.01 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.132 0.492 . . . . 1.0 110.308 178.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.73 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -109.37 -15.9 14.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.869 -0.605 . . . . 1.0 110.264 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -37.74 121.97 0.94 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.023 0.439 . . . . 1.0 111.889 -178.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.719 HG23 ' O ' ' A' ' 162' ' ' ALA . 24.7 t -125.39 158.68 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.438 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.502 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -136.23 -36.77 0.19 Allowed Glycine 0 C--N 1.334 0.431 0 N-CA-C 111.461 -0.656 . . . . 1.0 111.461 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.4 m -156.77 -170.47 3.32 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.046 -0.353 . . . . 1.0 110.046 -179.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.686 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -174.74 138.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.492 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -132.33 162.67 30.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.409 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -91.76 146.24 23.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.773 ' C ' HD12 ' A' ' 171' ' ' ILE . 42.2 t -79.22 84.62 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.186 -0.461 . . . . 1.0 111.506 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.773 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.9 mp -135.68 125.34 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 121.076 0.465 . . . . 1.0 109.972 178.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.43 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 36.7 p-10 -71.04 -35.08 71.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.649 -0.705 . . . . 1.0 110.492 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.43 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 90.2 m-85 -58.06 -79.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.698 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 118.006 -0.997 . . . . 1.0 110.452 179.84 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 109.16 -0.681 . . . . 1.0 109.16 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.539 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -171.9 -178.28 42.08 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.371 -1.092 . . . . 1.0 110.371 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -175.86 109.03 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.636 -0.426 . . . . 1.0 110.366 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.4 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -120.06 169.21 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.952 0.406 . . . . 1.0 110.833 -179.08 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.467 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.9 m -127.89 119.72 26.18 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.203 -1.036 . . . . 1.0 108.203 177.568 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.8 mt -105.55 133.14 50.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.68 -1.145 . . . . 1.0 109.819 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.467 ' CE1' HG22 ' A' ' 5' ' ' THR . 70.8 m-85 -115.1 130.09 56.84 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.623 -0.717 . . . . 1.0 111.644 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.478 ' O ' ' O ' ' A' ' 32' ' ' ARG . 80.8 tt0 -54.9 -24.44 23.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.402 -0.817 . . . . 1.0 110.459 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -125.39 161.06 27.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.284 0.564 . . . . 1.0 110.004 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 8.3 ptp180 -65.28 -175.33 0.22 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.311 -0.859 . . . . 1.0 110.929 -177.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.36 29.31 1.69 Allowed Glycine 0 C--N 1.335 0.482 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 48.36 68.03 0.75 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.489 -0.355 . . . . 1.0 110.288 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -129.78 -158.5 0.89 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.966 0.412 . . . . 1.0 110.454 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.48 -148.66 0.77 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.861 -0.895 . . . . 1.0 110.861 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.11 148.51 45.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.767 0.318 . . . . 1.0 110.463 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -135.7 146.84 48.16 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.381 0.61 . . . . 1.0 110.256 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.521 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -142.26 142.41 32.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.107 -0.951 . . . . 1.0 109.76 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.521 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 75.1 tt0 -111.7 123.48 50.33 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.229 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.6 126.54 54.57 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.306 -0.406 . . . . 1.0 110.67 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.3 p -118.17 11.06 13.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.861 -0.609 . . . . 1.0 110.425 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.6 p -156.45 169.36 24.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.579 -178.713 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -58.94 136.09 57.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.786 -0.643 . . . . 1.0 111.104 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.39 146.53 52.03 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.676 -0.693 . . . . 1.0 110.423 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -117.52 -19.98 9.22 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.478 -0.783 . . . . 1.0 112.774 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -141.29 106.28 4.96 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.461 0.648 . . . . 1.0 109.652 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 mt -109.62 -3.38 16.9 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.171 -0.922 . . . . 1.0 110.058 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.578 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 1.4 mt-30 -52.23 -51.11 75.09 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.921 -0.581 . . . . 1.0 110.735 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.578 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.0 Cg_endo -56.04 -35.08 94.21 Favored 'Trans proline' 0 N--CA 1.487 1.127 0 C-N-CA 121.22 1.28 . . . . 1.0 112.759 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -90.79 -40.97 11.49 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.314 -0.555 . . . . 1.0 111.027 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.4 mt -126.14 127.76 46.25 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.423 -0.808 . . . . 1.0 111.284 -178.726 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 t -90.36 -14.15 33.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.191 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' GLU . 44.3 ttm180 -175.64 120.62 0.18 Allowed 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 108.89 -0.781 . . . . 1.0 108.89 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.5 t -100.22 106.36 18.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 1.0 110.258 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.432 ' OD1' ' OD2' ' A' ' 74' ' ' ASP . 98.9 m-20 -101.59 -5.17 25.45 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.521 179.504 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.449 ' OG ' ' C ' ' A' ' 64' ' ' ALA . 71.9 m -155.74 156.99 35.83 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.977 0.417 . . . . 1.0 110.54 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.56 155.48 37.48 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.949 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -133.99 123.81 25.22 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.71 -0.848 . . . . 1.0 108.71 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.8 t -109.0 134.71 50.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.098 -0.704 . . . . 1.0 109.098 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -97.42 -42.83 7.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.505 -0.771 . . . . 1.0 110.51 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 m -161.45 160.46 29.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.426 -0.583 . . . . 1.0 109.426 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.51 176.26 48.73 Favored Glycine 0 C--N 1.316 -0.538 0 N-CA-C 111.085 -0.806 . . . . 1.0 111.085 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.8 m -112.4 140.96 46.69 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.884 -0.784 . . . . 1.0 108.884 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.619 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 48.2 m95 -127.42 150.44 49.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.63 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.523 ' C ' HD23 ' A' ' 45' ' ' LEU . 0.8 OUTLIER -124.37 130.05 51.8 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.179 -0.674 . . . . 1.0 109.179 178.594 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.523 HD23 ' C ' ' A' ' 44' ' ' MET . 0.5 OUTLIER -109.78 131.71 54.81 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.673 -0.862 . . . . 1.0 108.673 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -106.19 131.45 53.43 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.374 0.607 . . . . 1.0 111.279 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.671 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -56.04 -34.8 66.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.398 -0.819 . . . . 1.0 110.367 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -104.82 153.64 39.17 Favored Pre-proline 0 C--N 1.327 -0.41 0 O-C-N 121.945 -0.472 . . . . 1.0 109.918 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -55.68 150.84 42.23 Favored 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 121.363 1.375 . . . . 1.0 110.873 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.525 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.5 m-20 79.68 -122.95 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.735 0.814 . . . . 1.0 109.115 -178.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.525 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 15.3 m-85 -138.73 78.42 1.68 Allowed 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.017 -0.538 . . . . 1.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.0 m -152.3 163.53 39.26 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.738 -0.467 . . . . 1.0 109.738 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.04 -153.16 33.81 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 115.627 -0.715 . . . . 1.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.671 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.3 tp -77.73 144.47 37.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.343 -0.429 . . . . 1.0 109.987 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -121.41 154.17 36.87 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.691 0.282 . . . . 1.0 110.261 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.468 ' CE1' ' O ' ' A' ' 70' ' ' MET . 36.2 m-85 -127.04 129.56 48.27 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.113 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.425 ' C ' HD22 ' A' ' 58' ' ' LEU . 36.8 t80 -81.64 119.42 23.79 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.689 -0.687 . . . . 1.0 109.704 -179.356 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.425 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.3 mm? -111.36 134.42 52.96 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.9 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.4 ' O ' ' C ' ' A' ' 60' ' ' ARG . 18.3 mtm-85 -129.52 154.84 46.63 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.301 -0.863 . . . . 1.0 109.931 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' CZ ' ' O ' ' A' ' 172' ' ' ASP . 34.5 ptt180 -36.6 128.54 0.81 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.186 0.517 . . . . 1.0 111.696 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.18 179.92 29.88 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 111.117 -0.793 . . . . 1.0 111.117 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -115.79 124.1 49.9 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -118.92 113.5 21.12 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.131 -0.692 . . . . 1.0 109.131 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.449 ' C ' ' OG ' ' A' ' 35' ' ' SER . . . -93.99 3.42 55.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.015 0.436 . . . . 1.0 111.756 -179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 67.3 m-20 -152.14 140.68 20.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.77 -0.826 . . . . 1.0 108.77 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.472 ' C ' ' H ' ' A' ' 68' ' ' GLN . 13.9 p-80 -64.36 -40.66 96.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.974 0.416 . . . . 1.0 110.846 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.67 -8.17 0.14 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.899 -0.591 . . . . 1.0 110.248 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.472 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.5 mm-40 -80.93 -32.95 34.43 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 120.43 -0.508 . . . . 1.0 111.306 -178.284 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.41 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -96.1 13.33 27.56 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 121.05 -0.26 . . . . 1.0 110.69 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.468 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 54.9 mtt 76.26 30.01 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 124.278 0.986 . . . . 1.0 109.807 -179.036 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.565 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.24 40.51 0.88 Allowed Glycine 0 C--N 1.34 0.762 0 C-N-CA 119.852 -1.166 . . . . 1.0 112.181 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.487 ' CD1' HH12 ' A' ' 142' ' ' ARG . 19.7 mt -18.73 -47.03 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.388 0.675 . . . . 1.0 111.002 -178.693 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.565 ' N ' ' O ' ' A' ' 71' ' ' GLY . 62.5 m -107.35 114.82 29.09 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.724 -0.671 . . . . 1.0 109.393 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 74' ' ' ASP . 67.1 t0 -75.14 38.32 0.13 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.288 -0.414 . . . . 1.0 110.274 -179.205 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.569 ' O ' ' O ' ' A' ' 47' ' ' GLU . 4.2 p -115.22 73.76 0.85 Allowed 'General case' 0 C--O 1.212 -0.88 0 CA-C-N 116.172 -0.467 . . . . 1.0 109.942 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.48 131.5 66.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 123.631 0.582 . . . . 1.0 110.106 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -137.39 14.25 3.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.743 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.3 p -162.04 161.13 28.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.218 0.532 . . . . 1.0 110.795 178.461 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.2 p -155.67 146.94 22.63 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.471 -0.786 . . . . 1.0 110.662 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.603 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.7 ptm180 -126.82 150.55 49.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.467 -0.568 . . . . 1.0 109.467 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -102.41 124.92 48.85 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.911 -1.144 . . . . 1.0 107.911 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.721 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.2 mt -84.2 116.58 65.62 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.146 -178.656 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -52.85 148.53 28.69 Favored 'Trans proline' 0 N--CA 1.501 1.96 0 C-N-CA 121.906 1.737 . . . . 1.0 113.229 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.632 ' CG ' ' H ' ' A' ' 85' ' ' SER . 81.9 t60 -70.44 176.95 3.66 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.426 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.632 ' H ' ' CG ' ' A' ' 84' ' ' HIS . 2.2 t -164.75 144.7 7.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.991 -179.747 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.15 -64.19 1.03 Allowed Glycine 0 N--CA 1.465 0.577 0 N-CA-C 109.994 -1.242 . . . . 1.0 109.994 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m -83.47 148.06 27.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.011 -0.366 . . . . 1.0 110.011 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.442 ' CD2' HD11 ' A' ' 171' ' ' ILE . 9.0 m80 -135.04 110.78 9.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 1.0 111.162 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.8 mtp180 -143.54 135.61 26.75 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.746 -0.381 . . . . 1.0 110.068 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.5 HD12 HG22 ' A' ' 126' ' ' VAL . 17.6 tt -146.59 146.59 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.622 -0.263 . . . . 1.0 110.614 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -125.88 104.89 8.56 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.488 0.492 . . . . 1.0 111.424 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.4 mp -85.42 139.07 31.82 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.416 0.627 . . . . 1.0 111.87 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -116.44 136.25 53.15 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.798 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.51 ' OE1' ' CB ' ' A' ' 118' ' ' PHE . 78.2 mm-40 -55.72 -64.4 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.455 -0.793 . . . . 1.0 112.702 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -93.93 167.75 11.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.224 -177.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' GLU . . . . . 0.655 ' O ' ' O ' ' A' ' 97' ' ' ASP . 96.6 mt-10 -53.68 159.62 1.54 Allowed 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.316 -0.857 . . . . 1.0 110.264 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.813 ' O ' ' N ' ' A' ' 99' ' ' ARG . 55.1 m-20 51.33 126.51 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 108.213 -1.032 . . . . 1.0 108.213 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.4 OUTLIER -35.93 68.91 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.143 -0.481 . . . . 1.0 112.011 -177.714 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ARG . . . . . 0.813 ' N ' ' O ' ' A' ' 97' ' ' ASP . 74.3 mtt85 -134.82 165.83 24.37 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.117 -0.364 . . . . 1.0 110.501 -178.349 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.31 -168.35 52.96 Favored Glycine 0 CA--C 1.519 0.331 0 N-CA-C 110.175 -1.17 . . . . 1.0 110.175 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -60.83 145.99 47.94 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.607 -0.437 . . . . 1.0 109.837 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.2 ttp -131.08 145.55 52.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.324 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.1 tt -138.8 138.35 42.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -111.59 143.66 42.1 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.511 0.672 . . . . 1.0 110.66 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.812 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 77.6 m-85 -129.15 153.15 47.97 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.586 -1.188 . . . . 1.0 110.537 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 58.4 p -143.73 10.67 1.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 1.0 111.01 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.978 ' O ' ' O ' ' A' ' 108' ' ' ASP . 6.3 pt-20 -161.16 83.19 0.64 Allowed 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 118.657 -0.687 . . . . 1.0 110.016 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.978 ' O ' ' O ' ' A' ' 107' ' ' GLU . 53.4 p-10 14.99 164.83 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.021 1.119 . . . . 1.0 114.021 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -149.62 109.27 4.02 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 120.144 -1.597 . . . . 1.0 110.021 178.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 m -64.07 -31.88 73.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.651 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 t -135.41 89.68 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.246 0.546 . . . . 1.0 110.1 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.812 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.8 tp -61.4 -42.47 98.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.378 -0.828 . . . . 1.0 109.829 -178.843 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.406 ' HG2' ' H ' ' A' ' 113' ' ' GLN . 21.5 mm100 -42.93 -8.31 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.864 -0.607 . . . . 1.0 112.028 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 112' ' ' LEU . 47.0 t0 -97.2 -22.32 16.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.118 0.485 . . . . 1.0 110.66 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 112' ' ' LEU . 5.0 mmp_? -106.09 -37.21 6.68 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.183 0.809 . . . . 1.0 113.183 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.656 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.21 136.44 54.97 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.887 0.851 . . . . 1.0 110.128 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 118' ' ' PHE . 68.6 mtt85 -72.73 -69.61 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.632 -1.293 . . . . 1.0 110.371 -177.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.596 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -33.54 146.77 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.426 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -106.69 7.33 30.45 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.729 0.299 . . . . 1.0 111.326 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -138.41 139.74 39.04 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.11 0.481 . . . . 1.0 111.098 -178.417 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.722 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.0 mm -122.9 124.92 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.493 -0.776 . . . . 1.0 109.24 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.521 ' O ' ' OG ' ' A' ' 123' ' ' SER . 40.9 m-70 -116.0 21.62 13.62 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.543 -178.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.521 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 11.4 m 171.94 153.25 0.07 Allowed 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.161 0.505 . . . . 1.0 110.558 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.471 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 2.0 pp -165.72 157.7 14.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.321 -0.854 . . . . 1.0 110.788 -178.521 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -125.51 120.53 31.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.056 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.5 HG22 HD12 ' A' ' 90' ' ' ILE . 40.7 t -103.23 104.38 16.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 109.681 -0.488 . . . . 1.0 109.681 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.934 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.25 -40.68 36.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.231 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.476 ' O ' ' O ' ' A' ' 129' ' ' GLY . 36.9 mm-40 -133.81 162.01 33.16 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.835 0.826 . . . . 1.0 110.933 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 38.11 -165.51 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 CA-C-N 113.474 -1.694 . . . . 1.0 110.91 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.478 ' OG ' ' CG2' ' A' ' 170' ' ' VAL . 32.1 p -119.73 162.41 19.09 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -134.49 160.9 36.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.069 -0.514 . . . . 1.0 109.995 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.09 139.39 50.36 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 N-CA-C 109.296 -0.631 . . . . 1.0 109.296 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.492 ' HG ' HD11 ' A' ' 146' ' ' LEU . 38.5 mt -111.11 141.73 44.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 110.184 -0.302 . . . . 1.0 110.184 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -117.41 132.84 56.5 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.26 0.35 . . . . 1.0 110.812 179.198 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -45.3 -36.85 4.33 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.371 -0.377 . . . . 1.0 110.725 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -137.01 175.46 9.59 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.289 0.566 . . . . 1.0 110.767 -179.34 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.1 p -81.75 172.48 13.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.496 -0.775 . . . . 1.0 110.678 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 64.5 19.19 11.72 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.833 -1.076 . . . . 1.0 109.839 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.511 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 13.2 m-85 35.8 79.36 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.919 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -148.97 38.89 0.83 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.393 0.616 . . . . 1.0 109.989 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.437 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -151.72 -140.8 3.21 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 -178.107 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.487 HH12 ' CD1' ' A' ' 72' ' ' LEU . 28.8 mmt180 -74.64 165.44 25.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.918 -0.401 . . . . 1.0 109.918 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.52 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 1.3 pt20 -146.83 135.3 21.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.955 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 144' ' ' TYR . . . . . 0.408 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 7.2 m-85 -128.01 131.62 49.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.457 ' HB2' ' HE2' ' A' ' 44' ' ' MET . 41.6 tp -87.72 126.37 34.94 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.29 0.567 . . . . 1.0 110.8 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.492 HD11 ' HG ' ' A' ' 133' ' ' LEU . 28.6 mt -115.17 108.51 16.7 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.039 -0.982 . . . . 1.0 109.694 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.603 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 3.3 mtm -88.43 163.23 37.11 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.699 -0.4 . . . . 1.0 110.247 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -52.84 124.32 15.15 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 121.608 1.538 . . . . 1.0 111.393 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 165.64 -155.27 26.49 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 110.565 -1.014 . . . . 1.0 110.565 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 68.3 t0 -127.38 130.42 49.36 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.803 0.335 . . . . 1.0 110.299 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.2 m-85 -121.36 129.26 52.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 1.0 109.952 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 152' ' ' ARG . . . . . 0.5 ' C ' ' OG ' ' A' ' 123' ' ' SER . 13.5 ptm180 -118.95 5.99 11.37 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.838 0.351 . . . . 1.0 110.199 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.4 ptm180 -163.76 160.02 22.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.463 0.649 . . . . 1.0 110.319 179.161 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.465 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.4 p90 -75.99 -19.63 58.54 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.697 -1.138 . . . . 1.0 112.613 -177.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 39.5 mt-30 -70.52 -17.81 62.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.843 0.354 . . . . 1.0 111.228 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -54.68 -46.81 74.12 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.388 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.698 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 14.3 p90 -97.45 20.47 11.62 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.266 -0.425 . . . . 1.0 110.738 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.82 75.32 0.23 Allowed Glycine 0 CA--C 1.521 0.439 0 N-CA-C 111.21 -0.756 . . . . 1.0 111.21 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.698 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.32 147.9 43.78 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 121.088 0.47 . . . . 1.0 110.336 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 160' ' ' THR . . . . . 0.411 ' O ' ' CG ' ' A' ' 161' ' ' ASN . 15.1 t -76.02 -20.46 57.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.894 -1.048 . . . . 1.0 110.106 177.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.411 ' CG ' ' O ' ' A' ' 160' ' ' THR . 71.3 m-20 -163.56 -170.65 2.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.437 . . . . 1.0 110.503 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.722 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.27 -22.33 12.39 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.993 -0.548 . . . . 1.0 110.557 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -36.98 120.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.252 0.549 . . . . 1.0 111.651 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 162' ' ' ALA . 21.3 t -124.23 162.12 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.714 -0.675 . . . . 1.0 109.794 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.529 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -141.94 -33.67 0.11 Allowed Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 14.5 p -159.67 169.35 23.91 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.656 -0.417 . . . . 1.0 110.853 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.649 ' H ' HD23 ' A' ' 167' ' ' LEU . 1.3 pt? -153.67 146.82 24.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.849 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.511 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 11.3 ptp180 -135.81 147.99 48.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.403 0.62 . . . . 1.0 110.01 178.274 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.426 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -83.12 150.69 26.12 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.144 -0.934 . . . . 1.0 108.902 178.204 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.743 ' C ' HD12 ' A' ' 171' ' ' ILE . 35.6 t -83.71 85.25 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 111.837 0.31 . . . . 1.0 111.837 -177.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.743 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -135.13 116.77 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 N-CA-C 109.491 -0.559 . . . . 1.0 109.491 179.384 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.401 ' O ' ' CZ ' ' A' ' 60' ' ' ARG . 20.5 t0 -68.45 -36.58 79.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.514 -0.766 . . . . 1.0 110.208 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -67.12 179.76 1.11 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.906 -0.588 . . . . 1.0 110.81 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 14.4 p . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 118.001 -0.999 . . . . 1.0 110.425 -179.895 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.094 -0.706 . . . . 1.0 109.094 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.605 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -179.31 -177.37 47.67 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -168.22 140.93 3.03 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.25 -0.278 . . . . 1.0 110.25 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.429 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -148.46 167.43 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-N 116.448 -0.342 . . . . 1.0 110.912 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.2 m -127.09 121.09 30.51 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 108.278 -1.008 . . . . 1.0 108.278 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.3 mt -105.77 133.09 51.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.871 -1.059 . . . . 1.0 110.097 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.479 ' CE1' HG22 ' A' ' 5' ' ' THR . 68.1 m-85 -115.92 126.52 54.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.361 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -53.75 -29.31 39.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.561 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -118.19 153.29 34.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.206 0.527 . . . . 1.0 110.365 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -58.38 -174.51 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.348 -0.842 . . . . 1.0 110.348 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.13 26.45 0.53 Allowed Glycine 0 N--CA 1.461 0.32 0 N-CA-C 110.798 -0.921 . . . . 1.0 110.798 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 50.29 68.98 0.67 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.395 -0.403 . . . . 1.0 110.304 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -129.35 -156.48 0.76 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.958 0.409 . . . . 1.0 110.485 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.41 -151.68 0.1 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.088 -0.805 . . . . 1.0 111.088 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.1 147.16 51.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.319 . . . . 1.0 110.689 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.8 p-80 -135.84 150.57 49.45 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.363 0.601 . . . . 1.0 110.25 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.54 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.1 t80 -145.22 142.13 29.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.22 -0.9 . . . . 1.0 110.203 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.54 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 31.0 tt0 -110.62 122.53 48.0 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.174 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . 0.453 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -110.41 127.05 54.91 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.535 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -119.41 13.6 12.71 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.392 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.8 m -158.29 172.31 18.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 1.0 110.692 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.448 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 50.0 p-10 -62.49 137.33 58.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.505 -0.771 . . . . 1.0 112.051 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.453 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -133.08 143.49 49.36 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.463 -0.789 . . . . 1.0 110.404 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.403 HG22 ' CE2' ' A' ' 51' ' ' TYR . 18.4 p -112.36 -16.11 13.0 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.527 -0.76 . . . . 1.0 111.724 -179.145 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -149.88 115.19 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 1.0 110.32 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.7 mt -117.89 0.51 11.93 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.334 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 4.3 mt-30 -52.92 -42.16 88.79 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.043 179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 39.1 Cg_exo -59.26 -33.66 97.98 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.078 1.852 . . . . 1.0 111.556 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.94 -53.13 3.78 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.828 0.347 . . . . 1.0 111.012 -179.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -117.3 126.27 52.45 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.463 -178.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.6 t -93.93 -7.68 42.31 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.61 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.471 ' HG2' HD22 ' A' ' 34' ' ' ASN . 15.5 tpp180 -146.97 -60.65 0.29 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.436 -0.347 . . . . 1.0 111.923 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.3 t 64.98 75.81 0.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 O-C-N 123.269 0.356 . . . . 1.0 110.128 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ASN . . . . . 0.471 HD22 ' HG2' ' A' ' 32' ' ' ARG . 91.1 m-20 -93.1 3.34 55.89 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 116.33 -0.396 . . . . 1.0 111.32 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.9 p -155.41 157.35 36.91 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.959 -0.386 . . . . 1.0 109.959 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.75 155.32 34.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.006 -0.543 . . . . 1.0 111.059 -178.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.478 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 24.3 mtp85 -133.81 122.02 22.65 Favored 'General case' 0 C--O 1.21 -0.98 0 N-CA-C 108.371 -0.974 . . . . 1.0 108.371 178.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.94 114.63 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-O 121.259 0.552 . . . . 1.0 110.05 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -74.22 -44.89 51.38 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.002 -0.999 . . . . 1.0 110.695 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.1 t -162.68 155.13 19.01 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.643 -0.503 . . . . 1.0 109.643 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.89 175.97 50.06 Favored Glycine 0 C--N 1.317 -0.513 0 N-CA-C 110.566 -1.014 . . . . 1.0 110.566 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.1 m -111.94 138.1 49.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.671 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 54.9 m95 -126.04 146.29 49.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.619 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.515 ' C ' HD23 ' A' ' 45' ' ' LEU . 18.5 tpp -121.4 130.78 53.79 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 108.684 -0.858 . . . . 1.0 108.684 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.515 HD23 ' C ' ' A' ' 44' ' ' MET . 1.3 mt -110.1 132.08 54.48 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.026 -0.731 . . . . 1.0 109.026 -179.374 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.453 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 64.2 m-85 -108.12 130.96 55.08 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.634 0.731 . . . . 1.0 110.306 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.7 -34.61 71.5 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.006 -0.997 . . . . 1.0 110.596 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.0 mt-30 -109.5 153.04 43.04 Favored Pre-proline 0 C--N 1.333 -0.119 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.339 -178.758 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.29 160.24 35.93 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.308 2.005 . . . . 1.0 112.497 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 62.13 38.21 13.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.364 -0.835 . . . . 1.0 111.106 -179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.453 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.9 m-85 48.99 75.24 0.15 Allowed 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.899 -1.046 . . . . 1.0 111.02 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.6 m -143.91 154.2 43.09 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.021 0.439 . . . . 1.0 110.276 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.65 -150.02 22.15 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.978 -0.63 . . . . 1.0 111.947 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.621 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.8 tp -74.92 144.5 43.25 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.043 -0.579 . . . . 1.0 110.265 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -122.42 151.52 41.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.671 0.272 . . . . 1.0 110.433 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 8.4 m-85 -128.23 126.19 40.44 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.742 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.421 ' C ' HD12 ' A' ' 58' ' ' LEU . 46.8 t80 -83.43 123.81 30.06 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.019 0.437 . . . . 1.0 109.886 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.8 mp -117.3 145.61 43.88 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.079 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtm-85 -131.98 157.11 44.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.401 -0.818 . . . . 1.0 109.767 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 59' ' ' ARG . 71.8 ttt180 -36.32 126.52 0.79 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.69 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.94 -177.89 32.78 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.348 -1.101 . . . . 1.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.478 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 68.6 m-20 -115.99 129.56 56.43 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.86 0.362 . . . . 1.0 110.209 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -123.27 112.86 18.14 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.439 -0.578 . . . . 1.0 109.439 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.6 -4.23 55.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.882 -0.599 . . . . 1.0 111.456 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 76.7 m-20 -147.72 139.33 23.87 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.18 -0.674 . . . . 1.0 109.18 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.483 ' CB ' ' CZ2' ' A' ' 69' ' ' TRP . 15.2 p-80 -59.98 -41.14 91.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.093 0.473 . . . . 1.0 110.971 -179.072 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 25.3 mm100 -53.84 -7.6 0.13 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.67 179.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.479 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.0 mm-40 -83.96 -35.29 24.08 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.58 -0.448 . . . . 1.0 111.506 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.81 15.45 12.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 119.286 -0.388 . . . . 1.0 110.938 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.585 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 77.0 mtp 83.77 16.35 0.26 Allowed 'General case' 0 N--CA 1.463 0.215 0 O-C-N 123.922 0.764 . . . . 1.0 109.932 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.417 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -62.73 101.57 0.42 Allowed Glycine 0 C--N 1.344 1.007 0 C-N-CA 120.068 -1.063 . . . . 1.0 110.68 178.748 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 64.6 mt -77.9 -35.84 50.25 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.976 -0.379 . . . . 1.0 109.976 177.185 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.508 ' C ' ' H ' ' A' ' 75' ' ' SER . 27.5 t -124.52 121.01 33.63 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.844 0.354 . . . . 1.0 110.151 178.858 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 55.5 p-10 -71.16 35.91 0.05 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.21 -0.45 . . . . 1.0 110.697 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.508 ' H ' ' C ' ' A' ' 73' ' ' SER . 27.2 m -111.17 72.39 0.78 Allowed 'General case' 0 C--O 1.213 -0.853 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.539 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.87 118.57 46.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 109.317 -0.623 . . . . 1.0 109.317 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -124.41 3.14 8.42 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.192 -0.458 . . . . 1.0 111.393 -178.546 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 p -163.47 162.54 24.73 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.062 0.458 . . . . 1.0 110.647 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.4 p -155.49 147.09 23.01 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.748 . . . . 1.0 110.105 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.45 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 2.9 ptm180 -128.02 152.44 47.93 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.796 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.1 tt -104.65 128.54 52.73 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.957 -1.127 . . . . 1.0 107.957 178.262 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.796 ' N ' HD23 ' A' ' 81' ' ' LEU . 2.3 mt -90.56 115.71 64.76 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.295 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.0 153.94 14.41 Favored 'Trans proline' 0 N--CA 1.502 2.013 0 C-N-CA 122.468 2.112 . . . . 1.0 112.97 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.6 m170 -73.44 -174.51 1.69 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.646 -0.706 . . . . 1.0 110.191 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' SER . . . . . 0.422 ' OG ' ' CA ' ' A' ' 129' ' ' GLY . 3.1 t -167.88 137.46 2.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.028 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -82.22 -73.27 1.22 Allowed Glycine 0 CA--C 1.521 0.425 0 N-CA-C 109.843 -1.303 . . . . 1.0 109.843 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 m -87.15 152.1 22.63 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -132.2 120.22 21.92 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.624 -0.262 . . . . 1.0 111.179 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -146.92 134.7 21.19 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.957 -0.386 . . . . 1.0 109.957 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.496 HD12 HG22 ' A' ' 126' ' ' VAL . 18.0 tt -147.81 138.61 17.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.71 -0.223 . . . . 1.0 110.83 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -118.03 102.2 8.86 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.457 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.78 147.32 27.66 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.315 -0.402 . . . . 1.0 111.288 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.464 ' CD2' ' O ' ' A' ' 97' ' ' ASP . 65.3 m-85 -118.28 133.66 55.7 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 115.554 -0.748 . . . . 1.0 111.508 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.648 ' OE1' ' O ' ' A' ' 101' ' ' GLN . 0.5 OUTLIER -55.21 -36.49 66.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.965 -1.016 . . . . 1.0 111.291 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.612 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 36.8 mtp85 -130.98 170.05 14.99 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.419 -0.355 . . . . 1.0 110.131 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -43.15 152.25 0.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.837 -0.62 . . . . 1.0 110.723 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.464 ' O ' ' CD2' ' A' ' 93' ' ' TYR . 69.7 m-20 57.13 -102.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.266 -0.879 . . . . 1.0 110.369 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -166.64 37.77 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.092 -0.643 . . . . 1.0 109.536 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -95.38 70.82 3.17 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.416 0.627 . . . . 1.0 111.56 -178.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 161.78 -155.28 26.48 Favored Glycine 0 CA--C 1.533 1.173 0 CA-C-N 114.931 -1.031 . . . . 1.0 111.413 179.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.648 ' O ' ' OE1' ' A' ' 94' ' ' GLU . 67.4 tp60 -63.81 134.46 55.29 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 120.992 0.425 . . . . 1.0 111.728 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.402 ' SD ' ' C ' ' A' ' 102' ' ' MET . 0.5 OUTLIER -122.41 138.6 54.48 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.8 tt -139.99 138.57 37.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.246 -0.65 . . . . 1.0 109.246 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -112.95 147.25 37.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.203 0.525 . . . . 1.0 110.359 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.531 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 74.8 m-85 -130.56 154.45 47.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.684 -1.144 . . . . 1.0 110.285 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 18.2 p -143.28 9.3 1.64 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.547 -0.751 . . . . 1.0 111.17 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.956 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.1 pt-20 -158.51 81.08 0.82 Allowed 'General case' 0 C--O 1.216 -0.664 0 CA-C-O 118.488 -0.768 . . . . 1.0 109.884 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.956 ' O ' ' O ' ' A' ' 107' ' ' GLU . 14.0 p-10 18.46 164.99 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.514 1.149 . . . . 1.0 113.482 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 109' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 108' ' ' ASP . 98.3 m -148.43 107.58 3.89 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 120.133 -1.604 . . . . 1.0 109.896 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.442 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.0 p -66.28 -19.59 65.86 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.667 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.1 m -146.61 95.09 2.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.269 0.557 . . . . 1.0 109.974 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.531 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -62.39 -42.33 99.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.54 -0.754 . . . . 1.0 110.285 -179.201 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -45.72 -14.65 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.345 -0.388 . . . . 1.0 111.47 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 112' ' ' LEU . 81.3 m-20 -93.05 7.15 45.33 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.582 0.706 . . . . 1.0 110.481 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 112' ' ' LEU . 39.4 mmt180 -136.67 -42.78 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.508 -1.224 . . . . 1.0 113.719 -177.232 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.625 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -125.26 143.4 50.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.646 0.736 . . . . 1.0 110.667 -178.509 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 87.1 mtt180 -72.63 -73.7 0.19 Allowed 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.748 -0.781 . . . . 1.0 110.616 -177.673 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.606 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 93.2 m-85 -30.46 142.18 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 O-C-N 123.821 0.701 . . . . 1.0 110.391 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -104.3 12.44 33.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.851 0.358 . . . . 1.0 110.905 -178.467 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -142.02 138.48 31.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.536 0.684 . . . . 1.0 111.012 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.9 mm -120.43 118.09 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-N 115.067 -0.97 . . . . 1.0 109.088 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -109.9 24.09 13.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.629 -0.714 . . . . 1.0 111.497 -178.783 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.3 p 170.17 150.0 0.04 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.046 0.451 . . . . 1.0 109.825 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.403 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.8 pp -163.48 157.97 20.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.353 -0.84 . . . . 1.0 110.232 -178.219 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -125.16 120.27 30.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.529 -179.515 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.496 HG22 HD12 ' A' ' 90' ' ' ILE . 43.5 t -103.83 104.21 16.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 178.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.916 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.13 -40.32 31.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.564 -0.744 . . . . 1.0 111.22 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -139.88 148.21 41.74 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.106 0.479 . . . . 1.0 110.766 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.422 ' CA ' ' OG ' ' A' ' 85' ' ' SER . . . 59.11 -176.86 2.46 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.029 -0.828 . . . . 1.0 111.029 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.427 ' OG ' HG21 ' A' ' 170' ' ' VAL . 22.0 p -117.46 151.71 36.52 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -127.56 168.21 15.27 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.53 -0.759 . . . . 1.0 110.526 -178.632 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.54 144.84 25.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.516 ' HG ' HD11 ' A' ' 146' ' ' LEU . 48.3 mt -111.48 142.83 43.24 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 134' ' ' TYR . . . . . 0.419 ' CE2' ' HG2' ' A' ' 143' ' ' GLN . 39.1 m-85 -117.55 131.61 56.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.801 0.334 . . . . 1.0 110.247 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -43.82 -44.74 7.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.283 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -130.77 169.25 15.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.999 0.428 . . . . 1.0 110.001 -179.345 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.441 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 3.1 t -73.64 168.81 18.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.849 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 138' ' ' ASN . . . . . 0.441 ' N ' ' OG ' ' A' ' 137' ' ' SER . 3.2 t-20 69.32 14.82 8.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.142 -0.935 . . . . 1.0 109.911 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 41.42 78.43 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.241 -0.436 . . . . 1.0 111.997 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.562 ' C ' HD11 ' A' ' 136' ' ' LEU . 89.0 mtt-85 -147.46 35.36 0.87 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 120.926 0.393 . . . . 1.0 110.462 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -145.81 -150.14 5.14 Favored Glycine 0 N--CA 1.464 0.516 0 N-CA-C 111.763 -0.535 . . . . 1.0 111.763 -177.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.437 ' NH1' HG21 ' A' ' 160' ' ' THR . 95.2 mtt180 -69.51 165.35 21.16 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.904 -0.406 . . . . 1.0 109.904 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.585 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 42.3 mt-30 -142.8 135.01 27.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.552 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -126.86 124.75 40.32 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 108.807 -0.812 . . . . 1.0 108.807 178.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.651 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -82.2 126.63 32.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.048 -179.0 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.651 ' N ' HD23 ' A' ' 145' ' ' LEU . 23.7 mt -114.79 100.01 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.206 -0.907 . . . . 1.0 109.391 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.568 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -82.28 158.69 66.27 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.319 -179.199 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -47.36 121.76 5.8 Favored 'Trans proline' 0 N--CA 1.491 1.375 0 C-N-CA 121.632 1.555 . . . . 1.0 111.518 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.53 -154.83 24.93 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.38 -1.088 . . . . 1.0 110.38 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -129.49 129.27 44.35 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.874 0.368 . . . . 1.0 110.226 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.51 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -119.24 130.12 55.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.054 -0.521 . . . . 1.0 109.996 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -118.01 -3.8 11.1 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.843 0.354 . . . . 1.0 110.569 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -155.41 157.73 37.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.26 0.552 . . . . 1.0 109.964 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.544 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -70.3 -21.32 62.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.879 -1.055 . . . . 1.0 111.459 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.533 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.4 mt-30 -66.06 -21.3 66.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.234 0.54 . . . . 1.0 110.971 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -50.21 -47.96 54.59 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.793 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.665 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 19.1 p90 -101.9 18.45 20.57 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.16 0.505 . . . . 1.0 110.167 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.36 75.7 0.21 Allowed Glycine 0 C--N 1.331 0.269 0 N-CA-C 111.103 -0.799 . . . . 1.0 111.103 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.665 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -95.07 -171.05 2.32 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.053 0.454 . . . . 1.0 110.264 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 160' ' ' THR . . . . . 0.437 HG21 ' NH1' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -121.74 -35.94 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.342 -0.844 . . . . 1.0 111.588 -178.681 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.638 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 20.8 t-20 -146.31 -18.98 0.44 Allowed 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 111.948 0.351 . . . . 1.0 111.948 -178.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.676 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 90.66 -21.95 0.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.658 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -42.39 122.57 2.27 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.565 -0.743 . . . . 1.0 110.72 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 162' ' ' ALA . 26.0 t -123.21 133.24 69.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.275 -0.875 . . . . 1.0 110.106 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.33 -29.5 3.94 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.879 -0.489 . . . . 1.0 111.879 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 110' ' ' SER . 16.0 m -163.56 176.69 9.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.829 0.347 . . . . 1.0 110.188 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -160.2 142.6 13.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.841 -0.618 . . . . 1.0 110.52 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -131.84 157.28 44.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.498 -0.556 . . . . 1.0 109.498 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -88.85 153.11 21.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.832 -0.622 . . . . 1.0 109.411 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.427 HG21 ' OG ' ' A' ' 130' ' ' SER . 59.0 t -88.56 88.43 2.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.588 -0.445 . . . . 1.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.7 mp -139.28 138.34 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.235 -0.439 . . . . 1.0 110.439 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -96.73 -33.77 11.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.777 -0.647 . . . . 1.0 110.643 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.691 ' CG ' ' N ' ' A' ' 174' ' ' SER . 0.0 OUTLIER -69.82 -64.77 0.82 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.461 0.648 . . . . 1.0 109.954 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 174' ' ' SER . . . . . 0.691 ' N ' ' CG ' ' A' ' 173' ' ' PHE . 86.1 p . . . . . 0 C--N 1.321 -0.658 0 CA-C-O 117.725 -1.131 . . . . 1.0 111.191 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.078 -0.712 . . . . 1.0 109.078 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.503 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -172.66 172.82 45.23 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.429 -1.068 . . . . 1.0 110.429 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -171.38 111.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 121.034 -0.266 . . . . 1.0 110.692 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.83 169.37 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 120.928 0.394 . . . . 1.0 111.049 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.3 m -127.33 120.23 28.09 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.842 -1.17 . . . . 1.0 107.842 177.142 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -104.72 132.7 50.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.937 -1.029 . . . . 1.0 110.057 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.49 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.8 m-85 -115.15 125.87 53.95 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.394 -0.821 . . . . 1.0 111.022 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -51.63 -34.28 37.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.634 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -114.84 151.54 33.72 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.205 0.526 . . . . 1.0 110.423 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ARG . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' PHE . 12.0 ptm180 -56.42 -171.96 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.588 -179.3 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.28 23.76 0.17 Allowed Glycine 0 C--N 1.332 0.334 0 N-CA-C 110.937 -0.865 . . . . 1.0 110.937 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.451 ' N ' ' O ' ' A' ' 10' ' ' ARG . 9.6 m-85 52.54 69.59 0.67 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.568 -0.316 . . . . 1.0 110.172 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -131.69 -161.37 1.12 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.944 0.402 . . . . 1.0 110.482 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.76 -148.68 1.86 Allowed Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.951 -0.86 . . . . 1.0 110.951 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -72.48 148.1 45.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.786 0.327 . . . . 1.0 110.735 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.4 p-80 -137.04 151.98 49.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.259 0.552 . . . . 1.0 110.409 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.5 t80 -145.23 141.61 28.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.297 -0.865 . . . . 1.0 110.148 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.519 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.5 tt0 -110.42 123.04 49.14 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.895 -0.593 . . . . 1.0 110.183 -179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -111.69 126.95 55.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.288 -0.415 . . . . 1.0 110.994 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 72.0 p -118.78 11.24 12.62 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.809 -0.632 . . . . 1.0 110.566 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.5 p -156.02 168.81 26.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.477 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 50.2 p-10 -58.86 136.75 57.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.638 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' HIS . . . . . 0.419 ' CG ' HD21 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.74 142.99 49.92 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.443 -0.798 . . . . 1.0 110.533 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 24' ' ' THR . . . . . 0.504 ' O ' ' OG ' ' A' ' 78' ' ' SER . 65.4 p -115.73 -11.96 11.57 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.401 -0.818 . . . . 1.0 111.887 -178.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -149.95 110.96 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.274 0.559 . . . . 1.0 109.777 -179.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.419 HD21 ' CG ' ' A' ' 23' ' ' HIS . 36.4 mt -118.01 -3.55 11.12 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.428 -179.386 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.591 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -47.17 -52.67 33.15 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.488 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.591 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.5 Cg_endo -55.88 -32.45 85.21 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 C-N-CA 121.556 1.504 . . . . 1.0 112.295 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.403 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.1 m-85 -91.98 -49.5 6.19 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.362 -0.535 . . . . 1.0 110.38 -178.515 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.3 mt -121.41 126.95 50.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.44 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -94.7 -14.59 24.67 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.725 -0.671 . . . . 1.0 111.942 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -144.59 -55.84 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.381 . . . . 1.0 111.685 -178.067 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.0 t 60.75 79.5 0.24 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.096 -0.335 . . . . 1.0 110.096 -178.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -94.25 4.83 53.35 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.243 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.1 p -156.83 158.03 36.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.958 0.409 . . . . 1.0 110.372 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.68 154.45 32.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.624 . . . . 1.0 110.893 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.5 mtp85 -133.16 122.46 24.06 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 108.688 -0.856 . . . . 1.0 108.688 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.7 t -107.82 115.93 50.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.149 0.5 . . . . 1.0 109.873 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -78.44 -43.6 26.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.465 -0.788 . . . . 1.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 57.7 m -160.42 159.81 31.43 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.375 -0.602 . . . . 1.0 109.375 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.93 176.02 48.98 Favored Glycine 0 C--N 1.316 -0.565 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.9 m -112.49 138.02 49.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.091 -0.707 . . . . 1.0 109.091 178.408 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.598 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 52.4 m95 -127.94 148.82 50.52 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.288 0.566 . . . . 1.0 110.916 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.687 ' C ' HD23 ' A' ' 45' ' ' LEU . 1.9 ttt -128.06 137.04 52.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.413 -0.812 . . . . 1.0 110.021 178.289 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.687 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -113.27 139.73 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.374 -178.884 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -109.64 134.93 51.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.461 0.648 . . . . 1.0 111.711 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 15.4 pt-20 -57.86 -32.41 67.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.863 -1.062 . . . . 1.0 111.133 -178.243 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.438 ' NE2' ' HA3' ' A' ' 53' ' ' GLY . 5.2 pt20 -115.93 155.16 48.17 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.31 -0.626 . . . . 1.0 109.31 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 15.9 Cg_endo -52.82 149.0 26.97 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 121.089 1.193 . . . . 1.0 111.87 179.56 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.543 ' O ' ' CD1' ' A' ' 51' ' ' TYR . 1.2 m-20 75.78 -123.46 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.566 -1.197 . . . . 1.0 109.403 -178.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.543 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -150.96 73.29 1.1 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.18 0.514 . . . . 1.0 110.218 179.034 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 3.4 m -140.08 18.19 2.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.776 -0.647 . . . . 1.0 112.037 -177.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.438 ' HA3' ' NE2' ' A' ' 48' ' ' GLN . . . -137.7 -164.74 10.13 Favored Glycine 0 N--CA 1.467 0.73 0 N-CA-C 111.127 -0.789 . . . . 1.0 111.127 178.803 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.571 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 38.9 tp -59.39 146.76 38.8 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.516 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 4.9 pt20 -121.97 150.09 42.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.696 0.284 . . . . 1.0 110.692 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -125.61 123.64 39.47 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.009 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -83.58 122.32 28.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.112 0.482 . . . . 1.0 110.59 -179.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.5 mp -118.36 145.25 45.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.724 -0.671 . . . . 1.0 110.144 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.635 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 64.1 mtm180 -132.11 157.71 43.51 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.468 -0.787 . . . . 1.0 110.025 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.2 ptm180 -34.32 125.23 0.49 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.035 -0.529 . . . . 1.0 110.941 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.65 -178.3 32.32 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.35 129.02 56.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.059 0.457 . . . . 1.0 110.644 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -122.22 113.2 19.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.507 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.81 -3.66 54.33 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.982 -0.554 . . . . 1.0 111.537 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.9 m-20 -147.64 137.26 22.64 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.001 -0.74 . . . . 1.0 109.001 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.445 ' CB ' ' CZ2' ' A' ' 69' ' ' TRP . 19.3 p-80 -58.93 -37.87 77.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.059 0.457 . . . . 1.0 111.035 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.73 -7.83 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.917 -0.583 . . . . 1.0 110.494 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.437 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.7 mm-40 -83.14 -33.9 26.15 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 120.675 -0.41 . . . . 1.0 111.694 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.445 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.0 p90 -94.41 15.57 17.36 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.812 -0.355 . . . . 1.0 110.813 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.437 ' C ' ' H ' ' A' ' 72' ' ' LEU . 53.3 mtt 75.4 27.92 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.912 0.757 . . . . 1.0 109.942 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.588 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.04 39.82 0.82 Allowed Glycine 0 C--N 1.339 0.727 0 C-N-CA 120.135 -1.031 . . . . 1.0 111.999 -179.46 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.494 ' C ' ' O ' ' A' ' 71' ' ' GLY . 10.3 mt -17.38 -47.75 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.352 0.661 . . . . 1.0 110.823 -178.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.588 ' N ' ' O ' ' A' ' 71' ' ' GLY . 83.2 p -102.64 117.34 34.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.628 -0.715 . . . . 1.0 109.113 177.503 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -66.26 37.28 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.335 -0.393 . . . . 1.0 111.172 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.546 ' H ' ' C ' ' A' ' 73' ' ' SER . 35.6 t -117.36 127.14 53.75 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 109.742 -0.466 . . . . 1.0 109.742 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.1 p -163.57 118.1 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.03 -0.73 . . . . 1.0 109.03 -179.291 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -131.21 12.99 5.12 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.976 -178.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' SER . . . . . 0.504 ' OG ' ' O ' ' A' ' 24' ' ' THR . 3.5 m -160.84 159.55 29.99 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.306 0.574 . . . . 1.0 111.104 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.5 p -155.56 146.55 22.42 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.229 -0.896 . . . . 1.0 110.984 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.602 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 7.9 ptm180 -125.49 150.8 47.05 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.706 HD23 ' N ' ' A' ' 82' ' ' ILE . 3.8 tt -102.6 121.84 43.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.347 -1.353 . . . . 1.0 107.347 178.405 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.706 ' N ' HD23 ' A' ' 81' ' ' LEU . 5.3 mt -84.12 116.64 65.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 116.115 -0.493 . . . . 1.0 109.903 -178.274 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -53.81 150.53 29.27 Favored 'Trans proline' 0 N--CA 1.5 1.884 0 C-N-CA 121.912 1.741 . . . . 1.0 113.219 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -71.77 177.7 4.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.251 -0.886 . . . . 1.0 110.614 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.7 t -168.24 147.4 4.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.971 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -99.31 -56.04 1.01 Allowed Glycine 0 N--CA 1.465 0.615 0 N-CA-C 110.397 -1.081 . . . . 1.0 110.397 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.6 m -90.19 144.69 25.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.85 0.357 . . . . 1.0 110.093 179.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -133.48 110.11 9.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.856 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -137.99 131.69 31.14 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.839 -0.344 . . . . 1.0 110.084 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.428 HG22 ' CZ2' ' A' ' 131' ' ' TRP . 19.5 tt -147.84 148.26 16.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.84 0.352 . . . . 1.0 111.114 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -125.73 98.07 5.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.565 -0.743 . . . . 1.0 111.699 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' LEU . . . . . 0.428 HD11 HD22 ' A' ' 167' ' ' LEU . 17.4 mt -75.57 135.95 40.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 1.0 110.071 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.413 ' CG ' ' HA ' ' A' ' 98' ' ' TYR . 63.7 m-85 -117.78 138.28 52.16 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.566 0.698 . . . . 1.0 111.481 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.526 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.8 OUTLIER -56.56 -65.04 0.68 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.348 -0.842 . . . . 1.0 111.79 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -96.68 173.25 7.42 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.352 0.596 . . . . 1.0 111.446 -178.674 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -64.05 167.53 6.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.845 -1.071 . . . . 1.0 111.697 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ASP . . . . . 0.498 ' C ' ' CG ' ' A' ' 98' ' ' TYR . 66.5 t0 49.35 36.51 9.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.83 -1.077 . . . . 1.0 111.093 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.57 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER 56.13 35.75 26.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.313 -0.858 . . . . 1.0 110.639 178.344 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 78.7 mtp85 -99.25 148.91 23.65 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.129 0.49 . . . . 1.0 110.812 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.08 -164.62 31.17 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.27 -0.732 . . . . 1.0 111.27 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -63.07 146.13 53.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.958 0.408 . . . . 1.0 110.798 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.497 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.1 ppp? -132.49 158.67 41.5 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.743 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.8 tt -148.85 142.07 18.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 73.4 tt0 -113.53 141.94 46.55 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.619 0.723 . . . . 1.0 110.804 -178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.783 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 83.7 m-85 -129.32 151.68 49.71 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 114.669 -1.15 . . . . 1.0 110.267 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.4 p -143.63 16.95 1.82 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.082 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.97 ' O ' ' O ' ' A' ' 108' ' ' ASP . 4.9 pt-20 -166.31 86.14 0.32 Allowed 'General case' 0 C--O 1.213 -0.867 0 CA-C-O 118.328 -0.844 . . . . 1.0 111.013 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.97 ' O ' ' O ' ' A' ' 107' ' ' GLU . 7.8 t70 16.68 154.34 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 122.231 1.015 . . . . 1.0 113.16 178.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 4.1 t -140.99 104.82 4.74 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.098 -1.001 . . . . 1.0 110.531 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.3 m -64.52 -31.72 73.05 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.246 -0.434 . . . . 1.0 110.726 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.2 t -137.09 90.14 2.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.073 -0.512 . . . . 1.0 110.099 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.783 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.2 tp -62.03 -42.86 99.62 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.736 -0.666 . . . . 1.0 110.423 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.615 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 4.2 mp0 -43.08 -9.7 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' A' ' 112' ' ' LEU . 84.0 m-20 -95.31 -20.83 18.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.176 0.512 . . . . 1.0 110.472 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 112' ' ' LEU . 24.9 mmt85 -109.96 -35.72 6.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.405 -0.816 . . . . 1.0 113.149 -178.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.676 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.71 137.24 54.83 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.765 0.793 . . . . 1.0 110.151 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.8 mtt180 -75.27 -70.66 0.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 120.914 -1.116 . . . . 1.0 110.653 -177.739 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.632 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 87.4 m-85 -33.0 145.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.307 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -104.32 10.49 35.48 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.779 0.323 . . . . 1.0 111.115 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 120' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 76.7 mt-10 -141.07 141.72 34.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.087 0.47 . . . . 1.0 111.228 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 35.4 mm -122.68 116.44 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.564 -0.744 . . . . 1.0 109.116 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.463 ' O ' ' CB ' ' A' ' 123' ' ' SER . 41.7 m-70 -109.34 31.13 5.99 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.333 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.6 t 161.59 150.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.14 0.495 . . . . 1.0 110.661 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.437 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 0.9 OUTLIER -159.63 156.05 27.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.524 -0.762 . . . . 1.0 110.529 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 6.8 t-20 -126.87 107.26 9.95 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.702 -0.481 . . . . 1.0 109.702 -179.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.598 HG13 ' H ' ' A' ' 149' ' ' GLY . 1.1 p -104.57 108.18 24.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 108.666 -0.864 . . . . 1.0 108.666 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.965 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.3 OUTLIER -78.4 -33.25 48.86 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.875 -1.057 . . . . 1.0 110.83 -179.04 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -148.61 164.76 33.34 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.277 0.561 . . . . 1.0 110.859 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 55.81 170.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 110.416 -1.074 . . . . 1.0 110.416 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.514 ' OG ' HD11 ' A' ' 145' ' ' LEU . 4.1 t -115.67 146.76 41.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 41.1 m95 -120.79 161.16 21.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.076 -177.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.7 t -135.84 98.56 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.622 HD13 HD11 ' A' ' 146' ' ' LEU . 5.5 mp -69.71 138.51 52.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.527 -0.306 . . . . 1.0 110.26 -179.012 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 134' ' ' TYR . . . . . 0.63 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 43.3 m-85 -118.31 133.4 55.92 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.825 -0.625 . . . . 1.0 110.802 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 135' ' ' GLU . . . . . 0.448 ' OE2' ' CD ' ' A' ' 163' ' ' ARG . 42.9 tp10 -39.94 -56.14 1.88 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.858 -0.61 . . . . 1.0 111.199 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.59 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -123.92 170.45 10.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.487 -178.494 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 22.0 p -74.7 169.16 18.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.372 -0.831 . . . . 1.0 110.744 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 59.6 t30 67.24 17.27 10.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.268 -0.878 . . . . 1.0 109.667 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 139' ' ' TYR . . . . . 0.402 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.0 m-85 38.1 80.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.873 -0.603 . . . . 1.0 112.215 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.534 ' C ' HD11 ' A' ' 136' ' ' LEU . 15.9 tpp180 -148.98 39.79 0.86 Allowed 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.815 0.34 . . . . 1.0 110.326 179.302 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.15 -136.28 2.47 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.197 -0.761 . . . . 1.0 111.197 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 142' ' ' ARG . . . . . 0.451 ' NH2' HD13 ' A' ' 54' ' ' LEU . 77.1 mtp85 -81.22 172.34 13.75 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.209 -0.293 . . . . 1.0 110.209 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -149.35 134.85 18.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.512 . . . . 1.0 111.188 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -130.05 120.0 24.0 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.924 0.392 . . . . 1.0 110.212 179.122 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.514 HD11 ' OG ' ' A' ' 130' ' ' SER . 53.2 tp -79.97 131.24 35.78 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.614 0.721 . . . . 1.0 110.8 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.622 HD11 HD13 ' A' ' 133' ' ' LEU . 22.9 mt -117.27 105.03 11.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.023 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.602 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.7 mtm -77.52 159.56 76.89 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 109.823 -0.436 . . . . 1.0 109.823 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.45 114.81 2.08 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.207 1.938 . . . . 1.0 111.999 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 149' ' ' GLY . . . . . 0.598 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 175.21 -154.98 19.46 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 50.5 p-10 -121.23 136.11 55.02 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.061 0.458 . . . . 1.0 110.715 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.542 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 9.8 m-85 -127.29 126.76 43.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 32.1 ptt-85 -117.22 3.67 12.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.874 0.369 . . . . 1.0 110.305 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -162.37 160.72 26.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.532 0.682 . . . . 1.0 110.482 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.581 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -74.68 -17.96 60.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.869 -1.06 . . . . 1.0 111.93 -178.476 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.534 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.5 mt-30 -66.4 -20.55 66.1 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.115 -0.493 . . . . 1.0 111.214 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 156' ' ' ASP . . . . . 0.542 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 41.6 t0 -50.39 -49.47 54.39 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.067 -178.686 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.553 ' NE1' ' HB2' ' A' ' 159' ' ' ALA . 36.1 p90 -101.55 19.2 18.42 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.033 0.444 . . . . 1.0 110.323 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.0 75.14 0.24 Allowed Glycine 0 CA--C 1.518 0.253 0 CA-C-N 115.617 -0.719 . . . . 1.0 111.433 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.581 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . . . -95.4 -171.14 2.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 1.0 110.71 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.31 -40.85 2.55 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.295 -0.866 . . . . 1.0 111.955 -178.099 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.631 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.7 OUTLIER -143.01 -16.52 0.68 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.974 -177.744 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.631 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 90.32 -21.24 0.12 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.832 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 163' ' ' ARG . . . . . 0.448 ' CD ' ' OE2' ' A' ' 135' ' ' GLU . 17.4 ptp180 -44.35 123.56 3.57 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.593 0.711 . . . . 1.0 110.939 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 162' ' ' ALA . 11.8 t -119.54 156.08 22.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.159 -0.928 . . . . 1.0 110.343 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.401 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -128.11 -34.47 0.54 Allowed Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.711 -0.677 . . . . 1.0 111.512 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 4.9 p -159.17 -167.72 2.15 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.051 -0.351 . . . . 1.0 110.051 -178.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.589 HD21 HD13 ' A' ' 112' ' ' LEU . 1.8 pp -174.49 137.06 0.48 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.283 -0.417 . . . . 1.0 110.357 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.635 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 8.1 ptp180 -131.94 150.18 52.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 1.0 109.845 179.278 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -81.49 153.25 26.94 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.454 -0.793 . . . . 1.0 108.956 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 54.7 t -87.78 88.19 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.921 0.391 . . . . 1.0 111.309 -179.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.438 ' CG2' ' H ' ' A' ' 174' ' ' SER . 3.5 mp -137.69 134.45 45.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.084 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -103.56 -6.36 21.8 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.977 -0.556 . . . . 1.0 110.737 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.694 ' CG ' ' N ' ' A' ' 174' ' ' SER . 0.0 OUTLIER -95.99 -65.27 0.98 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.501 -0.555 . . . . 1.0 109.501 179.763 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 174' ' ' SER . . . . . 0.694 ' N ' ' CG ' ' A' ' 173' ' ' PHE . 68.5 m . . . . . 0 C--O 1.221 -0.416 0 CA-C-O 117.678 -1.153 . . . . 1.0 111.143 -178.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.16 -0.681 . . . . 1.0 109.16 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.612 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -80.37 174.2 54.94 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.629 -0.988 . . . . 1.0 110.629 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 mttm 179.21 103.84 0.03 OUTLIER 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.676 -0.308 . . . . 1.0 110.289 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.77 170.94 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.838 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.543 HG22 ' CE1' ' A' ' 7' ' ' TYR . 31.4 m -129.53 121.24 26.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.256 -1.016 . . . . 1.0 108.256 177.112 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.3 mt -106.6 132.79 52.2 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 114.939 -1.028 . . . . 1.0 110.238 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.543 ' CE1' HG22 ' A' ' 5' ' ' THR . 50.9 m-85 -114.42 130.47 56.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.355 -0.839 . . . . 1.0 111.127 -178.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.451 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 83.8 tt0 -55.8 -24.15 34.31 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.464 -0.789 . . . . 1.0 110.403 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -126.91 153.48 45.71 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.173 0.511 . . . . 1.0 110.221 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.6 ptt85 -56.63 -173.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.51 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.69 30.24 0.32 Allowed Glycine 0 C--N 1.333 0.408 0 N-CA-C 110.994 -0.842 . . . . 1.0 110.994 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . 0.557 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 46.38 68.94 0.53 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.472 -0.364 . . . . 1.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -126.88 -157.49 0.81 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.15 -146.9 0.26 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.972 -0.851 . . . . 1.0 110.972 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.2 mmt180 -74.54 150.13 39.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.905 0.383 . . . . 1.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 8.7 p80 -136.98 145.38 44.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.334 0.588 . . . . 1.0 110.24 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 7.1 t80 -139.89 142.78 36.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.069 -0.969 . . . . 1.0 109.893 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.511 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.1 tt0 -111.24 122.99 49.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.293 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 t -109.51 126.58 53.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.17 -0.468 . . . . 1.0 109.947 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.0 m -117.38 7.32 12.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.308 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 89.5 p -153.84 167.9 28.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.816 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASP . . . . . 0.443 ' O ' ' OD1' ' A' ' 22' ' ' ASP . 51.9 p-10 -57.72 137.46 56.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.708 -0.678 . . . . 1.0 111.493 -179.455 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.03 149.25 50.11 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.619 -0.718 . . . . 1.0 110.649 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 p -116.75 -18.9 10.14 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.799 -0.637 . . . . 1.0 112.083 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.451 ' OD1' ' CG ' ' A' ' 28' ' ' PRO . 2.3 t-20 -132.1 115.64 16.01 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.246 0.546 . . . . 1.0 110.503 -178.633 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.8 mp -115.39 -8.14 12.26 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.027 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.621 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 12.6 mt-30 -60.13 -41.41 84.41 Favored Pre-proline 0 CA--C 1.516 -0.358 0 C-N-CA 120.454 -0.498 . . . . 1.0 110.43 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.6 Cg_exo -58.61 -41.28 65.85 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.084 1.856 . . . . 1.0 112.112 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -92.96 -47.41 7.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.164 0.507 . . . . 1.0 111.103 -178.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.56 128.02 54.54 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.46 -0.791 . . . . 1.0 111.307 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 t -90.88 -16.31 28.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.133 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 43.9 ttm180 -174.5 119.84 0.24 Allowed 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.955 -0.757 . . . . 1.0 108.955 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.6 t -99.2 112.08 24.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.678 0.275 . . . . 1.0 110.644 179.283 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -106.25 -3.97 20.67 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.343 -0.39 . . . . 1.0 110.229 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.557 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.6 t -156.16 155.64 32.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.881 0.372 . . . . 1.0 110.309 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.74 155.5 37.32 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.092 -0.503 . . . . 1.0 110.786 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.0 mtt-85 -135.15 122.76 22.11 Favored 'General case' 0 C--O 1.212 -0.872 0 N-CA-C 108.953 -0.758 . . . . 1.0 108.953 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.3 t -107.99 130.08 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.156 0.503 . . . . 1.0 109.66 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -90.07 -43.21 10.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.276 -0.875 . . . . 1.0 110.635 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.2 p -161.8 164.45 28.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.725 -0.472 . . . . 1.0 109.725 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' GLY . . . . . 0.422 ' H ' ' CG ' ' A' ' 172' ' ' ASP . . . 76.49 175.87 41.29 Favored Glycine 0 C--N 1.316 -0.549 0 N-CA-C 111.278 -0.729 . . . . 1.0 111.278 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 97.7 m -111.69 129.63 56.04 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.484 -0.562 . . . . 1.0 109.484 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.47 145.81 43.02 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.751 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.567 ' C ' HD12 ' A' ' 45' ' ' LEU . 17.3 tpp -122.05 130.55 53.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.282 -0.872 . . . . 1.0 109.496 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.567 HD12 ' C ' ' A' ' 44' ' ' MET . 10.1 mp -108.69 131.82 54.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.544 -0.753 . . . . 1.0 109.429 -179.598 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' TYR . . . . . 0.402 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 85.3 m-85 -111.17 132.28 54.43 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.383 0.611 . . . . 1.0 111.814 -179.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.625 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.7 pt-20 -57.08 -36.14 70.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.271 -0.877 . . . . 1.0 111.261 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLN . . . . . 0.421 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.9 mt-30 -107.31 153.37 41.21 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.598 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.13 159.59 46.04 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.419 2.079 . . . . 1.0 112.045 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 62.92 34.66 14.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.545 -0.752 . . . . 1.0 111.388 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.402 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.6 m-85 54.1 76.45 0.23 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.267 -0.878 . . . . 1.0 111.439 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.1 m -146.04 154.15 41.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.077 0.465 . . . . 1.0 110.442 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.64 -148.41 21.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.031 -0.604 . . . . 1.0 111.805 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.625 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.7 tp -75.61 144.11 41.94 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.358 -0.421 . . . . 1.0 110.475 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.599 HE22 ' H ' ' A' ' 145' ' ' LEU . 1.0 OUTLIER -119.31 153.57 34.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.549 0.214 . . . . 1.0 110.496 179.169 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.448 ' O ' ' SD ' ' A' ' 44' ' ' MET . 39.9 m-85 -125.93 123.63 38.99 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 120.821 0.344 . . . . 1.0 110.457 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.465 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 43.2 t80 -82.87 123.25 29.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.128 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 mp -120.27 145.06 47.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.248 -0.887 . . . . 1.0 110.5 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 44.8 mtp180 -132.13 157.52 44.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.103 -0.953 . . . . 1.0 110.433 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.1 ttp85 -37.54 126.67 1.11 Allowed 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.856 -0.611 . . . . 1.0 110.765 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 179.9 31.9 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.471 -1.051 . . . . 1.0 110.471 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.7 p-10 -114.34 127.68 55.98 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.984 0.421 . . . . 1.0 110.399 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' TYR . . . . . 0.456 ' O ' ' OG ' ' A' ' 35' ' ' SER . 41.3 m-85 -122.3 113.53 19.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.85 -0.614 . . . . 1.0 109.761 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.94 -4.04 55.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.282 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -146.79 139.21 24.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.495 ' C ' ' H ' ' A' ' 68' ' ' GLN . 16.2 p-80 -60.18 -42.17 94.43 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 120.987 0.423 . . . . 1.0 111.121 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.18 -7.47 0.09 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.498 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.495 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -82.17 -32.25 30.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.269 -178.162 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.1 p90 -97.09 16.85 18.47 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 120.807 -0.357 . . . . 1.0 110.743 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.46 ' C ' ' H ' ' A' ' 72' ' ' LEU . 78.6 mtp 73.34 29.84 1.6 Allowed 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.838 0.711 . . . . 1.0 109.857 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLY . . . . . 0.591 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.55 38.46 0.87 Allowed Glycine 0 C--N 1.338 0.663 0 C-N-CA 120.122 -1.037 . . . . 1.0 111.606 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LEU . . . . . 0.505 ' C ' ' O ' ' A' ' 71' ' ' GLY . 11.7 mt -16.45 -49.13 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.357 0.663 . . . . 1.0 110.937 -178.713 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.591 ' N ' ' O ' ' A' ' 71' ' ' GLY . 39.5 t -102.49 117.58 35.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.428 -0.805 . . . . 1.0 109.003 177.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 48.5 p-10 -68.05 37.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.84 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.529 ' H ' ' C ' ' A' ' 73' ' ' SER . 73.3 m -116.29 125.49 52.25 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.828 -0.434 . . . . 1.0 109.828 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p -163.67 111.58 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.021 -0.733 . . . . 1.0 109.021 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -120.76 14.38 11.69 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.353 -0.385 . . . . 1.0 110.941 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 p -164.91 163.07 21.04 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.05 0.452 . . . . 1.0 110.975 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -154.87 146.24 22.99 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.638 . . . . 1.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ARG . . . . . 0.428 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 1.6 ptm180 -127.68 148.01 50.39 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 120.637 0.256 . . . . 1.0 110.514 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.612 HD21 ' H ' ' A' ' 2' ' ' GLY . 9.4 tp -96.0 111.37 23.4 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.846 -1.168 . . . . 1.0 107.846 177.656 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mt -57.2 110.47 2.47 Favored Pre-proline 0 C--N 1.322 -0.591 0 C-N-CA 120.247 -0.581 . . . . 1.0 110.629 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' PRO . . . . . 0.6 ' HG2' ' CE1' ' A' ' 84' ' ' HIS . 37.9 Cg_endo -79.64 174.12 12.16 Favored 'Trans proline' 0 N--CA 1.49 1.316 0 C-N-CA 121.989 1.792 . . . . 1.0 111.556 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' HIS . . . . . 0.6 ' CE1' ' HG2' ' A' ' 83' ' ' PRO . 10.7 m80 83.27 132.45 0.05 Allowed 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 112.665 0.617 . . . . 1.0 112.665 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.1 p -160.05 163.02 34.28 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.774 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.518 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . 118.25 -112.46 2.39 Favored Glycine 0 N--CA 1.465 0.568 0 N-CA-C 110.877 -0.889 . . . . 1.0 110.877 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.2 m -83.18 155.61 23.65 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.663 -0.495 . . . . 1.0 109.663 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.518 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 2.5 m80 -131.64 115.28 15.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.115 -0.234 . . . . 1.0 110.811 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 46.3 mtm-85 -143.38 134.64 25.9 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 1.0 110.017 178.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.516 HD12 HG22 ' A' ' 126' ' ' VAL . 15.7 tt -146.58 143.81 20.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.719 0.295 . . . . 1.0 110.967 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -121.33 97.7 5.63 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.872 -0.604 . . . . 1.0 111.427 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.9 mt -76.56 138.29 40.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.559 . . . . 1.0 110.184 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -117.0 136.47 52.92 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 115.432 -0.803 . . . . 1.0 111.093 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.561 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -57.99 -70.28 0.14 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.135 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -96.17 174.51 6.86 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.29 0.567 . . . . 1.0 110.639 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -65.51 165.05 12.82 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.188 -0.914 . . . . 1.0 110.58 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 42.6 26.54 0.07 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.502 -0.772 . . . . 1.0 110.855 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.521 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.7 OUTLIER 64.66 26.44 13.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.064 -0.517 . . . . 1.0 111.349 178.897 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -81.55 41.99 0.66 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.193 0.52 . . . . 1.0 111.373 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -169.72 -175.22 38.63 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.025 -0.83 . . . . 1.0 111.025 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -58.01 151.22 18.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 1.0 110.332 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ptm -130.79 156.37 45.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.358 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.9 tt -150.56 142.53 16.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 N-CA-C 109.632 -0.507 . . . . 1.0 109.632 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -113.56 144.09 43.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.435 0.636 . . . . 1.0 110.81 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.647 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 78.0 m-85 -131.01 152.73 50.0 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 114.59 -1.186 . . . . 1.0 110.265 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 p -143.2 10.85 1.73 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.893 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.969 ' O ' ' O ' ' A' ' 108' ' ' ASP . 7.3 pt-20 -158.85 81.49 0.79 Allowed 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.697 -0.668 . . . . 1.0 109.788 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.969 ' O ' ' O ' ' A' ' 107' ' ' GLU . 54.6 p30 19.86 162.02 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 122.336 1.065 . . . . 1.0 113.236 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 5.9 t -144.0 106.09 4.36 Favored 'General case' 0 C--N 1.315 -0.9 0 O-C-N 120.483 -1.386 . . . . 1.0 109.712 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.469 ' O ' ' OG ' ' A' ' 166' ' ' SER . 15.6 m -68.58 -28.02 66.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.667 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 37.1 t -139.38 89.19 2.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.183 0.516 . . . . 1.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.647 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 1.8 mt -62.29 -42.34 99.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.411 -0.813 . . . . 1.0 110.696 -179.456 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 7.0 mm100 -45.98 -8.07 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.288 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 112' ' ' LEU . 63.8 t0 -96.73 -23.9 16.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.175 0.512 . . . . 1.0 110.526 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 115' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' A' ' 112' ' ' LEU . 28.2 mmt180 -104.49 -40.47 6.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.495 -0.775 . . . . 1.0 112.966 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.692 ' CZ ' ' O ' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -123.62 138.72 54.49 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.362 0.601 . . . . 1.0 109.8 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 118' ' ' PHE . 90.6 mtt180 -71.86 -74.06 0.17 Allowed 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.594 -0.691 . . . . 1.0 111.308 -177.17 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.692 ' O ' ' CZ ' ' A' ' 116' ' ' PHE . 72.4 m-85 -29.56 146.23 0.01 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 O-C-N 123.975 0.797 . . . . 1.0 110.413 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -106.47 13.18 28.79 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.041 0.448 . . . . 1.0 111.155 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -141.73 140.53 33.14 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.912 -0.585 . . . . 1.0 111.113 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.7 mm -120.74 117.12 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 115.38 -0.827 . . . . 1.0 109.036 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 122' ' ' HIS . . . . . 0.471 ' O ' ' CB ' ' A' ' 123' ' ' SER . 38.3 m-70 -108.53 30.16 6.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.914 -0.584 . . . . 1.0 111.395 -178.357 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.471 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.5 p 162.06 152.49 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.034 0.445 . . . . 1.0 110.103 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.465 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.1 pp -163.32 157.71 20.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 1.0 110.149 -178.449 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 7.7 t-20 -124.75 116.21 21.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.965 0.412 . . . . 1.0 109.999 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.516 HG22 HD12 ' A' ' 90' ' ' ILE . 24.0 t -102.78 104.82 17.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 115.818 -0.628 . . . . 1.0 109.704 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.921 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -78.33 -38.66 41.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.633 -0.712 . . . . 1.0 111.433 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -141.59 155.95 45.72 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 120.536 -0.465 . . . . 1.0 110.757 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.96 -175.03 0.14 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 110.475 -1.05 . . . . 1.0 110.475 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 130' ' ' SER . . . . . 0.526 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.9 OUTLIER -116.32 178.53 4.29 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.099 -0.704 . . . . 1.0 109.099 178.856 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.526 ' CD1' ' C ' ' A' ' 130' ' ' SER . 69.7 m95 -148.86 162.87 38.96 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.286 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 24.0 t -136.25 105.53 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.577 -0.283 . . . . 1.0 111.105 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.466 ' HG ' HD11 ' A' ' 146' ' ' LEU . 26.5 mt -77.06 143.0 39.59 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.947 -0.301 . . . . 1.0 110.266 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 134' ' ' TYR . . . . . 0.52 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 37.8 m-85 -119.29 133.24 55.84 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.68 0.276 . . . . 1.0 110.538 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -43.47 -46.86 7.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.531 -0.304 . . . . 1.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.818 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -129.9 165.91 21.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.062 0.458 . . . . 1.0 110.011 -178.355 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 137' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 4.1 t -69.71 174.78 4.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.768 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 138' ' ' ASN . . . . . 0.491 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.7 t30 63.39 18.78 11.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.046 -0.979 . . . . 1.0 109.752 -178.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 37.42 74.87 0.07 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.163 -0.471 . . . . 1.0 111.318 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.818 ' C ' HD11 ' A' ' 136' ' ' LEU . 45.3 mmt-85 -144.2 40.38 1.35 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.872 0.368 . . . . 1.0 110.09 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.423 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -151.69 -146.82 4.42 Favored Glycine 0 N--CA 1.462 0.399 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -178.477 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -70.74 171.16 10.97 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.182 -0.303 . . . . 1.0 110.182 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.465 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 5.7 pt20 -149.29 135.48 19.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.203 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -130.15 124.03 31.71 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.757 -0.461 . . . . 1.0 109.757 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.599 ' H ' HE22 ' A' ' 55' ' ' GLN . 42.7 tp -79.9 127.47 32.29 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.025 -179.767 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.466 HD11 ' HG ' ' A' ' 133' ' ' LEU . 30.0 mt -117.47 107.86 14.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.42 -0.809 . . . . 1.0 110.5 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.428 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.3 OUTLIER -80.67 171.52 12.11 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.794 -179.589 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 148' ' ' PRO . . . . . 0.451 ' HD2' ' CE1' ' A' ' 84' ' ' HIS . 13.7 Cg_exo -67.45 115.7 3.84 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.225 1.95 . . . . 1.0 111.422 179.132 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 177.85 -152.26 11.61 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.621 -0.992 . . . . 1.0 110.621 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.459 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.3 p-10 -127.75 125.2 39.48 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.193 0.521 . . . . 1.0 110.603 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 12.2 m-85 -115.91 127.69 55.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.823 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -114.15 -3.07 13.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.827 0.346 . . . . 1.0 110.762 -179.262 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -157.23 164.45 37.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.732 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 154' ' ' TYR . . . . . 0.572 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.57 -20.76 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.031 -0.986 . . . . 1.0 111.978 -178.547 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -65.55 -21.82 66.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.226 -0.443 . . . . 1.0 111.041 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -48.14 -51.24 25.69 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.029 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.595 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.4 p90 -99.61 19.71 15.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.938 0.399 . . . . 1.0 110.258 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.0 74.36 0.3 Allowed Glycine 0 CA--C 1.518 0.243 0 N-CA-C 111.249 -0.741 . . . . 1.0 111.249 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.595 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.22 -171.13 2.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 1.0 110.233 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 12.6 t -123.15 -33.67 3.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.144 -0.935 . . . . 1.0 111.573 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 161' ' ' ASN . . . . . 0.629 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.8 OUTLIER -149.43 -15.89 0.28 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.757 0.313 . . . . 1.0 111.646 -178.953 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.629 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 89.49 -21.71 0.13 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.48 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -42.02 124.49 2.7 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.674 -0.694 . . . . 1.0 110.748 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 162' ' ' ALA . 24.8 t -120.73 160.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.713 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 165' ' ' GLY . . . . . 0.52 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -138.17 -35.08 0.17 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.282 -0.727 . . . . 1.0 111.282 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -162.06 172.06 16.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.01 0.433 . . . . 1.0 110.577 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 167' ' ' LEU . . . . . 0.407 ' CD2' HD11 ' A' ' 112' ' ' LEU . 0.4 OUTLIER -154.4 144.17 21.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.325 179.929 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.52 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 12.5 ptp180 -134.6 150.3 50.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.268 0.556 . . . . 1.0 110.27 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.522 ' NH2' ' OG ' ' A' ' 174' ' ' SER . 0.0 OUTLIER -76.88 147.69 36.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.146 -0.934 . . . . 1.0 108.698 177.143 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.462 HG21 ' CB ' ' A' ' 130' ' ' SER . 27.6 m -86.33 68.44 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.934 -0.575 . . . . 1.0 112.384 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.438 HD11 ' CD2' ' A' ' 88' ' ' HIS . 1.3 mp -127.18 128.25 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 121.173 0.511 . . . . 1.0 109.913 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 172' ' ' ASP . . . . . 0.542 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 46.2 p-10 -65.08 -34.98 79.7 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.676 -0.693 . . . . 1.0 110.386 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 173' ' ' PHE . . . . . 0.542 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 88.6 m-85 -66.41 176.26 1.92 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.598 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 174' ' ' SER . . . . . 0.522 ' OG ' ' NH2' ' A' ' 169' ' ' ARG . 4.7 p . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.01 -0.995 . . . . 1.0 110.462 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 109.441 -0.577 . . . . 1.0 109.441 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.573 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -176.74 178.93 47.95 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.435 -1.066 . . . . 1.0 110.435 -179.173 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.2 tttt -172.99 106.82 0.15 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.778 -0.369 . . . . 1.0 110.141 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.452 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.91 169.16 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.346 0.594 . . . . 1.0 111.647 -179.771 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.448 HG22 ' CE1' ' A' ' 7' ' ' TYR . 62.3 m -125.07 121.73 35.15 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.35 -0.982 . . . . 1.0 108.35 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.2 134.2 50.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.176 -0.92 . . . . 1.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TYR . . . . . 0.448 ' CE1' HG22 ' A' ' 5' ' ' THR . 86.0 m-85 -114.53 129.73 56.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.036 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 80.5 tt0 -55.62 -20.78 14.91 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.571 -0.741 . . . . 1.0 109.894 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -126.93 163.2 24.19 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.399 0.618 . . . . 1.0 111.0 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -67.82 179.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.0 111.37 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.59 25.98 7.11 Favored Glycine 0 C--N 1.335 0.518 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 51.7 66.02 1.32 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -128.51 -155.06 0.68 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.945 0.402 . . . . 1.0 110.535 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.07 -153.62 0.08 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.012 -0.835 . . . . 1.0 111.012 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -68.62 148.08 50.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.688 0.28 . . . . 1.0 110.75 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -135.46 151.32 50.29 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.418 0.628 . . . . 1.0 110.683 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.3 t80 -147.29 141.64 26.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.975 -1.011 . . . . 1.0 109.682 -179.344 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.8 tt0 -110.07 121.4 45.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.517 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.5 t -107.18 126.0 51.83 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.954 0.407 . . . . 1.0 110.891 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.5 m -118.72 13.22 13.24 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.755 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 49.8 m -158.03 169.49 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.421 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -61.03 136.41 58.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.029 -0.532 . . . . 1.0 111.457 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.34 150.22 51.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.576 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.7 p -117.05 -13.85 10.58 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.084 0.772 . . . . 1.0 113.084 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -152.01 109.43 3.59 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.127 -0.629 . . . . 1.0 111.618 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.3 mp -100.39 -1.76 35.18 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.052 -0.976 . . . . 1.0 110.336 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.611 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 28.5 mt-30 -51.85 -49.96 80.64 Favored Pre-proline 0 C--N 1.327 -0.409 0 C-N-CA 120.368 -0.533 . . . . 1.0 111.04 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 19.6 Cg_endo -57.88 -33.55 97.18 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 121.52 1.48 . . . . 1.0 112.414 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -95.39 -51.48 4.56 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 111.131 -178.09 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LEU . . . . . 0.417 ' N ' ' O ' ' A' ' 26' ' ' LEU . 11.1 mt -121.32 129.94 53.37 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.032 -0.531 . . . . 1.0 111.327 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -93.7 -9.23 38.46 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.177 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.456 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 62.3 ttp180 -179.1 119.29 0.07 Allowed 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 108.637 -0.875 . . . . 1.0 108.637 -179.089 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.6 t -100.95 113.41 26.37 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.739 0.304 . . . . 1.0 110.289 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 91.9 m-20 -105.5 -5.3 20.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.888 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.1 p -156.61 158.26 36.75 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.686 -0.406 . . . . 1.0 110.863 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.6 155.05 34.02 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.347 0.594 . . . . 1.0 112.036 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.7 mtt180 -136.47 122.45 20.15 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.207 -0.906 . . . . 1.0 108.838 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' VAL . . . . . 0.499 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.2 p -110.29 123.17 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.973 0.416 . . . . 1.0 110.016 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -77.19 -45.06 27.92 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.985 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.5 p -159.8 162.87 34.88 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.74 -0.837 . . . . 1.0 108.74 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 173.1 46.01 Favored Glycine 0 C--N 1.314 -0.671 0 N-CA-C 110.253 -1.139 . . . . 1.0 110.253 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.78 142.98 43.45 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.714 -0.847 . . . . 1.0 108.714 178.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' TRP . . . . . 0.626 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 56.4 m95 -130.88 155.56 46.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.455 0.645 . . . . 1.0 111.206 -178.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' MET . . . . . 0.64 ' C ' HD23 ' A' ' 45' ' ' LEU . 9.2 ttm -130.68 131.48 44.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.036 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.64 HD23 ' C ' ' A' ' 44' ' ' MET . 0.3 OUTLIER -107.97 137.45 45.94 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.114 -0.699 . . . . 1.0 109.114 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -113.68 132.18 55.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.178 0.513 . . . . 1.0 110.925 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.645 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.3 pt-20 -60.9 -35.67 77.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.643 -0.708 . . . . 1.0 111.237 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.77 151.66 42.46 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.445 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PRO . . . . . 0.448 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 42.1 Cg_endo -64.01 158.21 48.83 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.69 2.26 . . . . 1.0 113.533 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 63.82 36.24 10.56 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.091 -0.959 . . . . 1.0 111.626 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 52.5 72.67 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.995 -1.002 . . . . 1.0 110.852 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.1 p -142.41 159.64 41.83 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 116.004 -0.544 . . . . 1.0 109.679 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.6 -149.15 24.32 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.728 -0.749 . . . . 1.0 112.261 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LEU . . . . . 0.645 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.5 tp -77.8 140.95 39.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.807 -0.697 . . . . 1.0 110.244 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . 0.491 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 13.9 pt20 -120.53 149.31 42.62 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 117.803 0.274 . . . . 1.0 110.663 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -128.49 129.88 46.71 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.622 -0.263 . . . . 1.0 111.276 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' PHE . . . . . 0.496 ' H ' ' NE2' ' A' ' 143' ' ' GLN . 67.6 t80 -82.66 123.52 29.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.506 0.67 . . . . 1.0 110.597 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -110.08 134.5 52.09 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.809 -1.087 . . . . 1.0 108.5 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 60' ' ' ARG . 37.8 ttp180 -130.03 151.68 50.31 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ARG . . . . . 0.456 ' HA ' HG13 ' A' ' 38' ' ' VAL . 78.0 ttt-85 -34.66 125.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.167 -0.47 . . . . 1.0 111.769 -178.113 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLY . . . . . 0.499 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 152.48 -175.29 31.16 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.221 -1.152 . . . . 1.0 110.221 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 49.5 p-10 -117.32 131.29 56.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.182 0.515 . . . . 1.0 111.106 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -125.27 115.14 19.91 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.102 -0.703 . . . . 1.0 109.102 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . 0.439 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -95.51 -5.06 43.72 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.764 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 90.6 m-20 -145.76 136.04 23.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.674 -0.861 . . . . 1.0 108.674 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' HIS . . . . . 0.446 ' C ' ' H ' ' A' ' 68' ' ' GLN . 20.6 p-80 -56.06 -42.64 76.95 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.074 -0.65 . . . . 1.0 110.918 -178.817 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -50.17 -8.89 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.566 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -85.05 -34.06 22.36 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.336 -0.546 . . . . 1.0 110.983 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' TRP . . . . . 0.425 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -91.91 20.5 5.66 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.32 -0.552 . . . . 1.0 110.873 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' MET . . . . . 0.425 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 43.0 mtt 81.22 12.25 0.76 Allowed 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 123.772 0.67 . . . . 1.0 109.665 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -55.67 97.02 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.962 -0.855 . . . . 1.0 110.962 179.174 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 26.2 mt -69.88 -36.23 75.29 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.22 -0.659 . . . . 1.0 109.22 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.489 ' C ' ' H ' ' A' ' 75' ' ' SER . 46.6 t -130.33 128.46 41.53 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.017 178.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -69.15 40.68 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.221 -0.445 . . . . 1.0 111.21 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.489 ' H ' ' C ' ' A' ' 73' ' ' SER . 66.2 m -115.2 123.31 48.55 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.154 -0.684 . . . . 1.0 109.154 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 61.8 t -152.43 104.61 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.435 -0.58 . . . . 1.0 109.435 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.448 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.3 mtm-85 -114.73 6.68 15.67 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.685 0.254 . . . . 1.0 111.685 -179.09 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -164.44 163.42 22.24 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.153 -0.619 . . . . 1.0 111.127 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 28.1 p -158.4 149.11 20.39 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.709 -0.678 . . . . 1.0 111.037 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -128.2 150.52 49.98 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.742 0.306 . . . . 1.0 110.208 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LEU . . . . . 0.717 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -101.2 124.76 47.41 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.339 -0.986 . . . . 1.0 108.339 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ILE . . . . . 0.717 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.2 mt -86.03 114.33 56.56 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 116.1 -0.5 . . . . 1.0 110.577 -178.246 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -51.89 150.1 18.67 Favored 'Trans proline' 0 N--CA 1.498 1.772 0 C-N-CA 121.844 1.696 . . . . 1.0 112.274 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -50.44 157.08 0.76 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.849 -0.614 . . . . 1.0 109.545 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.19 -61.76 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.105 0.409 . . . . 1.0 112.105 -179.053 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLY . . . . . 0.546 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . 74.64 -96.47 0.94 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 109.176 -1.57 . . . . 1.0 109.176 -178.264 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.8 m -83.85 140.76 31.8 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.379 -0.601 . . . . 1.0 109.379 177.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.572 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 1.9 m170 -129.69 107.69 9.62 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.068 0.395 . . . . 1.0 112.068 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ARG . . . . . 0.412 HH21 ' HG ' ' A' ' 127' ' ' LEU . 57.3 ttp180 -138.21 127.61 24.69 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.468 -0.567 . . . . 1.0 109.468 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' ILE . . . . . 0.514 HG22 ' CH2' ' A' ' 131' ' ' TRP . 18.3 tt -145.85 145.11 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-O 120.758 0.313 . . . . 1.0 111.286 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 91' ' ' ARG . . . . . 0.667 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.2 mtp180 -122.69 98.69 6.03 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.773 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.27 139.06 36.83 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.522 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' TYR . . . . . 0.441 ' CE1' ' CB ' ' A' ' 98' ' ' TYR . 78.7 m-85 -115.0 134.05 55.52 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.121 -0.491 . . . . 1.0 111.141 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' GLU . . . . . 0.567 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 20.1 pt-20 -54.33 -41.3 68.88 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.496 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ARG . . . . . 0.49 ' O ' ' OG ' ' A' ' 123' ' ' SER . 9.9 mtt-85 -121.88 168.24 12.1 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.011 -0.541 . . . . 1.0 110.846 -178.063 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -45.75 154.56 0.21 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.448 0.642 . . . . 1.0 111.034 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.9 -96.83 0.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.984 -1.007 . . . . 1.0 109.432 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' TYR . . . . . 0.441 ' CB ' ' CE1' ' A' ' 93' ' ' TYR . 4.9 p90 -172.11 31.48 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 119.854 -0.739 . . . . 1.0 109.471 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 -83.41 39.02 0.64 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.158 -0.928 . . . . 1.0 112.173 -177.022 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -166.97 -161.16 15.45 Favored Glycine 0 CA--C 1.527 0.808 0 CA-C-N 115.585 -0.734 . . . . 1.0 111.403 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLN . . . . . 0.567 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 67.4 tp60 -65.01 146.78 54.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.071 0.463 . . . . 1.0 110.987 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 102' ' ' MET . . . . . 0.667 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 10.8 ttp -129.92 152.53 49.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.49 -0.777 . . . . 1.0 110.439 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ILE . . . . . 0.465 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.7 tt -145.01 137.54 21.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 108.459 -0.941 . . . . 1.0 108.459 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 78.0 tt0 -111.78 141.75 45.0 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.449 0.642 . . . . 1.0 110.737 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' PHE . . . . . 0.619 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 92.2 m-85 -127.44 148.88 50.3 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 114.868 -1.06 . . . . 1.0 110.533 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.6 p -139.81 16.67 2.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.704 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.0 OUTLIER -149.41 -174.95 4.81 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.526 -0.47 . . . . 1.0 110.293 178.961 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 108' ' ' ASP . 52.0 p-10 -74.33 141.49 45.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.335 -0.393 . . . . 1.0 111.165 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.07 116.52 16.44 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.324 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 110' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' A' ' 166' ' ' SER . 83.5 p -90.97 -21.64 21.21 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.921 0.391 . . . . 1.0 110.911 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 38.5 m -146.4 94.54 2.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.406 0.622 . . . . 1.0 109.867 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' LEU . . . . . 0.619 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -60.59 -39.54 88.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.821 -1.081 . . . . 1.0 110.673 -178.467 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 113' ' ' GLN . . . . . 0.614 ' CD ' ' H ' ' A' ' 113' ' ' GLN . 3.3 mp0 -49.09 -12.75 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.736 0.643 . . . . 1.0 112.736 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 114' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' A' ' 114' ' ' ASP . 61.6 t0 -88.87 -10.42 48.03 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.909 -0.774 . . . . 1.0 108.909 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -118.85 -39.52 2.95 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 114.22 1.193 . . . . 1.0 114.22 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 116' ' ' PHE . . . . . 0.623 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.08 135.2 53.4 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 122.523 1.154 . . . . 1.0 112.467 -178.898 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.13 -68.27 0.37 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.111 -0.949 . . . . 1.0 111.022 -177.788 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.59 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 65.9 m-85 -42.91 141.62 1.07 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.406 -0.816 . . . . 1.0 109.61 -179.788 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -101.15 5.7 42.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.928 0.394 . . . . 1.0 110.269 -179.353 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -134.46 139.13 45.29 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.461 0.648 . . . . 1.0 111.344 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 121' ' ' ILE . . . . . 0.715 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 45.9 mm -119.5 123.39 71.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.853 -1.067 . . . . 1.0 108.895 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -115.08 15.72 17.11 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 111.9 0.333 . . . . 1.0 111.9 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 123' ' ' SER . . . . . 0.49 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 5.7 p 176.93 149.97 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.212 -0.662 . . . . 1.0 109.212 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 124' ' ' LEU . . . . . 0.46 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.1 pp -159.97 156.54 27.3 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.569 -0.742 . . . . 1.0 109.856 -178.16 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 5.1 t-20 -124.21 109.31 13.25 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.194 -179.582 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 126' ' ' VAL . . . . . 0.43 HG22 HD12 ' A' ' 90' ' ' ILE . 4.1 t -96.4 103.95 15.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 109.171 -0.677 . . . . 1.0 109.171 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 127' ' ' LEU . . . . . 0.826 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -74.03 -36.87 64.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.562 179.578 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 128' ' ' GLU . . . . . 0.409 ' O ' ' O ' ' A' ' 129' ' ' GLY . 21.4 pt-20 -151.55 168.58 24.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.734 -0.666 . . . . 1.0 111.007 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 129' ' ' GLY . . . . . 0.409 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 54.41 167.79 0.03 OUTLIER Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.746 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 70.5 m -113.99 145.06 42.08 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.15 -0.685 . . . . 1.0 109.15 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 131' ' ' TRP . . . . . 0.514 ' CH2' HG22 ' A' ' 90' ' ' ILE . 30.3 m95 -120.52 162.24 19.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.474 -0.785 . . . . 1.0 110.64 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 16.3 t -137.03 93.04 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.749 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 133' ' ' LEU . . . . . 0.447 ' CD1' HD11 ' A' ' 146' ' ' LEU . 26.5 mt -66.09 146.15 55.0 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.21 -178.136 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 134' ' ' TYR . . . . . 0.583 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 60.1 m-85 -121.54 136.43 54.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.793 0.33 . . . . 1.0 111.071 178.779 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -48.39 -40.69 26.59 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.33 -0.395 . . . . 1.0 111.037 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 136' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -133.13 176.57 8.39 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.273 0.559 . . . . 1.0 111.069 -179.46 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.8 p -80.62 169.7 17.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.488 -0.778 . . . . 1.0 111.628 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 42.9 t30 64.98 15.51 10.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.888 -1.051 . . . . 1.0 110.614 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 42.26 79.32 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 1.0 112.536 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 94.1 mtt-85 -147.39 35.45 0.88 Allowed 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.768 0.318 . . . . 1.0 110.934 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 141' ' ' GLY . . . . . 0.418 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -147.11 -142.52 3.71 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.559 -0.616 . . . . 1.0 111.559 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -77.1 167.1 22.37 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 110.119 -0.326 . . . . 1.0 110.119 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 143' ' ' GLN . . . . . 0.496 ' NE2' ' H ' ' A' ' 57' ' ' PHE . 1.8 pt20 -143.31 138.1 29.28 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.126 -178.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -128.99 123.05 31.39 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.065 0.393 . . . . 1.0 110.304 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 145' ' ' LEU . . . . . 0.591 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.7 OUTLIER -78.74 126.97 31.44 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.435 -0.802 . . . . 1.0 112.345 -178.795 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 146' ' ' LEU . . . . . 0.591 ' N ' HD23 ' A' ' 145' ' ' LEU . 40.0 mt -116.69 102.45 9.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.418 178.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 147' ' ' MET . . . . . 0.624 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -79.36 160.69 69.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 109.121 -0.696 . . . . 1.0 109.121 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -56.97 113.83 1.65 Allowed 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.888 1.726 . . . . 1.0 111.209 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.92 -153.91 15.95 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 110.539 -1.024 . . . . 1.0 110.539 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 150' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 53.6 p-10 -123.42 141.72 51.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.999 0.428 . . . . 1.0 110.614 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 151' ' ' TYR . . . . . 0.531 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.5 m-85 -133.17 129.32 37.65 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.952 -0.567 . . . . 1.0 109.837 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -118.27 -0.58 11.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.649 0.262 . . . . 1.0 110.331 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -157.42 158.58 36.12 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.279 0.561 . . . . 1.0 110.36 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -74.16 -22.48 59.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 1.0 112.651 -177.552 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 -68.32 -18.84 64.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.48 -179.275 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 156' ' ' ASP . . . . . 0.531 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 58.6 t0 -54.17 -47.82 71.58 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.976 -0.289 . . . . 1.0 110.691 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 157' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 24.3 p90 -92.44 21.17 5.51 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 178.206 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.1 74.32 0.31 Allowed Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.931 -0.868 . . . . 1.0 110.931 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 159' ' ' ALA . . . . . 0.643 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.45 153.66 33.74 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.922 0.868 . . . . 1.0 111.677 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -81.8 -17.24 48.25 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.749 -1.569 . . . . 1.0 110.141 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 1.5 t-20 -168.51 -171.38 1.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.821 -0.352 . . . . 1.0 110.351 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 162' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.58 -4.95 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 1.0 110.896 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.4 mtt-85 -50.93 116.15 1.85 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 120.631 0.253 . . . . 1.0 111.317 -178.201 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 164' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 162' ' ' ALA . 77.6 t -128.35 133.69 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.495 -0.557 . . . . 1.0 109.495 178.067 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -110.38 -28.41 4.07 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.017 -0.433 . . . . 1.0 112.017 -179.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 166' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 110' ' ' SER . 32.0 m -158.67 -168.56 2.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.731 0.3 . . . . 1.0 110.367 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.33 139.58 0.61 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.464 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 168' ' ' ARG . . . . . 0.583 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 8.8 ptp180 -129.68 154.2 47.38 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.675 -0.491 . . . . 1.0 109.675 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 169' ' ' ARG . . . . . 0.601 ' HD2' ' H ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -88.46 145.08 25.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.933 -0.766 . . . . 1.0 108.933 178.742 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 170' ' ' VAL . . . . . 0.501 ' C ' HD12 ' A' ' 171' ' ' ILE . 57.3 t -77.26 84.74 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.069 0.462 . . . . 1.0 110.862 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 171' ' ' ILE . . . . . 0.501 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.3 mp -112.08 131.04 64.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.739 -0.664 . . . . 1.0 109.577 179.493 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -65.75 -35.09 79.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.809 -0.632 . . . . 1.0 110.917 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -61.19 -79.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.804 0.335 . . . . 1.0 110.539 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.065 -0.969 . . . . 1.0 110.694 179.794 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.627 0 N-CA-C 110.507 -1.037 . . . . 1.0 110.507 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -167.66 107.63 0.57 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.008 -0.277 . . . . 1.0 110.604 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.456 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.23 168.83 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.229 0.538 . . . . 1.0 111.206 -179.128 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' CE1' ' A' ' 7' ' ' TYR . 33.0 m -126.24 121.18 31.97 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 107.806 -1.183 . . . . 1.0 107.806 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.1 mt -106.59 134.72 49.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.008 -0.996 . . . . 1.0 110.117 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.476 ' CE1' HG22 ' A' ' 5' ' ' THR . 72.8 m-85 -117.18 128.25 54.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.631 -0.713 . . . . 1.0 111.461 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -53.05 -31.87 43.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.701 -0.681 . . . . 1.0 110.301 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -115.97 160.41 20.3 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.246 0.546 . . . . 1.0 110.774 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -63.76 -173.78 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 1.0 111.047 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.89 26.69 0.48 Allowed Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.765 -0.934 . . . . 1.0 110.765 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 50.29 70.41 0.51 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.147 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -133.69 -159.63 0.98 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.915 0.388 . . . . 1.0 110.378 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.16 -150.77 0.97 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.754 -0.938 . . . . 1.0 110.754 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -68.44 145.56 53.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.738 0.304 . . . . 1.0 110.822 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -135.59 151.84 50.67 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 121.288 0.566 . . . . 1.0 110.457 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -146.24 141.38 27.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.252 -0.886 . . . . 1.0 109.995 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 73.4 tt0 -110.22 121.24 44.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.317 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.57 127.05 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.973 0.416 . . . . 1.0 111.043 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 p -117.15 10.08 13.75 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.731 -0.668 . . . . 1.0 110.589 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.0 t -155.38 166.21 34.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.969 -0.56 . . . . 1.0 110.488 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -57.74 140.18 52.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.659 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.51 146.86 48.54 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.743 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.1 p -114.87 -14.98 11.89 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.787 -0.642 . . . . 1.0 112.17 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -150.87 111.08 4.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.216 0.532 . . . . 1.0 110.352 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 24.7 mt -111.43 0.96 16.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.304 -0.862 . . . . 1.0 110.278 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.607 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 20.4 mt-30 -51.65 -48.22 87.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.009 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 24.5 Cg_endo -57.22 -33.08 95.34 Favored 'Trans proline' 0 N--CA 1.491 1.37 0 C-N-CA 121.322 1.348 . . . . 1.0 112.239 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.17 -50.61 5.2 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.427 -0.509 . . . . 1.0 110.952 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.25 128.81 54.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.872 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.7 t -95.55 -8.2 35.77 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.842 -0.617 . . . . 1.0 111.631 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.6 mtm180 -145.0 -70.82 0.27 Allowed 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 112.427 0.528 . . . . 1.0 112.427 -177.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.5 t 76.69 71.68 0.07 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 122.757 0.423 . . . . 1.0 110.325 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -92.76 3.0 56.44 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.609 -0.269 . . . . 1.0 111.378 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.2 p -156.64 158.78 37.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.937 0.399 . . . . 1.0 110.181 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -156.25 153.84 29.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 1.0 111.495 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.5 mtp180 -131.94 122.45 25.63 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 108.771 -0.825 . . . . 1.0 108.771 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.69 110.83 33.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.254 0.55 . . . . 1.0 109.96 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -73.77 -43.5 58.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.296 -0.865 . . . . 1.0 110.851 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 95.7 p -160.83 160.34 30.99 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.761 -0.829 . . . . 1.0 108.761 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.05 168.29 42.8 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 111.158 -0.777 . . . . 1.0 111.158 179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 171' ' ' ILE . 64.7 m -110.28 124.55 51.85 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.919 -0.771 . . . . 1.0 108.919 178.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 57.0 m95 -115.28 152.42 32.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.613 0.721 . . . . 1.0 111.616 -178.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.518 ' C ' HD12 ' A' ' 45' ' ' LEU . 2.1 ttt -127.72 133.92 49.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.713 -1.131 . . . . 1.0 109.021 177.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.518 HD12 ' C ' ' A' ' 44' ' ' MET . 8.9 mp -109.96 134.83 51.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.882 -1.054 . . . . 1.0 110.092 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -111.49 133.45 53.77 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.343 0.592 . . . . 1.0 111.378 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.569 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.3 pt-20 -60.4 -37.11 79.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.306 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -105.37 153.8 39.44 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.123 -0.944 . . . . 1.0 111.256 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.93 152.51 80.25 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.776 2.318 . . . . 1.0 112.818 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.448 ' C ' ' CD1' ' A' ' 51' ' ' TYR . 3.3 m-80 60.71 32.54 20.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.237 -0.892 . . . . 1.0 110.955 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.448 ' CD1' ' C ' ' A' ' 50' ' ' ASN . 0.1 OUTLIER 46.6 65.07 1.29 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.171 -0.922 . . . . 1.0 109.65 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.7 m -123.2 17.44 9.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.435 -0.802 . . . . 1.0 111.798 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -142.05 -154.28 6.13 Favored Glycine 0 N--CA 1.46 0.289 0 C-N-CA 120.687 -0.768 . . . . 1.0 111.572 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.569 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.0 tp -63.48 152.44 38.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.338 -0.431 . . . . 1.0 109.88 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.422 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 9.7 pt20 -123.72 149.28 45.73 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.646 0.26 . . . . 1.0 111.298 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -125.99 122.9 37.22 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.16 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.411 ' C ' HD12 ' A' ' 58' ' ' LEU . 76.8 t80 -82.9 122.38 28.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.084 0.469 . . . . 1.0 110.139 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.411 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.6 mp -118.21 147.46 43.36 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.712 -0.676 . . . . 1.0 109.521 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' ' C ' ' A' ' 60' ' ' ARG . 5.3 ptm180 -136.39 161.82 34.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.723 -0.671 . . . . 1.0 109.897 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.404 ' C ' ' O ' ' A' ' 59' ' ' ARG . 62.3 ttp180 -38.49 124.73 1.32 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.766 0.317 . . . . 1.0 110.75 -178.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.6 -178.65 32.08 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.702 -0.959 . . . . 1.0 110.702 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -115.84 131.52 56.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.888 0.375 . . . . 1.0 110.491 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -125.09 113.4 17.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.419 -0.585 . . . . 1.0 109.419 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.48 -1.87 55.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.275 -0.421 . . . . 1.0 111.914 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -148.11 146.76 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.189 -1.041 . . . . 1.0 108.189 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.481 ' C ' ' H ' ' A' ' 68' ' ' GLN . 8.7 p-80 -66.13 -45.61 80.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.047 0.451 . . . . 1.0 111.296 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 98.9 mm-40 -49.5 -9.86 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.741 -0.663 . . . . 1.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.481 ' H ' ' C ' ' A' ' 66' ' ' HIS . 14.7 mm-40 -81.46 -37.38 28.09 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 120.481 -0.487 . . . . 1.0 111.007 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.453 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -87.89 18.82 3.88 Favored 'General case' 0 CA--C 1.509 -0.62 0 C-N-CA 120.323 -0.551 . . . . 1.0 111.244 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.55 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 63.8 mtp 80.52 19.16 0.54 Allowed 'General case' 0 CA--C 1.521 -0.138 0 O-C-N 123.929 0.768 . . . . 1.0 109.833 -178.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.519 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . . . . . . 0 C--N 1.339 0.697 0 N-CA-C 110.431 -1.067 . . . . 1.0 110.431 178.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 4.6 t . . . . . 0 N--CA 1.468 0.46 0 N-CA-C 108.491 -0.929 . . . . 1.0 108.491 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -117.76 7.89 12.59 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 121.015 -0.274 . . . . 1.0 110.978 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.6 p -162.49 162.82 27.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 1.0 110.543 178.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 14.2 p -156.27 147.57 22.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.486 -0.779 . . . . 1.0 110.426 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -126.93 151.44 48.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.912 0.386 . . . . 1.0 110.241 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 17.8 tp -97.45 126.86 42.97 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 177.725 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 28.7 mt -83.34 113.8 48.87 Favored Pre-proline 0 CA--C 1.538 0.5 0 C-N-CA 120.807 -0.357 . . . . 1.0 111.337 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo . . . . . 0 N--CA 1.491 1.371 0 C-N-CA 121.811 1.674 . . . . 1.0 111.581 179.141 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 CA--C 1.524 -0.044 0 N-CA-C 109.923 -0.399 . . . . 1.0 109.923 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.652 ' NE2' HD11 ' A' ' 171' ' ' ILE . 12.6 m80 -128.19 97.15 4.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 121.104 -0.238 . . . . 1.0 111.258 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -131.59 136.41 47.76 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 120.631 -0.428 . . . . 1.0 110.647 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.514 HG22 ' CZ2' ' A' ' 131' ' ' TRP . 18.4 tt -148.21 141.53 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-O 120.895 0.379 . . . . 1.0 111.486 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -119.28 98.06 5.97 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.838 -0.619 . . . . 1.0 111.511 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.9 139.82 40.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.203 0.525 . . . . 1.0 110.171 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.587 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 55.1 m-85 -119.84 137.44 53.99 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.984 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.527 ' OE2' ' CD1' ' A' ' 118' ' ' PHE . 1.8 tm-20 -56.32 -66.52 0.42 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.722 -0.672 . . . . 1.0 111.446 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.441 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.2 mtp85 -97.25 167.83 10.79 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.272 0.558 . . . . 1.0 111.715 -177.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 . . . . . 0 N--CA 1.461 0.113 0 CA-C-N 115.229 -0.896 . . . . 1.0 111.558 179.587 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.777 0 N-CA-C 110.891 -0.883 . . . . 1.0 110.891 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -62.97 144.12 57.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 1.0 110.81 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.587 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 6.3 ttp -131.67 148.08 52.56 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 116.345 -0.389 . . . . 1.0 111.013 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.52 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.4 tt -141.14 140.93 31.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.484 0 N-CA-C 109.464 -0.569 . . . . 1.0 109.464 177.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.68 137.73 50.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.639 0.733 . . . . 1.0 110.895 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.55 155.68 37.15 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.422 -1.263 . . . . 1.0 110.222 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 16.7 p -143.07 25.98 1.71 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.018 -0.537 . . . . 1.0 110.344 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -166.5 -166.86 0.91 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.842 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -76.09 141.99 41.85 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.111 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.9 m -130.6 92.56 3.27 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.079 -0.51 . . . . 1.0 109.998 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.51 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.3 m -68.48 -32.12 71.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.7 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -133.55 93.32 3.12 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.325 0.583 . . . . 1.0 110.479 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.485 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.7 tp -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.232 -0.895 . . . . 1.0 110.363 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -47.73 -9.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.697 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.485 ' H ' ' C ' ' A' ' 112' ' ' LEU . 92.5 m-20 -96.4 -25.31 15.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.035 0.445 . . . . 1.0 110.407 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -108.28 -39.96 5.31 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.662 -0.699 . . . . 1.0 111.704 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.52 ' CD1' HG21 ' A' ' 103' ' ' ILE . 3.6 t80 -124.81 122.07 36.39 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.629 -0.508 . . . . 1.0 109.629 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 78.2 mtt-85 -60.69 -56.07 25.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.641 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.527 ' CD1' ' OE2' ' A' ' 94' ' ' GLU . 95.2 m-85 -46.73 140.04 4.85 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.945 -0.571 . . . . 1.0 109.668 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -101.5 15.02 30.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.028 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.476 ' N ' ' OE1' ' A' ' 120' ' ' GLU . 3.4 pm0 -151.51 148.66 28.31 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.833 -179.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.627 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.1 mm -123.71 125.58 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 109.547 -0.538 . . . . 1.0 109.547 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.557 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 16.3 m-70 -108.89 20.81 18.03 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.078 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.487 ' H ' HG22 ' A' ' 121' ' ' ILE . 2.4 p 167.44 150.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.515 -0.55 . . . . 1.0 109.515 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.457 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.1 pp -161.27 156.79 24.57 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.709 -0.678 . . . . 1.0 110.285 -178.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.1 112.03 17.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.499 -0.556 . . . . 1.0 109.499 178.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.483 HG22 HD12 ' A' ' 90' ' ' ILE . 23.9 t -98.58 105.81 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.207 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.838 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.73 -45.0 22.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.957 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 29.5 tp10 -156.67 157.52 35.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.61 -0.436 . . . . 1.0 111.477 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.432 ' O ' ' O ' ' A' ' 130' ' ' SER . . . 64.2 78.72 0.19 Allowed Glycine 0 C--N 1.333 0.378 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.365 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.432 ' O ' ' O ' ' A' ' 129' ' ' GLY . 4.2 m -32.28 151.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.915 0.388 . . . . 1.0 111.599 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.514 ' CZ2' HG22 ' A' ' 90' ' ' ILE . 46.9 m95 -122.03 168.21 12.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.387 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.36 99.5 2.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.526 -0.306 . . . . 1.0 110.428 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.436 HD23 ' HB3' ' A' ' 167' ' ' LEU . 14.9 mt -74.77 141.35 44.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.612 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -120.45 134.66 55.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.366 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -48.81 -45.03 39.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.289 -0.414 . . . . 1.0 110.79 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.775 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -126.96 169.04 13.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.261 0.553 . . . . 1.0 110.478 -178.475 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 18.4 m -75.48 176.32 7.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.303 -0.862 . . . . 1.0 111.303 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 58.21 21.37 8.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.507 -1.224 . . . . 1.0 109.801 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 35.48 78.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.606 -0.724 . . . . 1.0 111.735 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.775 ' C ' HD11 ' A' ' 136' ' ' LEU . 63.2 ttt180 -149.01 45.6 1.0 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.0 0.429 . . . . 1.0 110.298 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.512 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -157.42 -137.51 2.31 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.764 -0.935 . . . . 1.0 110.764 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.449 HH12 ' CG2' ' A' ' 160' ' ' THR . 82.1 mtp180 -78.85 163.26 25.46 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.958 -0.297 . . . . 1.0 110.224 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.55 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.36 136.17 29.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.987 -0.551 . . . . 1.0 110.877 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -128.23 140.4 51.92 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.134 -0.691 . . . . 1.0 109.134 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.52 ' C ' HD22 ' A' ' 146' ' ' LEU . 39.0 tp -96.01 126.38 41.21 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.725 0.774 . . . . 1.0 111.425 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.828 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.1 mm? -112.68 99.5 7.98 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 114.39 -1.277 . . . . 1.0 109.733 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.516 ' SD ' HD21 ' A' ' 145' ' ' LEU . 2.0 mpp? -73.94 167.68 33.17 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -62.91 116.43 3.55 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 121.56 1.506 . . . . 1.0 111.163 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 178.08 -158.01 22.58 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 111.021 -0.832 . . . . 1.0 111.021 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -124.78 115.69 21.11 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.081 0.467 . . . . 1.0 110.537 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 37.1 m-85 -107.1 129.47 54.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 1.0 109.878 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -113.15 -4.53 13.78 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.709 0.29 . . . . 1.0 110.604 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -156.38 166.35 33.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.365 0.603 . . . . 1.0 110.337 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -78.09 -20.1 52.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.016 -0.993 . . . . 1.0 112.249 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -69.6 -20.02 63.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.786 0.327 . . . . 1.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -50.42 -47.73 56.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.993 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.599 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 24.5 p90 -97.65 22.22 9.32 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.091 0.472 . . . . 1.0 110.35 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.19 74.32 0.31 Allowed Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.599 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -121.28 149.1 43.41 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.292 0.568 . . . . 1.0 110.593 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . 0.449 ' CG2' HH12 ' A' ' 142' ' ' ARG . 11.6 t -77.37 -10.73 59.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.75 -1.114 . . . . 1.0 110.198 178.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.45 HD22 ' HG3' ' A' ' 163' ' ' ARG . 3.3 t30 -172.0 -165.49 0.36 Allowed 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.131 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.826 ' O ' HG23 ' A' ' 164' ' ' VAL . . . -111.7 -19.71 12.37 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.894 -0.593 . . . . 1.0 110.924 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.45 ' HG3' HD22 ' A' ' 161' ' ' ASN . 99.6 mtt180 -31.9 116.77 0.19 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.299 0.374 . . . . 1.0 111.881 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.826 HG23 ' O ' ' A' ' 162' ' ' ALA . 62.4 t -126.28 137.15 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-N 116.13 -0.486 . . . . 1.0 110.575 178.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -116.47 -34.57 1.29 Allowed Glycine 0 N--CA 1.465 0.581 0 N-CA-C 111.597 -0.601 . . . . 1.0 111.597 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.51 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -159.47 172.22 18.28 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 120.534 -0.466 . . . . 1.0 110.88 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.436 ' HB3' HD23 ' A' ' 133' ' ' LEU . 0.5 OUTLIER -157.32 142.48 17.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.539 -179.209 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -130.66 166.36 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.351 -0.981 . . . . 1.0 108.351 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -104.01 139.45 39.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.448 -0.796 . . . . 1.0 109.607 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.566 ' C ' HD12 ' A' ' 171' ' ' ILE . 19.0 t -81.48 121.22 34.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.849 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.652 HD11 ' NE2' ' A' ' 88' ' ' HIS . 1.6 mp . . . . . 0 N--CA 1.477 0.922 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.189 179.342 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.615 0 N-CA-C 110.459 -1.057 . . . . 1.0 110.459 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -172.81 103.31 0.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.124 -0.324 . . . . 1.0 110.124 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.38 166.78 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.089 0.471 . . . . 1.0 111.175 -178.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.452 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.5 m -124.62 121.19 34.03 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.86 -1.163 . . . . 1.0 107.86 177.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -106.19 133.72 50.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.874 -1.057 . . . . 1.0 110.244 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.452 ' CE1' HG22 ' A' ' 5' ' ' THR . 61.6 m-85 -115.97 125.94 53.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.351 -0.84 . . . . 1.0 111.219 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -53.75 -29.7 41.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.507 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -117.84 153.85 32.81 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.292 0.567 . . . . 1.0 110.675 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.422 ' C ' ' N ' ' A' ' 12' ' ' PHE . 16.3 ptt-85 -59.58 -176.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.827 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 46.1 22.53 0.9 Allowed Glycine 0 C--N 1.33 0.211 0 N-CA-C 110.552 -1.019 . . . . 1.0 110.552 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.537 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 10.6 m-85 54.14 67.85 0.94 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -129.92 -155.66 0.71 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.029 0.443 . . . . 1.0 110.468 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.14 -152.46 0.11 Allowed Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.984 -0.846 . . . . 1.0 110.984 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -68.98 146.53 52.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.787 0.327 . . . . 1.0 110.69 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -135.55 145.19 46.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.265 0.555 . . . . 1.0 110.444 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.4 t80 -140.26 142.26 35.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.31 -0.859 . . . . 1.0 110.213 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.545 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 41.1 tt0 -110.63 122.08 46.89 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.101 -0.499 . . . . 1.0 110.154 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.435 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -109.75 126.24 53.53 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.998 0.428 . . . . 1.0 110.67 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -117.32 13.96 14.65 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.624 -0.716 . . . . 1.0 110.357 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.9 m -157.91 167.87 28.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.582 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -58.67 140.13 55.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.577 -0.738 . . . . 1.0 111.549 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.435 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.16 145.31 45.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.868 -0.605 . . . . 1.0 110.821 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.2 p -112.64 -11.92 13.48 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.976 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -149.73 117.92 6.4 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.514 0.673 . . . . 1.0 110.172 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.8 mp -113.13 -2.44 14.15 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.096 -0.956 . . . . 1.0 110.246 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.629 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.4 OUTLIER -58.15 -41.77 91.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.301 -178.867 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.9 Cg_exo -58.79 -37.7 92.53 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.175 1.917 . . . . 1.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -97.22 -51.21 4.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.919 0.39 . . . . 1.0 111.327 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' A' ' 26' ' ' LEU . 6.9 mt -118.55 127.95 54.1 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.735 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -94.75 -8.39 37.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.937 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -147.5 -58.04 0.25 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.955 0.354 . . . . 1.0 111.955 -178.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t 63.08 74.83 0.42 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.755 0.312 . . . . 1.0 110.174 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.513 ' OD1' ' CE1' ' A' ' 66' ' ' HIS . 1.3 t30 -90.56 3.89 52.77 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.197 -0.456 . . . . 1.0 111.284 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.537 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -157.25 155.9 31.58 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 1.0 110.051 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 155.11 35.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 1.0 111.431 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -132.74 121.41 23.01 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 108.602 -0.888 . . . . 1.0 108.602 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.3 t -108.53 117.77 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 O-C-N 123.629 0.581 . . . . 1.0 109.905 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -78.84 -43.81 24.35 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.995 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.1 m -161.2 159.38 28.76 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.316 -0.624 . . . . 1.0 109.316 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.21 174.45 50.39 Favored Glycine 0 C--N 1.316 -0.55 0 N-CA-C 110.96 -0.856 . . . . 1.0 110.96 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 98.3 m -112.85 131.0 55.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.949 -0.76 . . . . 1.0 108.949 178.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.526 ' CE2' HD13 ' A' ' 81' ' ' LEU . 54.6 m95 -119.26 143.21 47.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.29 0.567 . . . . 1.0 111.438 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.544 ' C ' HD12 ' A' ' 45' ' ' LEU . 1.2 tpt -113.93 129.0 56.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.393 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.544 HD12 ' C ' ' A' ' 44' ' ' MET . 9.6 mp -108.15 127.57 53.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.995 -0.743 . . . . 1.0 108.995 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -106.85 133.41 51.55 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.687 0.756 . . . . 1.0 111.215 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.4 pt-20 -62.66 -36.7 83.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.828 -1.078 . . . . 1.0 110.296 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -106.59 151.68 40.49 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.244 -0.889 . . . . 1.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.1 154.14 74.91 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.575 2.183 . . . . 1.0 112.737 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.482 HD22 ' N ' ' A' ' 50' ' ' ASN . 1.4 m-80 59.47 34.8 22.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.967 -1.015 . . . . 1.0 110.721 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 23' ' ' HIS . 1.5 m-85 42.93 66.22 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.34 -0.846 . . . . 1.0 110.26 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.4 m -123.58 17.31 9.61 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.283 -0.871 . . . . 1.0 111.298 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.29 -155.12 6.37 Favored Glycine 0 N--CA 1.462 0.375 0 C-N-CA 120.693 -0.765 . . . . 1.0 111.553 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.58 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.4 tp -65.82 151.99 45.41 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.459 -0.371 . . . . 1.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -123.15 152.03 41.54 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.742 0.306 . . . . 1.0 111.624 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.402 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 27.1 m-85 -127.76 125.82 40.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.011 -0.541 . . . . 1.0 111.302 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -82.6 121.92 27.44 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.336 -0.393 . . . . 1.0 109.962 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.34 146.08 47.65 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.11 0.481 . . . . 1.0 110.311 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.467 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 42.5 mtp180 -134.69 160.42 38.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.494 -0.775 . . . . 1.0 110.283 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' A' ' 59' ' ' ARG . 9.7 ptm180 -34.02 127.32 0.42 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.829 -0.623 . . . . 1.0 111.272 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.63 -179.53 30.66 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.084 -0.807 . . . . 1.0 111.084 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.9 p-10 -116.36 125.19 51.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.161 0.505 . . . . 1.0 110.432 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -118.93 113.49 21.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.769 -0.651 . . . . 1.0 109.426 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.422 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.44 -3.31 53.35 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.669 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.422 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -148.36 141.63 25.13 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.628 -0.879 . . . . 1.0 108.628 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 34' ' ' ASN . 22.8 p-80 -62.52 -41.41 98.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.174 0.512 . . . . 1.0 110.689 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -51.98 -8.94 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.46 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -81.31 -34.93 31.6 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.116 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -92.78 15.65 14.15 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 120.813 -0.355 . . . . 1.0 110.515 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . . . . . . . . . 58.7 mtt 72.55 30.55 1.88 Allowed 'General case' 0 CA--C 1.514 -0.433 0 O-C-N 124.31 1.006 . . . . 1.0 109.633 -178.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.402 ' HA2' ' CE1' ' A' ' 56' ' ' TYR . . . . . . . . 0 CA--C 1.525 0.668 0 CA-C-O 118.786 -1.008 . . . . 1.0 112.834 -178.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 C--O 1.232 0.152 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -122.91 4.78 9.38 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.703 0.287 . . . . 1.0 110.723 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.7 t -166.12 163.42 18.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.199 0.523 . . . . 1.0 110.822 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -155.89 146.63 22.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.433 -0.803 . . . . 1.0 109.945 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.519 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 3.1 ptm180 -126.99 151.51 48.48 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.526 HD13 ' CE2' ' A' ' 43' ' ' TRP . 27.5 tp -100.05 135.22 41.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.457 -0.942 . . . . 1.0 108.457 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 81' ' ' LEU . 3.5 mt -96.7 111.32 56.94 Favored Pre-proline 0 CA--C 1.543 0.711 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 N--CA 1.5 1.9 0 C-N-CA 121.901 1.734 . . . . 1.0 113.295 -179.598 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . 0.405 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 3.8 m . . . . . 0 CA--C 1.521 -0.153 0 N-CA-C 109.744 -0.465 . . . . 1.0 109.744 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 m170 -128.06 104.17 7.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.835 -0.166 . . . . 1.0 111.379 -179.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -136.29 139.64 42.8 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.191 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.404 HD12 HG22 ' A' ' 126' ' ' VAL . 19.5 tt -149.6 141.81 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.735 0.302 . . . . 1.0 111.389 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -119.05 98.39 6.15 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.922 -0.581 . . . . 1.0 112.237 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.45 HD11 HD22 ' A' ' 167' ' ' LEU . 22.1 mt -79.88 142.91 34.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.538 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 25.2 m-85 -125.41 137.68 54.01 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.822 -0.626 . . . . 1.0 111.923 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.505 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 2.3 tm-20 -56.08 -58.14 9.18 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.791 -0.64 . . . . 1.0 111.584 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -107.36 172.34 6.88 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.173 0.511 . . . . 1.0 111.128 -178.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 . . . . . 0 C--N 1.327 -0.397 0 CA-C-N 115.432 -0.804 . . . . 1.0 110.735 179.377 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.709 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -69.04 141.55 54.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.006 0.431 . . . . 1.0 110.872 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.515 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 154.36 48.22 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.661 -0.7 . . . . 1.0 111.058 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.6 tt -145.77 139.42 21.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 N-CA-C 109.33 -0.619 . . . . 1.0 109.33 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -113.39 144.73 42.29 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.681 0.753 . . . . 1.0 111.141 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.785 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 85.2 m-85 -130.61 156.3 45.1 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 114.692 -1.14 . . . . 1.0 110.934 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.0 p -143.66 31.57 1.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.477 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -170.85 -169.08 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.628 -0.429 . . . . 1.0 110.796 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 55.2 p-10 -82.68 149.29 27.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.353 179.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.63 101.1 4.38 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.334 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.444 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.1 p -69.14 -19.47 64.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.635 -0.426 . . . . 1.0 111.072 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 33.7 t -149.83 91.07 1.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.155 0.502 . . . . 1.0 109.989 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.785 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 13.6 tp -58.97 -39.68 82.47 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.32 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.654 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 14.4 mp0 -42.75 -14.01 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.971 0.36 . . . . 1.0 111.971 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.519 ' N ' ' O ' ' A' ' 112' ' ' LEU . 55.3 t0 -93.1 0.45 57.26 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.582 0.706 . . . . 1.0 110.401 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 112' ' ' LEU . 36.8 mmt180 -132.16 -39.13 1.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 1.0 113.266 -177.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.684 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.91 134.7 55.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 122.19 0.995 . . . . 1.0 110.96 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 118' ' ' PHE . 38.1 mmt180 -71.47 -69.97 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.064 -1.022 . . . . 1.0 110.433 -177.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.625 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -37.29 146.84 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.968 -0.56 . . . . 1.0 110.347 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 p-10 -105.24 11.19 33.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.767 0.318 . . . . 1.0 110.962 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -140.49 141.38 35.37 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.267 0.556 . . . . 1.0 111.173 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.651 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 39.1 mm -121.09 126.91 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-N 115.251 -0.886 . . . . 1.0 109.498 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.453 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.0 m-70 -118.56 26.74 9.37 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.141 -0.481 . . . . 1.0 111.69 -178.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' C ' ' A' ' 152' ' ' ARG . 3.8 m 165.21 151.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.449 . . . . 1.0 110.276 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.446 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.4 pp -163.79 158.12 19.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.681 -0.69 . . . . 1.0 110.78 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.14 117.97 26.59 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.505 -0.554 . . . . 1.0 109.505 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.404 HG22 HD12 ' A' ' 90' ' ' ILE . 23.2 t -101.92 105.01 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-N 116.235 -0.438 . . . . 1.0 110.109 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.874 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.83 -44.2 28.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.82 -0.627 . . . . 1.0 111.177 179.39 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.405 ' CG ' ' O ' ' A' ' 87' ' ' SER . 33.0 tp10 -157.72 150.25 22.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 120.695 -0.402 . . . . 1.0 111.277 -178.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.554 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.6 79.7 0.29 Allowed Glycine 0 C--O 1.229 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.0 112.322 177.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.424 ' O ' ' O ' ' A' ' 129' ' ' GLY . 45.3 t -31.6 148.38 0.01 OUTLIER 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.345 0.593 . . . . 1.0 111.242 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.554 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 41.7 m95 -124.3 163.07 22.44 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.096 -0.956 . . . . 1.0 111.289 -177.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.9 t -132.46 138.34 52.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 N-CA-C 108.754 -0.832 . . . . 1.0 108.754 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.502 ' HG ' HD11 ' A' ' 146' ' ' LEU . 43.4 mt -110.39 141.74 43.04 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.679 -0.489 . . . . 1.0 109.679 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -117.74 135.3 54.13 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.209 0.318 . . . . 1.0 110.896 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -48.35 -42.08 30.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.769 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -131.33 167.27 19.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.208 0.528 . . . . 1.0 110.181 -178.684 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.4 m -72.94 175.22 6.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.858 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 62.0 16.69 8.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.856 -1.065 . . . . 1.0 109.796 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 39.24 77.86 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.533 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.769 ' C ' HD11 ' A' ' 136' ' ' LEU . 73.5 mtp180 -146.57 41.18 1.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.723 0.297 . . . . 1.0 110.48 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.475 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -153.5 -142.8 3.54 Favored Glycine 0 N--CA 1.463 0.485 0 N-CA-C 111.31 -0.716 . . . . 1.0 111.31 -178.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -73.5 166.76 22.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 120.786 -0.366 . . . . 1.0 110.154 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -146.27 136.44 23.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.009 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -128.1 130.3 47.95 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 109.557 -0.535 . . . . 1.0 109.557 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 45.4 tp -85.51 126.95 34.25 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.342 0.591 . . . . 1.0 111.219 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.502 HD11 ' HG ' ' A' ' 133' ' ' LEU . 25.6 mt -114.75 106.5 14.28 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.156 -0.929 . . . . 1.0 109.819 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.59 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.7 160.81 65.97 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.291 -179.669 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.75 112.62 1.26 Allowed 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.302 2.001 . . . . 1.0 110.868 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.99 -152.55 12.35 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 110.538 -1.025 . . . . 1.0 110.538 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 49.0 p-10 -125.94 134.72 51.44 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.09 0.472 . . . . 1.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -124.83 124.62 42.48 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.924 -0.58 . . . . 1.0 109.638 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . 0.53 ' C ' ' OG ' ' A' ' 123' ' ' SER . 95.2 mtt-85 -112.97 1.8 15.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.626 0.25 . . . . 1.0 110.369 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.689 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.9 ptm180 -160.83 162.61 32.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.556 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.528 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -75.76 -24.06 56.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.138 -0.937 . . . . 1.0 112.314 -178.233 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.689 ' NE2' HH21 ' A' ' 153' ' ' ARG . 1.1 mt-30 -63.89 -20.18 65.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.282 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . 0.479 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 52.6 t0 -51.22 -49.31 61.32 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.365 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.726 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 26.1 p90 -96.58 19.05 12.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.026 0.441 . . . . 1.0 110.505 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.07 73.95 0.34 Allowed Glycine 0 CA--C 1.52 0.389 0 N-CA-C 111.227 -0.749 . . . . 1.0 111.227 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.726 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -116.45 141.92 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 1.0 111.337 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . 0.457 HG23 ' N ' ' A' ' 161' ' ' ASN . 15.0 t -66.79 -38.68 87.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.5 -1.227 . . . . 1.0 110.238 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.457 ' N ' HG23 ' A' ' 160' ' ' THR . 21.9 m120 -145.21 -172.51 3.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.019 0.438 . . . . 1.0 110.265 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.651 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.83 -2.06 18.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.822 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -53.99 118.13 3.76 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.001 0.429 . . . . 1.0 111.239 -178.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.87 131.23 72.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.463 -0.79 . . . . 1.0 109.49 178.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.31 -28.57 4.3 Favored Glycine 0 N--CA 1.465 0.605 0 N-CA-C 111.659 -0.576 . . . . 1.0 111.659 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 110' ' ' SER . 7.9 m -159.47 -172.3 3.66 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.938 -0.393 . . . . 1.0 109.938 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.659 HD21 HD13 ' A' ' 112' ' ' LEU . 2.3 pp -173.57 145.06 1.17 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.433 -0.507 . . . . 1.0 111.56 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.467 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 6.2 ptm180 -133.84 164.76 26.54 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.067 0.46 . . . . 1.0 110.285 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.443 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -98.33 147.03 25.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.581 -0.896 . . . . 1.0 108.581 178.45 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.782 ' C ' HD12 ' A' ' 171' ' ' ILE . 61.2 t -79.55 84.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.157 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.782 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.8 mp . . . . . 0 N--CA 1.465 0.291 0 N-CA-C 109.66 -0.496 . . . . 1.0 109.66 179.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.529 0 N-CA-C 110.523 -1.031 . . . . 1.0 110.523 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -171.88 106.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.996 -0.282 . . . . 1.0 110.724 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.73 170.36 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 121.129 0.49 . . . . 1.0 111.059 -178.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.5 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.6 m -127.41 120.41 28.38 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.226 -1.027 . . . . 1.0 108.226 177.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.4 mt -105.87 133.43 50.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.938 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.5 ' CE1' HG22 ' A' ' 5' ' ' THR . 58.2 m-85 -114.83 129.39 56.69 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.505 -0.771 . . . . 1.0 111.026 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.535 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.5 tt0 -56.03 -23.16 31.45 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.308 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -123.73 155.22 38.25 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.045 0.45 . . . . 1.0 110.465 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.84 -174.48 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.558 -0.746 . . . . 1.0 110.501 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.46 28.64 0.61 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 110.964 -0.855 . . . . 1.0 110.964 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.546 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 6.1 m-85 49.71 67.24 0.93 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.921 -0.4 . . . . 1.0 109.921 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -128.15 -160.83 1.05 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.953 0.406 . . . . 1.0 110.58 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.92 -151.74 0.73 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.535 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.1 mtm180 -69.3 148.95 49.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.705 0.288 . . . . 1.0 110.782 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.5 p-80 -135.42 145.71 47.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.308 0.575 . . . . 1.0 110.284 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.9 t80 -140.89 141.95 34.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.127 -0.942 . . . . 1.0 109.809 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.558 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 66.7 tt0 -110.53 120.89 43.88 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.124 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -107.92 126.52 52.78 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.033 0.444 . . . . 1.0 110.747 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -117.58 12.23 14.01 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.55 -0.75 . . . . 1.0 110.385 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 35.5 p -156.94 167.09 31.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.191 0.52 . . . . 1.0 110.425 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.441 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 53.8 p-10 -58.1 142.56 46.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.555 -0.748 . . . . 1.0 111.684 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.75 147.17 44.48 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.904 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -115.45 -16.29 11.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.614 -0.721 . . . . 1.0 111.908 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -150.18 109.96 4.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 1.0 109.989 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 20.9 mt -108.43 2.36 22.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.388 -0.823 . . . . 1.0 110.41 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.615 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 10.3 mt-30 -56.89 -41.06 89.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.141 -0.482 . . . . 1.0 110.698 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.3 Cg_exo -59.34 -36.47 94.3 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.058 1.838 . . . . 1.0 111.999 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -94.21 -47.51 6.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.843 0.354 . . . . 1.0 111.24 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -120.09 127.79 52.86 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.338 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -91.26 -6.8 52.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.854 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.64 ' NE ' HD21 ' A' ' 34' ' ' ASN . 3.4 mmm-85 177.59 120.58 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t -102.09 111.35 23.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 1.0 110.498 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.64 HD21 ' NE ' ' A' ' 32' ' ' ARG . 19.2 m120 -106.01 -3.72 21.34 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.247 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.546 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 3.8 t -157.11 155.64 31.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.801 0.334 . . . . 1.0 110.371 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.04 155.25 36.52 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.205 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -132.7 122.04 24.01 Favored 'General case' 0 C--O 1.217 -0.641 0 N-CA-C 108.794 -0.817 . . . . 1.0 108.794 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.67 116.32 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.29 0.567 . . . . 1.0 109.799 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.29 -43.97 31.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.335 -0.848 . . . . 1.0 110.979 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.4 t -161.89 152.79 17.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 109.226 -0.657 . . . . 1.0 109.226 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.82 176.38 49.33 Favored Glycine 0 C--N 1.317 -0.501 0 N-CA-C 111.07 -0.812 . . . . 1.0 111.07 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.1 m -113.02 139.68 48.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 178.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.446 ' CE2' HD13 ' A' ' 81' ' ' LEU . 55.3 m95 -128.18 138.88 52.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.225 0.536 . . . . 1.0 111.268 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.536 ' C ' HD12 ' A' ' 45' ' ' LEU . 1.0 OUTLIER -107.43 127.19 53.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.357 -0.838 . . . . 1.0 109.282 178.501 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.536 HD12 ' C ' ' A' ' 44' ' ' MET . 10.2 mp -108.65 129.84 55.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.536 -0.756 . . . . 1.0 109.297 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -112.23 131.65 55.37 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.631 0.729 . . . . 1.0 111.094 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.642 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.9 pt-20 -58.88 -35.42 72.96 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.067 -0.97 . . . . 1.0 111.072 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -108.57 154.22 41.72 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.689 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -66.05 159.12 50.9 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.843 2.362 . . . . 1.0 112.866 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.629 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.8 OUTLIER 62.94 43.3 6.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.917 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 44.2 72.74 0.18 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.836 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.0 m -141.2 157.77 44.8 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.743 -0.466 . . . . 1.0 109.743 -178.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.36 -146.84 21.16 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.78 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.642 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.7 tp -79.72 144.02 34.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.971 -0.614 . . . . 1.0 110.282 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -120.73 150.7 40.57 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.45 0.167 . . . . 1.0 110.872 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -126.73 126.26 43.18 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-O 120.83 0.348 . . . . 1.0 111.318 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -82.94 122.74 28.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.955 -0.566 . . . . 1.0 109.495 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.6 mp -121.19 146.21 47.02 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.066 -0.516 . . . . 1.0 110.189 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.55 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 36.9 mtp180 -134.09 159.19 41.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.277 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.6 ptm180 -35.09 125.67 0.57 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.804 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 -178.64 32.92 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.683 -0.967 . . . . 1.0 110.683 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 42.2 p-10 -116.4 126.99 54.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.02 0.438 . . . . 1.0 110.608 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -121.43 113.94 20.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.815 -0.63 . . . . 1.0 109.43 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.5 -2.83 53.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.637 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -147.95 140.77 24.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.835 -0.802 . . . . 1.0 108.835 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.474 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.8 p-80 -62.13 -42.03 98.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.06 0.457 . . . . 1.0 110.799 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -52.16 -8.63 0.08 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.606 -0.725 . . . . 1.0 110.665 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.474 ' H ' ' C ' ' A' ' 66' ' ' HIS . 16.9 mm-40 -83.58 -36.06 24.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.552 -0.459 . . . . 1.0 111.363 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.458 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.85 15.93 10.35 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.709 -0.396 . . . . 1.0 111.265 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.495 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 44.3 mtt 84.0 14.22 0.3 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 124.175 0.922 . . . . 1.0 109.574 -178.254 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.711 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.188 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.471 0.606 0 CA-C-O 120.782 0.325 . . . . 1.0 110.785 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -104.45 4.95 33.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.648 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 p -163.17 162.56 25.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.263 0.554 . . . . 1.0 110.61 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.0 p -157.46 148.45 21.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 1.0 110.058 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.599 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 4.3 ptm180 -127.93 149.86 50.14 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.75 0.31 . . . . 1.0 110.397 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.446 HD13 ' CE2' ' A' ' 43' ' ' TRP . 20.9 tp -99.08 129.11 45.33 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.253 -1.017 . . . . 1.0 108.253 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.416 ' N ' HD12 ' A' ' 81' ' ' LEU . 4.5 mt -90.89 114.17 60.52 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 109.893 -0.41 . . . . 1.0 109.893 -179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo . . . . . 0 N--CA 1.5 1.911 0 C-N-CA 121.97 1.78 . . . . 1.0 113.215 -179.975 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m . . . . . 0 C--O 1.231 0.122 0 N-CA-C 109.664 -0.495 . . . . 1.0 109.664 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -129.78 119.26 23.12 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.706 -0.225 . . . . 1.0 110.96 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -147.86 133.78 19.13 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.522 HD12 HG22 ' A' ' 126' ' ' VAL . 17.6 tt -147.51 146.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.962 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -125.71 103.69 7.96 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 123.389 0.43 . . . . 1.0 111.511 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.21 149.1 25.33 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.157 0.503 . . . . 1.0 111.839 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -125.44 138.92 54.02 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.823 -0.626 . . . . 1.0 112.396 -179.123 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.469 ' N ' ' CD ' ' A' ' 94' ' ' GLU . 1.2 mm-40 -57.19 -55.25 37.22 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.803 -0.635 . . . . 1.0 111.2 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.424 ' O ' ' OG ' ' A' ' 123' ' ' SER . 75.7 mtp180 -109.68 173.24 6.42 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.238 -178.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 . . . . . 0 C--N 1.332 -0.188 0 CA-C-N 115.61 -0.723 . . . . 1.0 111.27 179.657 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.603 0 N-CA-C 110.874 -0.891 . . . . 1.0 110.874 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.525 ' NE2' ' H ' ' A' ' 102' ' ' MET . 53.9 tp60 -56.34 156.43 5.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.231 0.538 . . . . 1.0 110.617 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.525 ' H ' ' NE2' ' A' ' 101' ' ' GLN . 0.4 OUTLIER -127.4 146.06 50.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.954 -0.566 . . . . 1.0 110.651 -179.752 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.6 tt -141.8 140.49 30.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -114.31 143.6 44.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.573 0.701 . . . . 1.0 110.949 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.753 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 86.1 m-85 -130.37 154.38 47.75 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 114.781 -1.1 . . . . 1.0 110.739 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.61 11.23 1.65 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 1.0 111.151 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.964 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.5 pt-20 -160.79 79.11 0.62 Allowed 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 119.221 -0.419 . . . . 1.0 109.918 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.964 ' O ' ' O ' ' A' ' 107' ' ' GLU . 55.5 p30 18.77 167.96 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 122.434 1.112 . . . . 1.0 113.634 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 10.5 t -148.0 109.7 4.45 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 120.737 -1.227 . . . . 1.0 110.505 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.437 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.53 -18.58 64.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.309 -0.405 . . . . 1.0 110.9 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.423 ' SG ' ' O ' ' A' ' 110' ' ' SER . 85.1 m -151.84 88.7 1.42 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 1.0 109.819 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.753 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 11.9 tp -61.01 -41.49 96.64 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.163 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.571 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 24.3 mp0 -43.16 -10.29 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.285 -0.416 . . . . 1.0 112.113 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.564 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.7 t0 -95.13 -22.83 17.61 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 1.0 110.434 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.511 ' N ' ' O ' ' A' ' 112' ' ' LEU . 34.5 mmt180 -107.06 -38.67 5.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.136 0.791 . . . . 1.0 113.136 -178.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.66 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -119.11 138.58 52.8 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 122.035 0.922 . . . . 1.0 110.811 -179.828 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 118' ' ' PHE . 32.1 mmt180 -72.21 -73.67 0.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.11 -0.994 . . . . 1.0 110.447 -177.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.616 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 98.1 m-85 -33.23 143.22 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.485 0 O-C-N 123.588 0.555 . . . . 1.0 110.515 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -103.07 6.49 38.66 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.079 0.466 . . . . 1.0 110.853 -178.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -137.68 141.59 41.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.753 -0.658 . . . . 1.0 111.017 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 41.8 mm -121.19 116.94 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.258 -0.883 . . . . 1.0 109.582 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.438 ' O ' ' CB ' ' A' ' 123' ' ' SER . 37.7 m-70 -109.44 29.97 7.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.581 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.8 p 163.33 149.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.095 0.474 . . . . 1.0 110.078 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.9 pp -163.3 157.52 20.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.338 -178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.91 119.62 29.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.792 0.33 . . . . 1.0 110.161 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.522 HG22 HD12 ' A' ' 90' ' ' ILE . 44.3 t -103.17 104.01 15.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.918 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -77.91 -40.76 38.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.658 -0.701 . . . . 1.0 111.331 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -137.21 146.37 44.77 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.102 0.477 . . . . 1.0 111.26 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.55 -171.39 2.36 Favored Glycine 0 CA--C 1.519 0.327 0 N-CA-C 111.177 -0.769 . . . . 1.0 111.177 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.3 m -119.37 157.12 28.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.318 0.58 . . . . 1.0 109.877 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -129.98 162.27 29.05 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.452 -0.795 . . . . 1.0 110.753 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 47.0 t -132.32 138.34 52.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 N-CA-C 109.181 -0.674 . . . . 1.0 109.181 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.5 ' HG ' HD11 ' A' ' 146' ' ' LEU . 39.3 mt -110.75 143.18 41.66 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.793 -0.447 . . . . 1.0 109.793 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -117.97 133.35 56.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.756 0.312 . . . . 1.0 110.904 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 -47.41 -30.38 3.28 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.943 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.5 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -140.27 177.13 8.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 1.0 110.493 -179.677 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . 0.464 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -83.37 172.29 12.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.637 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . 0.464 ' N ' ' OG ' ' A' ' 137' ' ' SER . 6.2 m120 64.24 19.21 11.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.17 -0.923 . . . . 1.0 110.078 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 35.59 78.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.706 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.404 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 65.2 ttt180 -147.38 36.79 0.91 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.185 0.516 . . . . 1.0 110.388 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.459 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -149.25 -141.77 3.49 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 111.163 -0.775 . . . . 1.0 111.163 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.25 164.89 25.98 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.058 -0.349 . . . . 1.0 110.058 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.495 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.99 137.59 29.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.791 -179.681 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -127.56 124.2 37.61 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.558 -0.534 . . . . 1.0 109.558 178.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.7 tp -81.0 127.22 32.33 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.806 -0.634 . . . . 1.0 111.048 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.5 HD11 ' HG ' ' A' ' 133' ' ' LEU . 23.1 mt -115.32 105.09 12.46 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.643 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.599 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.8 mtm -80.76 159.84 68.07 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.383 -0.372 . . . . 1.0 110.105 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -56.06 115.99 2.86 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.27 1.98 . . . . 1.0 110.966 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 174.75 -151.29 12.22 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 110.513 -1.035 . . . . 1.0 110.513 -179.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.44 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 42.2 p-10 -128.55 131.92 48.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.977 0.417 . . . . 1.0 110.954 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 14.6 m-85 -122.14 127.97 50.72 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.019 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -115.52 -1.1 12.86 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.719 0.295 . . . . 1.0 110.692 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -156.96 163.1 39.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.305 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.564 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.96 -22.34 56.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.055 -0.975 . . . . 1.0 111.827 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.539 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.42 -21.47 66.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.249 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -49.75 -47.32 50.87 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.909 -178.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.664 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 30.5 p90 -102.48 17.57 23.3 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.175 0.512 . . . . 1.0 109.95 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.57 74.17 0.32 Allowed Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.467 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.664 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.58 -171.24 2.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.35 0.595 . . . . 1.0 110.907 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.58 -35.58 3.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.985 -1.007 . . . . 1.0 112.277 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.601 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.3 OUTLIER -145.67 -27.4 0.45 Allowed 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 111.696 0.258 . . . . 1.0 111.696 -178.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 96.92 0.38 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 124.36 1.038 . . . . 1.0 110.736 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -66.55 116.07 7.12 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.139 -178.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 60.5 t -118.8 128.79 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.198 -0.91 . . . . 1.0 110.415 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.503 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -104.65 -26.02 6.65 Favored Glycine 0 N--CA 1.464 0.53 0 N-CA-C 111.393 -0.683 . . . . 1.0 111.393 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 110' ' ' SER . 4.6 m -159.44 -173.69 4.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.787 -0.365 . . . . 1.0 110.03 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.521 HD21 HD13 ' A' ' 112' ' ' LEU . 2.5 pp -171.51 144.32 1.9 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.521 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.55 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 4.9 ptm180 -135.8 164.04 28.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.4 0.619 . . . . 1.0 109.908 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.878 ' H ' HH11 ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.48 150.02 21.08 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.008 -0.997 . . . . 1.0 109.171 178.329 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.811 ' C ' HD12 ' A' ' 171' ' ' ILE . 44.6 t -82.95 83.59 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.189 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.811 HD12 ' C ' ' A' ' 170' ' ' VAL . 2.0 mp . . . . . 0 N--CA 1.465 0.296 0 CA-C-N 116.104 -0.498 . . . . 1.0 109.978 179.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.499 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.524 0.616 0 N-CA-C 110.599 -1.0 . . . . 1.0 110.599 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -172.02 112.7 0.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 121.145 -0.222 . . . . 1.0 110.79 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.541 HG22 HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -120.07 173.91 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.31 0 O-C-N 123.174 0.296 . . . . 1.0 111.057 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.509 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.4 m -131.36 120.62 23.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.299 -1.0 . . . . 1.0 108.299 177.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -105.12 132.64 51.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.898 -1.046 . . . . 1.0 110.027 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.509 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.2 m-85 -114.89 129.4 56.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.241 -0.89 . . . . 1.0 111.354 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.534 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 80.9 tt0 -55.45 -26.73 43.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.197 -0.911 . . . . 1.0 110.389 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -122.86 154.71 37.92 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.027 0.441 . . . . 1.0 110.209 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 6.5 ptp85 -58.32 -173.92 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.541 -0.754 . . . . 1.0 110.257 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.53 27.24 0.48 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.555 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.8 m-85 49.91 67.45 0.9 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.074 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -127.19 -160.16 0.98 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.991 0.424 . . . . 1.0 110.485 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.61 -149.08 0.75 Allowed Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.882 -0.887 . . . . 1.0 110.882 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.534 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 89.8 mtm-85 -72.49 149.8 43.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.682 0.277 . . . . 1.0 110.78 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -137.48 148.8 46.34 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.279 0.562 . . . . 1.0 110.35 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.525 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.9 t80 -141.86 142.18 33.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.924 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.525 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 77.0 tt0 -110.8 122.56 48.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.121 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.33 126.59 54.38 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.707 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.6 p -118.85 11.47 12.62 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.501 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.2 p -156.1 168.8 26.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.055 -0.52 . . . . 1.0 110.536 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -59.51 138.52 57.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.68 -0.691 . . . . 1.0 111.392 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.08 143.64 48.15 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.224 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.438 HG22 ' CE2' ' A' ' 51' ' ' TYR . 27.6 p -111.35 -18.59 12.87 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.793 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -148.14 110.07 4.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 1.0 110.405 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -108.11 1.0 21.98 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.179 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.569 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 47.1 mt-30 -53.34 -48.21 93.38 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.632 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 21.0 Cg_endo -56.86 -35.24 98.19 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.255 1.303 . . . . 1.0 112.881 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -91.36 -46.9 7.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.244 0.545 . . . . 1.0 110.945 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 mt -119.84 128.18 53.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.329 -0.851 . . . . 1.0 111.469 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -91.0 -15.54 29.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.351 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 59.7 ttm-85 -176.13 120.08 0.16 Allowed 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.706 -0.85 . . . . 1.0 108.706 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.7 t -99.53 109.91 22.4 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.348 -0.241 . . . . 1.0 110.348 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -103.37 -3.29 25.71 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.435 -0.348 . . . . 1.0 110.228 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.555 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.1 t -157.84 156.36 31.3 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.192 -0.299 . . . . 1.0 110.192 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.13 155.36 36.59 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.224 -0.444 . . . . 1.0 110.719 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.3 mtp85 -133.89 122.02 22.56 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.791 -0.818 . . . . 1.0 108.791 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.541 HG13 HG22 ' A' ' 4' ' ' ILE . 22.3 t -107.19 117.55 53.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.27 0.557 . . . . 1.0 110.333 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -78.77 -43.45 25.49 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.064 -0.971 . . . . 1.0 110.874 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.8 t -162.96 162.02 25.9 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.424 -0.584 . . . . 1.0 109.424 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.67 177.17 48.7 Favored Glycine 0 C--N 1.315 -0.637 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.7 m -114.24 132.58 56.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.645 -0.502 . . . . 1.0 109.645 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.648 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 53.4 m95 -120.27 146.49 46.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.898 -0.592 . . . . 1.0 110.661 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.557 ' C ' HD12 ' A' ' 45' ' ' LEU . 22.0 tpp -120.49 131.18 54.6 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.549 -0.751 . . . . 1.0 109.212 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.557 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -109.58 131.27 55.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.664 -0.698 . . . . 1.0 109.838 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.41 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 87.9 m-85 -111.69 133.09 54.16 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.579 0.704 . . . . 1.0 111.687 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -57.65 -36.89 72.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.125 -0.943 . . . . 1.0 111.389 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.7 mt-30 -108.11 153.25 41.91 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.635 -178.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -63.6 159.43 40.88 Favored 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.458 2.106 . . . . 1.0 112.172 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.688 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.53 36.9 13.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.254 -0.884 . . . . 1.0 111.332 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.438 ' CE2' HG22 ' A' ' 24' ' ' THR . 3.2 m-85 50.77 75.96 0.17 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.057 -0.974 . . . . 1.0 111.071 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.3 m -144.07 152.97 41.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.105 0.479 . . . . 1.0 110.244 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.84 -148.16 21.53 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.038 -0.601 . . . . 1.0 111.801 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.629 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.1 tp -75.49 143.58 42.49 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.038 -0.581 . . . . 1.0 110.262 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -120.84 150.79 40.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.482 0.182 . . . . 1.0 110.591 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 26.1 m-85 -124.99 124.12 41.32 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-O 120.841 0.353 . . . . 1.0 110.585 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -83.1 123.07 29.16 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.068 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.0 mp -119.37 144.07 47.08 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.415 -0.812 . . . . 1.0 110.03 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -132.4 158.91 40.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.121 -0.945 . . . . 1.0 110.141 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.7 ttp85 -37.09 125.32 0.94 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.997 -0.547 . . . . 1.0 110.763 -178.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.58 -179.97 32.01 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.53 -1.028 . . . . 1.0 110.53 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -114.14 136.23 53.16 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.897 0.379 . . . . 1.0 110.19 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -130.37 112.9 13.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 1.0 109.616 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.83 -3.85 55.59 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.033 -0.531 . . . . 1.0 111.411 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.428 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 78.9 m-20 -147.6 135.7 21.36 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.13 -0.693 . . . . 1.0 109.13 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.666 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 5.1 p80 -56.34 -41.06 75.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.045 0.45 . . . . 1.0 111.057 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -54.52 -6.96 0.13 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.785 -0.643 . . . . 1.0 110.617 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.471 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -82.89 -34.43 26.67 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.152 -0.619 . . . . 1.0 111.606 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.404 ' O ' ' HB2' ' A' ' 70' ' ' MET . 2.3 p90 -94.51 15.68 17.3 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.404 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 70.2 mtp 76.18 27.89 0.85 Allowed 'General case' 0 C--O 1.224 -0.252 0 O-C-N 124.341 1.025 . . . . 1.0 109.679 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.851 0 C-N-CA 119.974 -1.108 . . . . 1.0 112.073 -179.125 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.454 -0.272 0 N-CA-C 109.212 -0.662 . . . . 1.0 109.212 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -122.2 13.42 10.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.247 -0.433 . . . . 1.0 110.829 -178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.4 p -163.63 162.8 24.43 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.171 0.51 . . . . 1.0 110.644 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -157.55 148.9 21.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.604 -0.726 . . . . 1.0 110.327 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.611 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 2.1 ptm180 -128.23 150.38 50.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.761 -0.459 . . . . 1.0 109.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.724 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -101.43 124.14 46.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.088 -1.079 . . . . 1.0 108.088 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.724 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.0 mt -85.65 115.75 62.83 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 109.796 -0.446 . . . . 1.0 109.796 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo . . . . . 0 N--CA 1.501 1.969 0 C-N-CA 122.34 2.027 . . . . 1.0 113.021 179.609 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.231 0.115 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.611 ' NE2' HD11 ' A' ' 171' ' ' ILE . 15.5 m80 -132.3 120.12 21.68 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.486 -0.325 . . . . 1.0 110.914 -179.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -145.45 135.3 23.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.838 -0.345 . . . . 1.0 110.178 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.492 HD12 HG22 ' A' ' 126' ' ' VAL . 18.0 tt -148.27 144.86 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.047 -0.261 . . . . 1.0 110.582 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -124.42 99.92 6.43 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.563 0.54 . . . . 1.0 111.471 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.15 152.36 27.8 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.638 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -129.57 137.84 50.96 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.448 -0.796 . . . . 1.0 111.79 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -54.8 -56.85 14.87 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.362 -0.835 . . . . 1.0 110.978 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.596 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 78.0 mtp180 -105.57 173.87 6.12 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 110.107 -0.331 . . . . 1.0 110.107 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.1 mt-10 . . . . . 0 CA--C 1.511 -0.537 0 CA-C-N 115.829 -0.623 . . . . 1.0 110.163 179.085 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.445 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.501 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 56.5 tp60 -68.62 145.48 53.89 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.461 0.648 . . . . 1.0 111.26 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.491 ' O ' ' SD ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 151.0 51.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 1.0 111.187 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.429 HG21 ' CD1' ' A' ' 116' ' ' PHE . 9.4 tt -145.15 139.16 22.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -112.38 143.72 43.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.381 0.61 . . . . 1.0 110.578 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.49 ' CD1' ' SG ' ' A' ' 109' ' ' CYS . 88.6 m-85 -129.18 154.81 46.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.514 -1.221 . . . . 1.0 110.522 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.0 p -143.79 9.61 1.55 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.329 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.934 ' O ' ' O ' ' A' ' 108' ' ' ASP . 8.1 pt-20 -160.25 78.33 0.65 Allowed 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 118.851 -0.595 . . . . 1.0 109.424 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.934 ' O ' ' O ' ' A' ' 107' ' ' GLU . 12.9 p-10 22.44 167.7 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 122.491 1.139 . . . . 1.0 113.278 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.49 ' SG ' ' CD1' ' A' ' 105' ' ' PHE . 9.8 m -146.95 106.42 3.92 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 120.342 -1.474 . . . . 1.0 109.548 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.422 ' O ' ' OG ' ' A' ' 166' ' ' SER . 80.9 p -67.46 -22.53 65.49 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.395 -0.522 . . . . 1.0 110.675 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 72.0 m -143.96 95.57 2.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.246 0.546 . . . . 1.0 110.554 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.1 tp -63.62 -44.54 93.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.416 -0.811 . . . . 1.0 110.373 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.434 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 98.0 mm-40 -47.2 -9.15 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.245 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.513 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.1 m-20 -96.8 -24.99 15.65 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.988 0.423 . . . . 1.0 110.381 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.0 mmt-85 -109.41 -36.69 5.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.849 -0.614 . . . . 1.0 111.682 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.5 ' HB2' HD11 ' A' ' 112' ' ' LEU . 3.7 t80 -125.53 120.67 31.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.146 0.498 . . . . 1.0 109.902 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -60.36 -60.06 4.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.488 -0.778 . . . . 1.0 110.942 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -40.39 137.84 1.01 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.803 -0.443 . . . . 1.0 109.803 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.434 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 62.9 m-20 -101.94 2.38 37.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.097 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -135.13 137.88 43.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.227 0.537 . . . . 1.0 110.555 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.555 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.0 mm -120.99 122.2 67.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.025 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -112.31 21.85 15.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.413 -0.812 . . . . 1.0 111.046 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.499 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.8 p 169.29 153.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.064 0.459 . . . . 1.0 109.937 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.428 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.7 pp -165.33 158.31 16.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.523 -0.762 . . . . 1.0 110.079 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.09 119.08 27.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.361 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.492 HG22 HD12 ' A' ' 90' ' ' ILE . 29.6 t -102.95 104.92 17.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 115.925 -0.58 . . . . 1.0 109.785 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.899 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.82 -41.14 30.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.516 -0.766 . . . . 1.0 111.315 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -140.59 147.11 38.91 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.511 -0.476 . . . . 1.0 110.745 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 60.51 -175.46 4.56 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.079 -0.809 . . . . 1.0 111.079 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.1 m -117.91 153.15 34.06 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.406 -0.59 . . . . 1.0 109.406 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -126.42 159.39 33.43 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.562 -0.744 . . . . 1.0 110.73 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 41.4 t -130.67 136.44 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.28 -0.637 . . . . 1.0 109.28 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.543 ' HG ' HD11 ' A' ' 146' ' ' LEU . 37.3 mt -107.82 141.42 39.42 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 110.219 -0.289 . . . . 1.0 110.219 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -117.58 134.35 54.97 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.268 0.355 . . . . 1.0 110.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -45.74 -50.75 13.52 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.57 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.72 166.06 16.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.288 0.566 . . . . 1.0 110.279 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.1 m -68.6 177.04 2.62 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.101 -0.954 . . . . 1.0 110.936 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 12.2 m120 58.76 22.16 9.75 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.356 -1.293 . . . . 1.0 110.057 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 36.36 76.94 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.435 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -146.41 41.2 1.14 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.252 0.548 . . . . 1.0 110.166 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.52 -146.64 4.38 Favored Glycine 0 N--CA 1.462 0.386 0 N-CA-C 111.618 -0.593 . . . . 1.0 111.618 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 85.1 mtt85 -69.94 168.39 15.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.86 135.16 21.76 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 123.851 0.719 . . . . 1.0 110.89 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . 0.413 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 7.1 m-85 -127.25 137.92 52.98 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.604 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.7 OUTLIER -91.5 126.23 36.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.937 0.399 . . . . 1.0 110.565 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.604 ' N ' HD23 ' A' ' 145' ' ' LEU . 24.0 mt -114.93 102.73 10.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.522 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.611 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -81.62 161.92 59.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 116.374 -0.375 . . . . 1.0 110.708 -178.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.61 119.15 5.95 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 121.41 1.406 . . . . 1.0 111.522 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.73 -152.42 19.45 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.344 -1.102 . . . . 1.0 110.344 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -127.15 136.4 52.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.77 0.319 . . . . 1.0 110.352 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.513 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 27.6 m-85 -126.6 129.01 47.71 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.172 -0.467 . . . . 1.0 109.766 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -116.33 -3.1 11.97 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.882 0.373 . . . . 1.0 110.291 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.682 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -156.19 159.16 38.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.518 0.675 . . . . 1.0 110.191 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.474 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.8 p90 -74.68 -20.87 59.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.562 -1.199 . . . . 1.0 112.286 -177.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.682 ' NE2' HH21 ' A' ' 153' ' ' ARG . 50.1 mt-30 -68.44 -19.48 64.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.252 -0.431 . . . . 1.0 111.09 -179.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . 0.513 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 54.4 t0 -51.5 -50.13 60.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.101 -0.5 . . . . 1.0 110.914 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.71 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 14.4 p90 -94.43 21.5 7.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.041 0.448 . . . . 1.0 110.443 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.68 75.18 0.23 Allowed Glycine 0 CA--C 1.519 0.343 0 N-CA-C 111.148 -0.781 . . . . 1.0 111.148 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.71 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.82 147.91 42.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.124 0.488 . . . . 1.0 110.03 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . 0.488 ' O ' ' ND2' ' A' ' 161' ' ' ASN . 15.1 t -76.49 -20.51 56.89 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.003 -0.998 . . . . 1.0 109.91 177.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 160' ' ' THR . 12.1 m120 -162.3 -171.04 2.66 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.5 -0.48 . . . . 1.0 110.497 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.82 -10.81 15.1 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.569 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -47.28 117.03 1.59 Allowed 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 120.614 0.245 . . . . 1.0 111.266 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 162' ' ' ALA . 55.8 t -131.14 124.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.76 177.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -100.05 -24.62 9.58 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 111.464 -0.654 . . . . 1.0 111.464 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 110' ' ' SER . 6.0 m -159.82 -171.0 3.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.006 -0.368 . . . . 1.0 110.006 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 pp -172.54 142.17 1.22 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.945 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -132.93 162.66 31.04 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.861 -0.422 . . . . 1.0 109.861 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.496 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -95.49 154.3 17.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.542 -0.754 . . . . 1.0 109.63 178.522 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.733 ' C ' HD12 ' A' ' 171' ' ' ILE . 49.4 t -88.25 88.62 2.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 O-C-N 122.105 -0.372 . . . . 1.0 111.944 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.733 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.8 mp . . . . . 0 N--CA 1.469 0.51 0 CA-C-O 121.137 0.494 . . . . 1.0 109.88 179.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.522 0.512 0 N-CA-C 110.818 -0.913 . . . . 1.0 110.818 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -173.78 98.92 0.11 Allowed 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.829 -0.348 . . . . 1.0 110.571 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.02 164.48 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-O 120.781 0.324 . . . . 1.0 110.487 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.501 HG22 ' CE1' ' A' ' 7' ' ' TYR . 32.9 m -124.17 119.94 30.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.919 -1.141 . . . . 1.0 107.919 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.0 mt -104.17 133.88 48.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.799 -1.091 . . . . 1.0 109.776 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.501 ' CE1' HG22 ' A' ' 5' ' ' THR . 66.4 m-85 -116.12 126.5 53.8 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.383 -0.826 . . . . 1.0 111.067 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.532 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 79.2 tt0 -52.74 -33.63 49.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.657 -0.701 . . . . 1.0 110.289 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -113.35 161.29 17.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.245 0.545 . . . . 1.0 110.655 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.415 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 14.6 ptt-85 -65.22 -175.94 0.26 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.271 -0.877 . . . . 1.0 110.673 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.61 26.29 1.04 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 110.662 -0.975 . . . . 1.0 110.662 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 50.53 70.05 0.56 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.346 -0.427 . . . . 1.0 110.102 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -133.43 -159.78 0.99 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.914 0.388 . . . . 1.0 110.319 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.28 -152.1 0.82 Allowed Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.731 -0.947 . . . . 1.0 110.731 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.532 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 91.1 mtm-85 -68.83 146.01 53.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.673 0.273 . . . . 1.0 110.998 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -136.64 153.79 50.82 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 121.223 0.535 . . . . 1.0 110.688 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 8.2 t80 -147.4 141.78 26.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.253 -0.885 . . . . 1.0 110.086 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.453 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.2 tt0 -110.21 124.72 52.1 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.571 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -114.42 126.53 55.08 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.337 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t -117.28 9.89 13.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.877 -0.601 . . . . 1.0 110.189 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.3 m -154.4 166.37 33.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.892 -0.594 . . . . 1.0 110.563 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -59.25 138.67 57.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.5 -0.773 . . . . 1.0 111.576 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.28 142.21 48.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.412 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.515 ' O ' ' OG ' ' A' ' 78' ' ' SER . 21.0 p -109.82 -10.07 14.78 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.66 -0.7 . . . . 1.0 112.274 -178.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -156.88 114.4 3.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.291 0.567 . . . . 1.0 110.09 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -116.93 1.26 12.63 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.512 -0.767 . . . . 1.0 110.75 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.6 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 4.4 mt-30 -52.93 -43.24 93.7 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.31 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.6 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 37.6 Cg_exo -58.62 -33.51 98.23 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.063 1.842 . . . . 1.0 111.616 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -95.5 -53.1 3.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 120.734 -0.386 . . . . 1.0 110.754 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 mt -116.81 127.61 54.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 1.0 110.804 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 t -94.74 -7.12 41.47 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.862 -0.608 . . . . 1.0 112.148 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.419 ' CD ' HD21 ' A' ' 34' ' ' ASN . 35.8 ttm180 -151.83 -55.29 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.229 0.455 . . . . 1.0 112.229 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.9 t 62.34 80.03 0.24 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 1.0 110.975 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.419 HD21 ' CD ' ' A' ' 32' ' ' ARG . 94.7 m-20 -94.64 3.44 55.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.733 -0.212 . . . . 1.0 111.551 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 p -157.33 159.09 37.14 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.839 -0.345 . . . . 1.0 110.419 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.15 155.24 33.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 1.0 111.512 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.452 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 26.4 mtp85 -134.89 124.48 25.08 Favored 'General case' 0 C--O 1.211 -0.96 0 N-CA-C 108.801 -0.815 . . . . 1.0 108.801 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.1 t -108.92 134.48 50.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.06 -0.719 . . . . 1.0 109.06 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.25 -43.39 8.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 1.0 110.241 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 p -159.58 156.52 28.16 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.735 -0.839 . . . . 1.0 108.735 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.46 174.18 50.21 Favored Glycine 0 C--N 1.316 -0.547 0 N-CA-C 110.959 -0.856 . . . . 1.0 110.959 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.6 m -111.74 142.55 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.415 -0.587 . . . . 1.0 109.415 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.449 ' CE2' HD13 ' A' ' 81' ' ' LEU . 54.6 m95 -131.06 150.47 52.13 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.45 0.643 . . . . 1.0 111.254 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.598 ' C ' HD23 ' A' ' 45' ' ' LEU . 37.6 ttm -128.47 133.26 48.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.964 -1.016 . . . . 1.0 108.908 178.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.598 HD23 ' C ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -109.92 137.6 47.47 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 -179.405 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.418 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 40.9 m-85 -110.95 132.01 54.57 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.628 0.728 . . . . 1.0 110.277 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -59.36 -35.09 73.25 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.184 -0.916 . . . . 1.0 110.962 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.7 mt-30 -110.44 152.43 43.31 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.602 -178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.425 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 40.0 Cg_endo -63.05 157.09 50.91 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.592 2.195 . . . . 1.0 113.133 178.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.658 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.8 OUTLIER 64.33 35.95 9.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.3 -0.864 . . . . 1.0 111.268 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.418 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.5 m-85 51.89 76.28 0.18 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.01 -0.996 . . . . 1.0 111.119 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.5 m -144.98 154.87 43.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.015 0.436 . . . . 1.0 109.976 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.88 -149.79 22.56 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.97 -0.633 . . . . 1.0 112.143 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.609 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.3 tp -75.24 142.74 43.34 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.023 -0.589 . . . . 1.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 2.9 pt20 -121.1 151.92 39.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -128.77 125.89 38.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.294 -0.412 . . . . 1.0 110.881 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.41 ' C ' HD12 ' A' ' 58' ' ' LEU . 58.2 t80 -84.52 122.69 29.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.986 0.422 . . . . 1.0 110.471 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.41 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.6 mp -117.25 146.1 43.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.329 0.585 . . . . 1.0 110.06 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' C ' ' A' ' 60' ' ' ARG . 40.1 mtp180 -131.76 160.82 34.43 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.374 -0.83 . . . . 1.0 109.896 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.5 ttt180 -37.25 125.51 0.99 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.769 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.7 -178.42 33.14 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.508 -1.037 . . . . 1.0 110.508 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.452 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 70.9 m-20 -117.77 124.63 48.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.902 0.382 . . . . 1.0 110.533 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -117.26 113.27 21.93 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.196 -0.668 . . . . 1.0 109.196 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.413 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.91 -2.89 55.43 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.707 -179.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.413 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.4 m-20 -147.98 139.23 23.48 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.576 -0.898 . . . . 1.0 108.576 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.47 ' CD2' HE21 ' A' ' 67' ' ' GLN . 12.2 p-80 -59.24 -43.52 92.39 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.599 -0.44 . . . . 1.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 98.7 mm-40 -50.77 -9.46 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.86 -0.609 . . . . 1.0 111.12 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.453 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.1 mm-40 -82.36 -35.57 27.66 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.265 -0.574 . . . . 1.0 111.15 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.455 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.53 17.79 7.02 Favored 'General case' 0 CA--C 1.507 -0.673 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.534 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 37.6 mtt 80.37 16.47 0.69 Allowed 'General case' 0 CA--C 1.521 -0.152 0 O-C-N 124.013 0.82 . . . . 1.0 109.94 -178.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.472 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . . . . . . 0 C--N 1.337 0.624 0 N-CA-C 110.576 -1.009 . . . . 1.0 110.576 178.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.0 t . . . . . 0 CA--C 1.52 -0.204 0 N-CA-C 109.301 -0.629 . . . . 1.0 109.301 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.425 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.7 mtm-85 -124.34 5.09 8.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.372 -0.376 . . . . 1.0 111.628 -178.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.515 ' OG ' ' O ' ' A' ' 24' ' ' THR . 30.7 m -165.06 162.23 20.21 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.238 0.542 . . . . 1.0 111.202 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.1 p -154.42 146.72 23.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.285 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.439 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 4.5 ptm180 -128.42 150.58 50.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.415 -0.357 . . . . 1.0 110.192 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.449 HD13 ' CE2' ' A' ' 43' ' ' TRP . 20.7 tp -99.58 134.57 42.28 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.046 -1.094 . . . . 1.0 108.046 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.445 ' H ' HD12 ' A' ' 81' ' ' LEU . 6.4 mt -94.82 131.33 30.7 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.737 -0.468 . . . . 1.0 109.737 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo . . . . . 0 N--CA 1.498 1.759 0 C-N-CA 122.159 1.906 . . . . 1.0 113.158 -178.715 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 N--CA 1.461 0.121 0 N-CA-C 109.869 -0.419 . . . . 1.0 109.869 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.591 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 8.2 m80 -134.09 119.79 19.36 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.52 -0.309 . . . . 1.0 111.013 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -142.24 134.01 27.0 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.617 -0.433 . . . . 1.0 110.398 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.482 HD12 HG22 ' A' ' 126' ' ' VAL . 18.5 tt -145.52 140.5 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.83 0.347 . . . . 1.0 110.769 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.546 ' NH2' ' SD ' ' A' ' 102' ' ' MET . 77.0 mtp85 -120.14 98.03 5.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.164 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -79.17 140.89 37.63 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.126 0.489 . . . . 1.0 110.998 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -118.21 134.9 54.61 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-N 115.359 -0.837 . . . . 1.0 111.141 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -55.18 -59.18 5.13 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.688 179.378 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.48 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.3 mtt85 -98.68 162.93 12.86 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.44 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 . . . . . 0 CA--C 1.519 -0.24 0 CA-C-O 121.677 0.751 . . . . 1.0 111.017 178.075 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.413 0 N-CA-C 110.835 -0.906 . . . . 1.0 110.835 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.417 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 9.4 tp-100 -65.7 143.85 57.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 1.0 110.926 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.546 ' SD ' ' NH2' ' A' ' 91' ' ' ARG . 2.1 ptm -129.82 152.06 49.72 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.673 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.9 tt -144.38 140.81 24.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.504 -0.554 . . . . 1.0 109.504 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . 0.503 ' OE1' ' NH1' ' A' ' 91' ' ' ARG . 80.6 tt0 -115.04 146.81 40.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.637 0.732 . . . . 1.0 111.398 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.471 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 83.4 m-85 -132.17 155.58 47.94 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 114.647 -1.16 . . . . 1.0 110.737 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.8 p -144.04 15.84 1.72 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.526 -0.761 . . . . 1.0 110.314 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.2 pm0 -151.54 -172.97 4.37 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.602 -0.439 . . . . 1.0 110.286 178.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 66.4 t0 -74.76 140.17 43.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.771 0.319 . . . . 1.0 110.865 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.518 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.9 m -133.71 91.38 2.83 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.56 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -64.68 -27.28 68.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.37 -0.377 . . . . 1.0 111.082 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.4 t -137.79 95.66 3.09 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.285 0.564 . . . . 1.0 110.429 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -60.62 -41.24 94.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.156 -0.929 . . . . 1.0 110.423 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.602 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 10.8 mp0 -47.83 -13.37 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.895 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' A' ' 112' ' ' LEU . 82.3 m-20 -91.46 1.41 57.15 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.767 0.794 . . . . 1.0 109.714 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.1 mmt-85 -131.02 -40.11 1.18 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.09 -1.413 . . . . 1.0 113.613 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.654 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.61 137.29 54.39 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 122.29 1.043 . . . . 1.0 111.471 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 118' ' ' PHE . 29.4 mmt180 -69.83 -69.19 0.36 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 121.47 -0.768 . . . . 1.0 111.137 -177.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.601 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 81.3 m-85 -37.86 145.73 0.07 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.313 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.426 ' ND2' ' H ' ' A' ' 119' ' ' ASN . 2.6 p30 -104.21 9.18 36.22 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.77 0.319 . . . . 1.0 111.028 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -138.49 140.22 39.11 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.147 0.498 . . . . 1.0 111.204 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.734 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.8 mm -120.96 124.04 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 115.33 -0.85 . . . . 1.0 109.25 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -112.8 21.26 15.7 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.733 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.5 p 169.77 153.7 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.067 0.461 . . . . 1.0 109.959 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.5 pp -164.2 158.21 18.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.568 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.25 115.11 19.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.659 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.482 HG22 HD12 ' A' ' 90' ' ' ILE . 21.5 t -98.72 104.84 16.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 109.458 -0.571 . . . . 1.0 109.458 178.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.865 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.86 -39.59 42.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 1.0 111.262 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -146.65 148.83 32.46 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.848 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 66.47 175.13 6.35 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.772 -0.931 . . . . 1.0 110.772 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 m -116.83 150.54 38.21 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.058 -0.719 . . . . 1.0 109.058 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.416 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 43.8 m95 -124.09 167.38 14.3 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.638 -178.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 39.9 t -138.42 105.63 3.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.558 -0.292 . . . . 1.0 110.331 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 13.3 mt -78.62 142.78 36.97 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.068 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -121.55 136.69 54.93 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.711 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -47.88 -46.8 31.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.519 -0.309 . . . . 1.0 110.412 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -127.8 165.27 20.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.421 0.629 . . . . 1.0 110.343 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 55.6 m -69.92 -179.11 1.74 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.96 -1.018 . . . . 1.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . 0.45 ' CB ' HH21 ' A' ' 140' ' ' ARG . 15.4 m120 55.92 19.6 3.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.555 -1.202 . . . . 1.0 109.466 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.569 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 17.4 m-85 37.67 77.22 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.593 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.45 HH21 ' CB ' ' A' ' 138' ' ' ASN . 76.9 mtm180 -145.22 41.98 1.28 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.029 0.442 . . . . 1.0 110.637 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -154.5 -145.78 4.25 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 111.397 -0.681 . . . . 1.0 111.397 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.28 164.31 25.95 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.835 -0.432 . . . . 1.0 109.835 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.534 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.43 137.47 30.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.395 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -129.9 139.74 51.08 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.086 -0.709 . . . . 1.0 109.086 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.53 ' C ' HD22 ' A' ' 146' ' ' LEU . 43.1 tp -93.18 125.76 37.94 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.494 0.664 . . . . 1.0 111.959 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.814 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.4 mm? -112.42 98.39 7.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.751 -1.113 . . . . 1.0 108.758 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.516 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -75.8 164.18 62.19 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 109.9 -0.407 . . . . 1.0 109.9 -179.203 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -58.68 118.62 5.53 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 C-N-CA 120.665 0.91 . . . . 1.0 110.445 178.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 171.7 -155.58 24.28 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.59 -1.004 . . . . 1.0 110.59 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -125.56 135.07 51.84 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.805 0.336 . . . . 1.0 110.766 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.487 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.8 m-85 -125.26 130.56 52.3 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.161 -0.472 . . . . 1.0 109.849 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -115.81 -2.74 12.31 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.828 0.347 . . . . 1.0 110.087 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -156.78 159.91 38.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.579 0.704 . . . . 1.0 110.088 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.407 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 7.7 p90 -73.68 -19.85 60.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.639 -1.164 . . . . 1.0 112.201 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.32 -19.6 63.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.368 -0.378 . . . . 1.0 111.402 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -51.33 -47.82 62.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.944 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 27.2 p90 -95.82 22.67 7.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.954 0.406 . . . . 1.0 110.654 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.56 74.4 0.29 Allowed Glycine 0 CA--C 1.52 0.384 0 N-CA-C 111.248 -0.741 . . . . 1.0 111.248 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.644 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.06 148.31 43.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.525 0.678 . . . . 1.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . 0.496 ' O ' ' ND2' ' A' ' 161' ' ' ASN . 0.0 OUTLIER -75.77 -25.67 56.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.277 -1.329 . . . . 1.0 109.874 177.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.496 ' ND2' ' O ' ' A' ' 160' ' ' THR . 13.8 m120 -158.15 -171.19 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.042 0.449 . . . . 1.0 110.508 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.734 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -107.59 -18.17 13.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.693 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -37.71 118.88 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.85 0.357 . . . . 1.0 111.866 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 162' ' ' ALA . 18.9 t -122.36 159.38 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 115.858 -0.61 . . . . 1.0 109.65 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.484 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -136.72 -34.88 0.21 Allowed Glycine 0 N--CA 1.462 0.4 0 N-CA-C 111.207 -0.757 . . . . 1.0 111.207 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.4 p -158.11 -174.06 4.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.847 0.356 . . . . 1.0 110.109 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -169.53 137.56 1.81 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.143 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.569 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 12.4 ptp180 -133.17 154.45 50.61 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.605 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -84.84 152.35 23.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.962 -0.563 . . . . 1.0 109.653 178.428 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.829 ' C ' HD12 ' A' ' 171' ' ' ILE . 47.3 t -88.01 83.13 2.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.262 -0.426 . . . . 1.0 111.559 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.829 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.0 mp . . . . . 0 N--CA 1.465 0.303 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.336 179.014 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.525 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.525 0.692 0 N-CA-C 110.602 -0.999 . . . . 1.0 110.602 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -169.67 138.63 1.89 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.29 -0.263 . . . . 1.0 110.29 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -147.03 168.77 4.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.337 -0.392 . . . . 1.0 110.786 179.474 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.1 m -128.39 120.67 27.41 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.325 -0.991 . . . . 1.0 108.325 175.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.25 132.77 50.15 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.318 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.49 ' CE1' HG22 ' A' ' 5' ' ' THR . 60.7 m-85 -115.35 125.9 53.77 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.331 -0.849 . . . . 1.0 110.883 -178.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -53.96 -27.37 30.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.613 -0.721 . . . . 1.0 110.633 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -119.48 154.57 33.58 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.119 0.485 . . . . 1.0 110.142 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 12' ' ' PHE . 32.4 ptt85 -59.39 -172.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.515 -0.766 . . . . 1.0 110.266 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.65 25.49 0.2 Allowed Glycine 0 N--CA 1.461 0.304 0 N-CA-C 111.008 -0.837 . . . . 1.0 111.008 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 7.8 m-85 51.69 69.01 0.71 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.062 -0.348 . . . . 1.0 110.062 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -131.17 -158.83 0.92 Allowed 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.008 0.432 . . . . 1.0 110.635 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.57 -151.96 0.43 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.875 -0.89 . . . . 1.0 110.875 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -68.97 146.81 52.43 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.961 -0.296 . . . . 1.0 110.621 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -136.48 150.29 48.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.221 0.534 . . . . 1.0 110.196 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -143.78 142.09 30.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.396 -0.82 . . . . 1.0 110.089 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.7 tt0 -110.48 122.18 47.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.958 -0.564 . . . . 1.0 110.313 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.22 127.91 55.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.456 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 79.4 p -118.66 12.99 13.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.407 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 54.9 m -158.63 172.71 17.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.543 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 46.8 p-10 -62.3 137.49 58.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.572 -0.74 . . . . 1.0 111.279 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.82 149.17 52.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.783 -0.644 . . . . 1.0 110.093 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 p -119.46 -18.4 8.51 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.26 -0.882 . . . . 1.0 112.196 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -143.54 109.52 5.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.994 0.426 . . . . 1.0 110.074 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.406 ' O ' ' N ' ' A' ' 30' ' ' LEU . 19.8 mt -116.17 -5.57 11.88 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.735 -0.666 . . . . 1.0 110.421 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.623 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -45.33 -52.45 21.69 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.889 -0.596 . . . . 1.0 109.92 178.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.623 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.3 Cg_endo -54.19 -30.29 60.54 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 C-N-CA 121.97 1.78 . . . . 1.0 111.767 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.529 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -96.27 -55.14 3.04 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.843 0.354 . . . . 1.0 110.273 -178.832 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.4 mt -117.4 125.28 50.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.867 -0.606 . . . . 1.0 110.274 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -93.59 -9.77 36.97 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.825 -0.625 . . . . 1.0 111.752 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.476 ' CD ' HD21 ' A' ' 34' ' ' ASN . 43.5 ttm180 -147.32 -63.71 0.28 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.737 -178.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 51.8 t 71.01 83.61 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.31 0.381 . . . . 1.0 110.06 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.476 HD21 ' CD ' ' A' ' 32' ' ' ARG . 92.1 m-20 -97.29 5.74 49.47 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.945 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.553 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 2.0 t -160.32 158.05 29.07 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.67 -0.412 . . . . 1.0 109.978 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.99 155.37 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.048 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.6 mtp85 -133.54 121.66 22.44 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 108.506 -0.924 . . . . 1.0 108.506 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -107.51 117.78 53.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.397 0.618 . . . . 1.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -77.24 -43.64 32.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.91 -1.041 . . . . 1.0 110.508 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.4 t -163.38 162.89 25.16 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.31 176.33 48.58 Favored Glycine 0 C--N 1.317 -0.508 0 N-CA-C 110.982 -0.847 . . . . 1.0 110.982 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.4 m -112.09 126.29 55.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.571 -0.529 . . . . 1.0 109.571 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.667 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 50.8 m95 -115.31 149.28 38.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.856 -0.611 . . . . 1.0 111.091 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.695 ' C ' HD23 ' A' ' 45' ' ' LEU . 2.1 ttt -128.46 133.27 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.408 -0.814 . . . . 1.0 109.592 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.695 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -110.84 140.33 45.38 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.761 -178.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.401 ' CD1' ' N ' ' A' ' 46' ' ' TYR . 27.5 m-85 -113.48 132.38 55.68 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.269 0.556 . . . . 1.0 110.898 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.572 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.2 pt-20 -60.34 -36.19 77.41 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.539 -0.755 . . . . 1.0 110.263 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -100.87 151.53 37.63 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.286 -0.87 . . . . 1.0 110.038 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.52 ' C ' HD22 ' A' ' 50' ' ' ASN . 18.6 Cg_endo -55.32 149.77 44.44 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 121.792 1.662 . . . . 1.0 110.689 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.764 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER 71.24 -116.88 0.08 Allowed 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.572 -0.899 . . . . 1.0 108.572 -177.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -151.74 70.92 0.96 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.778 -0.646 . . . . 1.0 109.884 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -138.08 15.4 2.84 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.82 0.343 . . . . 1.0 110.903 -178.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.8 -176.66 14.5 Favored Glycine 0 C--N 1.321 -0.285 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.572 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.5 tp -51.75 150.0 4.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -123.87 153.39 41.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.911 0.386 . . . . 1.0 110.877 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -132.46 125.9 31.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.159 178.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.403 ' C ' HD12 ' A' ' 58' ' ' LEU . 52.8 t80 -83.9 124.02 30.55 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.255 -0.429 . . . . 1.0 110.414 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.403 HD12 ' C ' ' A' ' 57' ' ' PHE . 7.3 mp -121.15 146.86 46.32 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.351 0.596 . . . . 1.0 110.383 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.402 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtp180 -132.67 160.41 36.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.108 -0.951 . . . . 1.0 110.562 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 59' ' ' ARG . 79.6 ttt-85 -38.47 125.04 1.34 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.617 -0.719 . . . . 1.0 110.441 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.59 -179.73 32.2 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.382 -1.087 . . . . 1.0 110.382 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -114.63 131.8 56.59 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.866 0.365 . . . . 1.0 110.297 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.11 113.34 17.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.049 -0.523 . . . . 1.0 109.851 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.32 -4.18 56.09 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.416 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 72.1 m-20 -147.43 141.99 26.53 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.502 ' C ' ' H ' ' A' ' 68' ' ' GLN . 15.5 p-80 -62.12 -41.75 98.55 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.466 . . . . 1.0 111.215 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -53.73 -6.51 0.08 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.702 -0.681 . . . . 1.0 110.363 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.502 ' H ' ' C ' ' A' ' 66' ' ' HIS . 19.4 mm-40 -83.66 -34.86 24.92 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.613 -0.435 . . . . 1.0 111.354 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.489 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -94.13 18.21 11.19 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.668 -0.413 . . . . 1.0 110.901 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.626 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 4.2 mtt 80.03 17.23 0.72 Allowed 'General case' 0 C--N 1.338 0.096 0 O-C-N 123.593 0.558 . . . . 1.0 110.774 -178.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.855 0 N-CA-C 110.097 -1.201 . . . . 1.0 110.097 178.878 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.53 0.188 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -115.65 4.2 14.06 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 120.667 0.27 . . . . 1.0 111.514 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.7 p -162.84 160.93 25.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.058 0.456 . . . . 1.0 110.584 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.77 148.29 22.43 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.577 -0.738 . . . . 1.0 110.605 -178.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.592 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.5 ptm180 -128.18 150.03 50.18 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 110.027 -0.361 . . . . 1.0 110.027 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.77 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.6 tt -101.8 124.27 47.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.887 -0.783 . . . . 1.0 108.887 178.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.77 ' N ' HD23 ' A' ' 81' ' ' LEU . 6.4 mt -85.34 116.09 64.07 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 115.99 -0.55 . . . . 1.0 109.974 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo . . . . . 0 N--CA 1.498 1.761 0 C-N-CA 122.364 2.043 . . . . 1.0 113.107 179.882 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.3 m . . . . . 0 CA--C 1.52 -0.199 0 N-CA-C 109.712 -0.477 . . . . 1.0 109.712 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -134.91 120.01 18.74 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 121.116 -0.233 . . . . 1.0 110.932 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -146.55 133.57 20.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.3 tt -147.2 150.53 14.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.605 -0.271 . . . . 1.0 110.494 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -126.5 98.11 5.29 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.947 -0.57 . . . . 1.0 111.697 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.11 129.81 38.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.537 . . . . 1.0 110.136 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.571 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 46.1 m-85 -107.68 136.53 47.28 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.363 -0.835 . . . . 1.0 110.944 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.528 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.91 -69.45 0.16 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.832 -0.622 . . . . 1.0 111.761 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 33.2 mtt-85 -96.85 176.44 5.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.744 -0.662 . . . . 1.0 110.892 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 59.1 mp0 . . . . . 0 CA--C 1.509 -0.598 0 CA-C-N 115.391 -0.822 . . . . 1.0 109.445 179.985 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -58.42 148.58 27.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.037 -0.357 . . . . 1.0 110.037 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.571 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 7.9 ttp -131.63 152.42 50.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.995 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.475 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.1 tt -146.92 141.67 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.171 -0.678 . . . . 1.0 109.171 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -111.29 141.55 44.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.406 0.622 . . . . 1.0 110.466 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.86 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 79.7 m-85 -129.42 153.53 47.84 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 114.714 -1.13 . . . . 1.0 110.42 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -141.66 29.9 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.641 -0.708 . . . . 1.0 110.738 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -170.94 -167.81 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.461 -0.495 . . . . 1.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.438 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 55.3 p-10 -76.83 144.83 38.82 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.69 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 6.2 m -135.02 89.43 2.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.997 -0.547 . . . . 1.0 109.779 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.1 m -64.46 -36.35 83.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.834 0.349 . . . . 1.0 111.454 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.0 m -131.65 84.96 2.21 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.426 0.631 . . . . 1.0 110.323 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.86 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.4 tp -59.27 -38.95 81.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.097 -0.956 . . . . 1.0 110.019 -178.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.648 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 22.1 mp0 -43.45 -9.64 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.281 -0.418 . . . . 1.0 111.511 178.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.587 ' N ' ' O ' ' A' ' 112' ' ' LEU . 87.2 m-20 -93.89 -21.94 18.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.982 0.42 . . . . 1.0 110.86 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.4 mmt180 -110.11 -38.65 5.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.974 -0.557 . . . . 1.0 112.383 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.729 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -118.95 137.28 53.6 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.756 1.265 . . . . 1.0 111.142 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 118' ' ' PHE . 84.5 mmt-85 -73.78 -74.32 0.19 Allowed 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.275 -1.516 . . . . 1.0 110.364 -178.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.686 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 91.5 m-85 -31.53 143.65 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 123.499 0.499 . . . . 1.0 110.598 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -104.73 11.69 33.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 1.0 110.726 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -140.0 139.38 36.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.237 0.541 . . . . 1.0 110.902 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.675 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 44.4 mm -120.41 123.46 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.369 -0.832 . . . . 1.0 109.51 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.447 ' O ' ' CB ' ' A' ' 123' ' ' SER . 20.4 m-70 -110.8 22.25 15.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.516 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.591 ' C ' HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER 165.2 157.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.921 -0.312 . . . . 1.0 110.479 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.699 HD13 ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -158.91 164.01 36.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.184 179.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -130.46 103.4 6.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.284 -0.636 . . . . 1.0 109.284 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.519 HG13 ' H ' ' A' ' 149' ' ' GLY . 0.6 OUTLIER -101.4 110.42 28.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.7 -0.852 . . . . 1.0 108.7 179.234 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.955 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.3 OUTLIER -81.66 -39.22 24.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.419 -0.809 . . . . 1.0 111.249 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.484 ' O ' ' O ' ' A' ' 129' ' ' GLY . 43.6 mm-40 -121.53 160.34 24.46 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.372 0.606 . . . . 1.0 111.039 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 34.62 -159.4 0.01 OUTLIER Glycine 0 CA--C 1.53 1.016 0 CA-C-N 114.191 -1.368 . . . . 1.0 110.993 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 1.7 t -120.26 -175.93 3.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.994 0.426 . . . . 1.0 109.891 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 130' ' ' SER . 75.0 m95 -150.71 168.97 22.75 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.269 -178.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 57.5 t -137.42 131.44 44.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.534 -0.543 . . . . 1.0 109.534 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.07 143.0 33.86 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 110.205 -0.295 . . . . 1.0 110.205 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . 0.526 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 14.2 m-85 -119.17 133.22 55.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.445 -0.343 . . . . 1.0 110.088 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.421 ' OE2' ' O ' ' A' ' 135' ' ' GLU . 4.3 tm-20 -50.89 -29.86 13.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.088 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -139.79 176.7 8.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.119 0.485 . . . . 1.0 110.107 -179.523 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.2 m -82.8 171.76 13.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.329 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 10.1 m120 64.78 18.33 11.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.114 -0.948 . . . . 1.0 110.247 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.455 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 3.2 m-85 37.39 79.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.663 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 50.4 ttm-85 -148.55 37.51 0.83 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.968 0.414 . . . . 1.0 110.422 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -149.36 -144.33 3.93 Favored Glycine 0 CA--C 1.521 0.442 0 N-CA-C 111.333 -0.707 . . . . 1.0 111.333 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -73.01 159.06 34.25 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.077 -0.342 . . . . 1.0 110.077 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.626 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 88.6 mt-30 -138.81 134.6 33.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.007 -0.542 . . . . 1.0 111.047 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -129.65 140.72 51.08 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.291 -0.633 . . . . 1.0 109.291 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.53 ' C ' HD22 ' A' ' 146' ' ' LEU . 43.1 tp -95.95 128.37 42.78 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.725 0.641 . . . . 1.0 110.588 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.862 HD22 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -113.45 96.92 6.14 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.971 -1.013 . . . . 1.0 109.764 179.73 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.592 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.6 OUTLIER -68.89 154.57 94.77 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 114.89 -1.05 . . . . 1.0 110.235 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . 0.452 ' HA ' HG13 ' A' ' 126' ' ' VAL . 18.5 Cg_endo -56.55 112.97 1.25 Allowed 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.233 1.955 . . . . 1.0 111.372 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.519 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 176.06 -150.83 10.98 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.421 -1.072 . . . . 1.0 110.421 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -128.66 125.76 38.74 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.298 -0.451 . . . . 1.0 111.175 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.551 ' CD1' ' CD2' ' A' ' 124' ' ' LEU . 3.8 m-85 -117.66 128.38 54.86 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.315 -0.624 . . . . 1.0 109.315 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -107.47 -5.22 17.76 Favored 'General case' 0 CA--C 1.518 -0.25 0 O-C-N 123.685 0.616 . . . . 1.0 110.797 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -154.13 172.22 17.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.688 -0.687 . . . . 1.0 110.545 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.443 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 26.6 p90 -85.21 -21.82 28.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.097 -0.956 . . . . 1.0 112.495 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -64.53 -23.29 67.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.006 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . 0.505 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.3 t0 -44.2 -54.33 5.74 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.946 0.403 . . . . 1.0 111.068 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.671 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 28.7 p90 -92.67 24.13 3.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.753 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 50.39 75.23 0.22 Allowed Glycine 0 CA--C 1.52 0.383 0 N-CA-C 111.217 -0.753 . . . . 1.0 111.217 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.671 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.65 145.67 46.26 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.884 -0.413 . . . . 1.0 109.884 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.7 t -76.23 -10.73 59.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.92 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.503 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 30.2 t-20 -171.95 -164.53 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.449 -0.5 . . . . 1.0 110.156 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.871 ' O ' HG23 ' A' ' 164' ' ' VAL . . . -112.13 -16.42 13.03 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 116.37 -0.377 . . . . 1.0 110.328 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.437 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.7 mtt180 -30.12 116.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.285 0.365 . . . . 1.0 111.751 -178.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.871 HG23 ' O ' ' A' ' 162' ' ' ALA . 57.6 t -126.43 162.9 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.135 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.609 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -146.07 -34.85 0.06 OUTLIER Glycine 0 CA--C 1.516 0.133 0 N-CA-C 111.604 -0.598 . . . . 1.0 111.604 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 11.6 p -160.19 173.0 16.4 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 120.932 0.396 . . . . 1.0 110.753 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.614 HD21 HD13 ' A' ' 112' ' ' LEU . 1.1 pt? -158.59 154.19 26.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 1.0 112.186 -179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.526 ' NE ' ' OH ' ' A' ' 134' ' ' TYR . 17.0 ptp180 -145.35 153.49 41.29 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.409 -0.517 . . . . 1.0 110.441 178.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.441 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -82.04 149.14 28.25 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.43 -0.581 . . . . 1.0 109.43 177.805 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.795 ' C ' HD12 ' A' ' 171' ' ' ILE . 25.9 m -81.73 78.12 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.373 0.606 . . . . 1.0 112.416 -178.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.795 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.9 mp . . . . . 0 C--N 1.329 -0.285 0 O-C-N 121.834 -0.541 . . . . 1.0 110.181 179.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.541 0 N-CA-C 110.456 -1.057 . . . . 1.0 110.456 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . 0.553 ' NZ ' ' OE2' ' A' ' 18' ' ' GLU . 59.5 tttm -173.18 102.16 0.13 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.534 0.206 . . . . 1.0 110.66 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.409 HD13 ' O ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER -119.6 169.87 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.853 -178.385 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.489 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.6 m -129.37 123.27 31.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.41 -0.959 . . . . 1.0 108.41 177.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.6 mt -107.83 133.09 52.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.941 -1.027 . . . . 1.0 110.184 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.489 ' CE1' HG22 ' A' ' 5' ' ' THR . 47.9 m-85 -115.36 126.22 54.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.346 -0.843 . . . . 1.0 111.111 -178.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -52.9 -32.96 48.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.626 -0.715 . . . . 1.0 110.664 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -115.42 150.0 37.11 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.304 0.574 . . . . 1.0 110.481 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.427 ' C ' ' N ' ' A' ' 12' ' ' PHE . 20.1 ptt-85 -54.93 -173.32 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.613 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.32 23.22 0.26 Allowed Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.427 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.3 m-85 52.78 68.24 0.86 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.482 -0.359 . . . . 1.0 110.287 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -130.41 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.0 0.429 . . . . 1.0 110.516 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.82 -150.76 0.25 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.943 -0.863 . . . . 1.0 110.943 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -69.71 146.9 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.804 0.335 . . . . 1.0 110.622 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -136.26 144.14 44.64 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.279 0.561 . . . . 1.0 110.433 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.556 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.2 t80 -137.81 141.52 40.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.309 -0.86 . . . . 1.0 109.893 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.556 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 17.2 tt0 -111.22 122.17 47.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.368 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.8 126.3 53.64 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.627 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -117.99 13.33 13.92 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.745 -0.662 . . . . 1.0 110.377 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.0 m -158.21 168.18 27.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.647 -178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.34 140.64 53.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.534 -0.757 . . . . 1.0 111.211 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.88 153.1 49.59 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.534 -0.757 . . . . 1.0 110.601 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.7 p -120.88 -11.46 8.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.437 -0.801 . . . . 1.0 112.4 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.15 116.44 5.72 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.42 0.629 . . . . 1.0 110.897 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.426 ' O ' ' N ' ' A' ' 30' ' ' LEU . 6.5 mp -110.4 -3.11 16.29 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.483 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.589 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 35.8 mt-30 -52.95 -51.23 76.52 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.948 -0.301 . . . . 1.0 110.597 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.589 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 17.1 Cg_endo -54.76 -35.93 89.23 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 121.274 1.316 . . . . 1.0 112.292 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -94.81 -51.31 4.75 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 120.177 -0.609 . . . . 1.0 111.001 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.426 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.2 mt -118.19 127.61 53.91 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.618 -0.719 . . . . 1.0 110.824 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.3 t -94.24 -10.41 33.03 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.76 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -145.7 -58.79 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.749 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 41.0 t 62.58 80.73 0.22 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -96.57 4.78 51.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.573 -0.285 . . . . 1.0 111.245 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.6 p -155.88 157.6 36.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.864 0.364 . . . . 1.0 110.368 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.71 154.71 34.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.967 -178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -134.79 123.32 23.4 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.732 -0.84 . . . . 1.0 108.732 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.4 t -108.75 133.5 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -96.74 -41.48 8.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.367 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.8 p -160.85 157.28 26.4 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.99 176.28 49.38 Favored Glycine 0 C--N 1.315 -0.583 0 N-CA-C 110.924 -0.87 . . . . 1.0 110.924 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.9 m -112.55 147.19 37.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.403 ' CE2' HD13 ' A' ' 81' ' ' LEU . 51.8 m95 -132.46 151.28 51.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 1.0 110.776 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.563 ' C ' HD12 ' A' ' 45' ' ' LEU . 13.9 tpp -124.19 129.01 50.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.133 -1.062 . . . . 1.0 108.133 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.564 HD23 HG21 ' A' ' 76' ' ' VAL . 10.4 mp -109.81 131.46 55.04 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.101 -0.499 . . . . 1.0 109.858 -179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -109.19 129.52 55.49 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.899 0.38 . . . . 1.0 111.927 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 19.7 pt-20 -53.61 -32.32 50.68 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.418 -0.81 . . . . 1.0 111.097 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.758 ' CG ' ' H ' ' A' ' 53' ' ' GLY . 9.7 pt20 -113.83 156.72 43.4 Favored Pre-proline 0 CA--C 1.514 -0.404 0 N-CA-C 109.442 -0.577 . . . . 1.0 109.442 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -56.39 147.39 68.28 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 121.127 1.218 . . . . 1.0 111.968 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.846 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.3 OUTLIER 82.88 -124.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.279 -1.328 . . . . 1.0 109.588 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.3 m-85 -150.12 75.05 1.23 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.052 179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -134.78 -56.52 0.83 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 112.455 0.539 . . . . 1.0 112.455 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.758 ' H ' ' CG ' ' A' ' 48' ' ' GLN . . . -61.97 -163.05 0.26 Allowed Glycine 0 C--N 1.314 -0.677 0 C-N-CA 120.07 -1.062 . . . . 1.0 111.305 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.497 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.7 tp -59.02 147.61 33.94 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.908 -0.646 . . . . 1.0 110.143 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -121.34 149.8 42.4 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.994 0.184 . . . . 1.0 110.864 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.45 ' O ' ' SD ' ' A' ' 44' ' ' MET . 22.0 m-85 -126.51 127.1 44.81 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.151 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.467 ' C ' HD22 ' A' ' 58' ' ' LEU . 55.9 t80 -81.71 121.63 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.558 0.694 . . . . 1.0 109.692 -179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 ' C ' ' A' ' 57' ' ' PHE . 4.0 mm? -111.87 132.57 54.63 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 114.769 -1.105 . . . . 1.0 109.77 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.7 ttp180 -127.96 156.03 43.32 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.287 -0.869 . . . . 1.0 109.746 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' A' ' 59' ' ' ARG . 36.9 ptt180 -37.35 126.87 1.05 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.763 -0.653 . . . . 1.0 111.454 -178.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.9 -178.3 30.09 Favored Glycine 0 CA--C 1.521 0.459 0 N-CA-C 111.166 -0.773 . . . . 1.0 111.166 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.0 p-10 -116.43 127.48 54.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.094 0.474 . . . . 1.0 110.335 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -121.47 113.27 19.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.272 -0.64 . . . . 1.0 109.272 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.432 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.49 -4.6 53.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.381 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 81.9 m-20 -147.89 133.53 18.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.137 -0.69 . . . . 1.0 109.137 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.5 ' C ' ' H ' ' A' ' 68' ' ' GLN . 4.5 p80 -56.17 -40.97 74.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 1.0 111.127 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -51.93 -8.36 0.07 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.537 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.2 mm-40 -84.39 -32.93 23.91 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.838 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -96.57 17.94 15.22 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 121.021 -0.272 . . . . 1.0 111.43 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.436 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 41.1 mtt 82.9 9.86 0.62 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 123.941 0.775 . . . . 1.0 109.815 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.406 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.343 0.964 0 C-N-CA 120.306 -0.949 . . . . 1.0 111.218 179.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.564 HG21 HD23 ' A' ' 45' ' ' LEU . 1.4 p . . . . . 0 N--CA 1.479 1.005 0 CA-C-O 120.671 0.272 . . . . 1.0 111.044 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 26' ' ' LEU . 89.8 mtm180 -110.68 9.43 22.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.271 -0.422 . . . . 1.0 110.692 -177.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.4 p -160.46 159.27 30.67 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.497 0.665 . . . . 1.0 110.968 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.9 p -154.66 146.49 23.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.081 -0.963 . . . . 1.0 110.356 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -127.67 146.4 50.57 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.795 0.331 . . . . 1.0 110.108 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.403 HD13 ' CE2' ' A' ' 43' ' ' TRP . 21.9 tp -94.44 126.76 39.91 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.451 -0.944 . . . . 1.0 108.451 178.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mt -91.32 114.94 63.35 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 109.222 -0.658 . . . . 1.0 109.222 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo . . . . . 0 N--CA 1.499 1.824 0 C-N-CA 122.087 1.858 . . . . 1.0 113.479 -179.837 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 m . . . . . 0 CA--C 1.523 -0.076 0 CA-C-O 120.903 0.382 . . . . 1.0 110.157 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -137.26 112.2 8.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.803 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.466 ' HE ' HD23 ' A' ' 127' ' ' LEU . 61.4 ttp180 -140.18 135.02 31.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.699 0.285 . . . . 1.0 110.27 178.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.9 tt -148.93 145.76 17.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.929 -0.309 . . . . 1.0 110.813 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -126.14 97.37 5.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.73 -0.668 . . . . 1.0 111.352 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.95 142.57 39.98 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.166 0.508 . . . . 1.0 111.187 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -117.59 134.8 54.48 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.367 -0.833 . . . . 1.0 110.86 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.437 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.2 tm-20 -53.45 -61.79 2.07 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.568 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.442 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.4 mtp85 -100.33 170.48 8.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.364 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.713 -0.676 . . . . 1.0 110.43 179.067 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.689 0 N-CA-C 111.083 -0.807 . . . . 1.0 111.083 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.78 145.11 53.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.815 0.34 . . . . 1.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.2 ptm -131.41 157.24 43.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.262 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.7 tt -148.98 142.85 18.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 109.989 -0.374 . . . . 1.0 109.989 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -113.62 142.41 46.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.447 0.642 . . . . 1.0 110.84 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -129.5 156.66 43.78 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 114.556 -1.202 . . . . 1.0 110.331 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.6 p -143.61 26.06 1.61 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.586 -0.734 . . . . 1.0 110.636 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -167.74 -166.82 0.78 Allowed 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.627 -0.429 . . . . 1.0 110.37 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.445 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 54.2 p-10 -77.11 143.92 38.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.792 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.2 m -133.16 92.85 3.08 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.949 -0.569 . . . . 1.0 109.793 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.421 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.0 OUTLIER -67.2 -27.69 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.469 -0.332 . . . . 1.0 111.323 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 13.6 m -136.84 96.45 3.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.25 0.548 . . . . 1.0 110.863 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.519 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.4 tp -64.58 -44.25 91.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.346 -0.843 . . . . 1.0 110.44 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -47.87 -7.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.348 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.519 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.7 m-20 -96.21 -25.45 15.81 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.061 0.458 . . . . 1.0 110.318 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -108.78 -35.41 6.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.648 -0.705 . . . . 1.0 111.463 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.466 ' HB2' HD11 ' A' ' 112' ' ' LEU . 4.2 t80 -126.12 121.09 31.86 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.001 0.429 . . . . 1.0 109.898 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.3 mtt-85 -60.11 -65.92 0.6 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.225 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.437 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 94.0 m-85 -39.5 142.35 0.29 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -104.18 2.85 32.27 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.715 0.293 . . . . 1.0 111.345 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -131.72 137.4 48.23 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.241 0.543 . . . . 1.0 111.221 -178.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.68 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.5 mm -122.75 126.08 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.101 -0.954 . . . . 1.0 109.502 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 23.3 m-70 -113.64 18.13 17.74 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.105 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.0 p 173.84 153.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.987 0.422 . . . . 1.0 110.288 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.471 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.1 pp -162.75 156.71 20.68 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.443 -178.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.96 108.74 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.88 -0.6 . . . . 1.0 109.846 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.478 HG13 ' H ' ' A' ' 149' ' ' GLY . 0.7 OUTLIER -102.84 110.9 30.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.773 -0.825 . . . . 1.0 108.773 178.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.918 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -80.09 -39.25 30.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.033 -0.985 . . . . 1.0 111.158 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.512 ' O ' ' O ' ' A' ' 129' ' ' GLY . 66.3 mm-40 -137.6 169.15 18.27 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-O 121.853 0.835 . . . . 1.0 110.74 -179.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.83 177.58 0.01 OUTLIER Glycine 0 C--N 1.311 -0.853 0 CA-C-N 113.622 -1.626 . . . . 1.0 110.828 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -118.64 148.05 43.13 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.261 -0.644 . . . . 1.0 109.261 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.473 ' N ' ' CD1' ' A' ' 131' ' ' TRP . 27.5 m95 -120.17 166.48 13.39 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.479 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.0 p -141.46 98.0 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.889 179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.419 HD23 ' HB3' ' A' ' 167' ' ' LEU . 10.7 mt -66.78 141.1 57.84 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.418 -0.513 . . . . 1.0 111.299 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -117.75 131.65 56.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.636 . . . . 1.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -45.3 -49.76 12.47 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.432 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.784 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -123.82 170.48 10.51 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.206 0.527 . . . . 1.0 110.179 -178.45 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.5 p -75.43 174.79 9.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.236 -0.893 . . . . 1.0 110.898 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 60.01 16.63 6.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.467 -1.242 . . . . 1.0 110.037 -179.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 40.06 78.01 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.718 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.784 ' C ' HD11 ' A' ' 136' ' ' LEU . 96.4 mtt180 -146.58 44.85 1.21 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.73 0.3 . . . . 1.0 110.551 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.521 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -158.39 -139.42 2.69 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 111.187 -0.765 . . . . 1.0 111.187 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -78.19 169.04 18.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.024 0.44 . . . . 1.0 109.942 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.432 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -147.83 139.21 23.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.757 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.7 m-85 -129.07 139.71 51.89 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.363 -0.977 . . . . 1.0 108.363 177.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.635 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -94.35 126.17 39.44 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.056 0.455 . . . . 1.0 110.743 -178.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.842 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.4 mm? -112.26 101.82 10.02 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.635 -0.711 . . . . 1.0 109.237 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.584 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.98 159.37 68.59 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.645 -0.707 . . . . 1.0 109.729 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -54.29 120.76 8.52 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.276 1.984 . . . . 1.0 111.844 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.478 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 166.3 -159.09 32.3 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 110.734 -0.947 . . . . 1.0 110.734 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.487 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 67.8 t0 -119.47 135.21 54.86 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.192 -0.504 . . . . 1.0 110.645 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.487 ' N ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 m-85 -126.55 128.45 46.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.017 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -115.4 -5.53 12.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.991 0.424 . . . . 1.0 110.332 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.683 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.4 ptm180 -154.25 161.13 42.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.843 -0.617 . . . . 1.0 110.436 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.419 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -76.18 -20.32 57.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.898 -1.047 . . . . 1.0 112.443 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.683 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.3 mt-30 -68.97 -18.69 64.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.981 0.419 . . . . 1.0 111.021 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -51.06 -49.04 61.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.973 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.716 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 16.0 p90 -97.29 21.86 9.46 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.244 -0.434 . . . . 1.0 110.568 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.05 74.83 0.26 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.009 -0.836 . . . . 1.0 111.009 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.716 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.94 149.24 41.23 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 121.034 0.445 . . . . 1.0 110.211 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -80.39 -10.5 59.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.014 178.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.736 HD22 ' HE ' ' A' ' 163' ' ' ARG . 58.3 t30 -172.22 -170.52 0.74 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.456 -0.498 . . . . 1.0 110.406 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.68 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.72 -13.31 14.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.493 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.736 ' HE ' HD22 ' A' ' 161' ' ' ASN . 19.1 ptp180 -43.35 121.31 2.18 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.51 0.671 . . . . 1.0 111.504 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 162' ' ' ALA . 38.5 t -133.08 131.85 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.422 -0.808 . . . . 1.0 109.876 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.65 -29.29 3.93 Favored Glycine 0 N--CA 1.464 0.529 0 N-CA-C 111.477 -0.649 . . . . 1.0 111.477 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 110' ' ' SER . 21.0 m -162.98 174.42 12.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.905 0.383 . . . . 1.0 110.988 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.419 ' HB3' HD23 ' A' ' 133' ' ' LEU . 0.4 OUTLIER -154.79 139.72 17.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 1.0 111.015 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.555 ' O ' HG12 ' A' ' 132' ' ' VAL . 2.0 ttm180 -129.28 144.81 51.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.59 0.71 . . . . 1.0 109.485 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.811 ' H ' ' CD ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -79.27 150.43 31.54 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.314 -1.312 . . . . 1.0 109.083 178.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.468 ' C ' HD12 ' A' ' 171' ' ' ILE . 58.3 t -90.21 81.23 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.927 0.394 . . . . 1.0 111.375 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.468 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.1 mp . . . . . 0 C--N 1.329 -0.301 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.253 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.516 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.525 0.711 0 N-CA-C 110.534 -1.027 . . . . 1.0 110.534 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -171.11 111.32 0.35 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.107 -0.237 . . . . 1.0 110.734 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.441 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 171.18 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.173 0.511 . . . . 1.0 111.493 -178.854 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.46 HG22 ' CE1' ' A' ' 7' ' ' TYR . 31.0 m -128.16 120.34 27.11 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 177.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.5 mt -105.25 133.33 50.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.085 -0.961 . . . . 1.0 110.305 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.46 ' CE1' HG22 ' A' ' 5' ' ' THR . 73.5 m-85 -115.29 130.44 56.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.304 -178.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.453 ' O ' ' O ' ' A' ' 32' ' ' ARG . 84.0 tt0 -55.18 -24.22 25.82 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.643 -0.708 . . . . 1.0 110.244 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -124.94 161.81 25.83 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.302 0.572 . . . . 1.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 19.4 ptt180 -65.62 -173.81 0.17 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.47 -0.786 . . . . 1.0 111.048 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.8 25.25 0.57 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.815 -0.914 . . . . 1.0 110.815 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 51.6 67.85 0.89 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.648 -0.276 . . . . 1.0 110.312 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -129.64 -156.8 0.78 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.961 0.41 . . . . 1.0 110.523 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.43 -149.73 0.41 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -71.71 148.26 46.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.717 0.294 . . . . 1.0 110.577 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.98 149.72 48.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.391 0.615 . . . . 1.0 110.299 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.3 t80 -144.13 141.86 30.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.196 -0.911 . . . . 1.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.557 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.1 tt0 -110.57 121.38 45.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.467 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 t -108.85 126.01 52.6 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.943 0.401 . . . . 1.0 110.734 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 84.4 p -117.75 12.58 13.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.723 -0.672 . . . . 1.0 110.529 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -156.46 172.49 18.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.654 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -62.18 138.85 58.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.574 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.59 143.23 47.23 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.328 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.423 HG22 ' CE2' ' A' ' 51' ' ' TYR . 19.0 p -111.21 -17.41 13.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.774 -0.648 . . . . 1.0 112.067 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -150.53 112.16 4.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.145 0.498 . . . . 1.0 110.208 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.0 mt -108.84 2.39 21.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 43.7 mt-30 -52.05 -51.57 70.06 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.214 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.3 Cg_endo -55.96 -34.97 93.62 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.509 1.473 . . . . 1.0 112.789 -178.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -91.27 -45.91 8.35 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.183 0.516 . . . . 1.0 110.807 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.7 mt -122.66 129.06 51.42 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.509 -0.768 . . . . 1.0 111.305 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -92.4 -14.67 28.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 8' ' ' GLU . 62.2 ttp180 -176.47 119.69 0.14 Allowed 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 108.745 -0.835 . . . . 1.0 108.745 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -99.2 112.97 25.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.677 0.275 . . . . 1.0 110.598 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -105.0 -4.44 22.04 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.598 0.237 . . . . 1.0 110.473 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.6 p -157.1 157.78 35.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.91 0.386 . . . . 1.0 110.552 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 154.79 34.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.069 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -132.81 122.06 23.9 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 108.783 -0.821 . . . . 1.0 108.783 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.18 115.89 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.276 0.56 . . . . 1.0 110.028 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -77.58 -42.18 36.14 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.936 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.5 t -163.6 159.86 22.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 109.223 -0.658 . . . . 1.0 109.223 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.17 177.5 50.91 Favored Glycine 0 C--N 1.315 -0.623 0 N-CA-C 111.057 -0.817 . . . . 1.0 111.057 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.5 m -112.62 141.27 46.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.344 -0.613 . . . . 1.0 109.344 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.613 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 55.0 m95 -130.37 141.01 50.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.145 0.497 . . . . 1.0 110.903 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.549 ' C ' HD12 ' A' ' 45' ' ' LEU . 12.6 tpp -114.86 130.81 56.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.55 -0.75 . . . . 1.0 109.457 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.549 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -109.34 130.25 55.5 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.796 -0.638 . . . . 1.0 109.448 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.426 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 90.2 m-85 -109.71 133.42 53.15 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.429 0.633 . . . . 1.0 111.671 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.625 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.55 -35.57 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.259 -0.882 . . . . 1.0 111.402 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.8 mt-30 -109.42 152.83 42.92 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.562 -179.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.439 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 35.0 Cg_endo -63.59 158.68 44.58 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.446 2.097 . . . . 1.0 112.493 178.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.631 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.8 OUTLIER 63.84 37.03 9.97 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.937 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.426 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.2 m-85 50.06 76.12 0.15 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.306 -0.861 . . . . 1.0 111.108 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.6 m -144.04 153.12 41.87 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.009 0.433 . . . . 1.0 110.313 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 -148.63 21.77 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.053 -0.594 . . . . 1.0 111.88 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.625 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.8 tp -75.58 143.74 42.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.368 -0.416 . . . . 1.0 110.59 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.573 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.6 OUTLIER -120.18 153.25 36.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.581 0.229 . . . . 1.0 110.486 179.543 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.425 ' O ' ' SD ' ' A' ' 44' ' ' MET . 29.6 m-85 -126.45 124.63 40.58 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.932 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -83.8 122.51 28.77 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.178 0.513 . . . . 1.0 110.146 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 mp -119.85 145.36 46.73 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.636 -0.711 . . . . 1.0 109.973 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.642 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 68.4 mtm180 -132.26 158.57 41.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.541 -0.754 . . . . 1.0 109.949 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.413 ' C ' ' O ' ' A' ' 59' ' ' ARG . 61.6 ttp180 -36.1 126.48 0.75 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.032 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.61 -178.89 32.83 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.501 -1.039 . . . . 1.0 110.501 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -115.31 129.46 56.61 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.008 0.432 . . . . 1.0 110.154 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -123.53 113.04 18.2 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.996 -0.547 . . . . 1.0 109.538 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.89 -3.75 54.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.249 -0.432 . . . . 1.0 111.654 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -146.6 137.22 23.94 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.971 -0.751 . . . . 1.0 108.971 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.67 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 4.7 p80 -57.98 -41.64 83.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 1.0 110.694 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.63 -8.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.807 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 66' ' ' HIS . 22.8 mm-40 -81.57 -34.09 31.25 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.647 -0.421 . . . . 1.0 111.317 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.41 ' O ' ' HB2' ' A' ' 70' ' ' MET . 2.5 p90 -94.75 17.41 13.58 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.871 -0.331 . . . . 1.0 110.86 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.41 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 58.2 mtt 72.71 28.99 2.04 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 124.209 0.943 . . . . 1.0 110.128 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.401 ' HA2' ' CE1' ' A' ' 56' ' ' TYR . . . . . . . . 0 N--CA 1.444 -0.822 0 C-N-CA 120.667 -0.777 . . . . 1.0 111.599 -179.188 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.3 p . . . . . 0 N--CA 1.452 -0.348 0 N-CA-C 108.981 -0.748 . . . . 1.0 108.981 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.439 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.3 mtm-85 -123.23 12.29 9.51 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.003 -0.544 . . . . 1.0 111.468 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.1 p -163.38 163.13 25.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.182 0.515 . . . . 1.0 110.592 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.4 p -157.58 148.37 21.19 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.489 -0.778 . . . . 1.0 110.546 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -128.08 150.18 50.07 Favored 'General case' 0 CA--C 1.513 -0.442 0 N-CA-C 109.844 -0.428 . . . . 1.0 109.844 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.713 HD23 ' N ' ' A' ' 82' ' ' ILE . 3.7 tt -101.69 121.71 42.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.825 -1.176 . . . . 1.0 107.825 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.713 ' N ' HD23 ' A' ' 81' ' ' LEU . 7.2 mt -86.08 120.41 72.45 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.011 -178.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo . . . . . 0 N--CA 1.496 1.655 0 C-N-CA 121.598 1.532 . . . . 1.0 113.077 -179.844 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.7 p . . . . . 0 CA--C 1.515 -0.378 0 N-CA-C 109.881 -0.414 . . . . 1.0 109.881 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.6 m170 -127.58 102.48 6.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.895 0.332 . . . . 1.0 111.895 -179.336 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 57.1 mtt180 -136.06 138.21 41.9 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.669 -0.413 . . . . 1.0 110.598 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.429 HD12 HG22 ' A' ' 126' ' ' VAL . 19.3 tt -148.44 144.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-N 116.483 -0.326 . . . . 1.0 110.847 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -122.87 97.91 5.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.367 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.47 139.8 39.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.449 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -120.17 135.76 54.86 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.892 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.51 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.42 -62.36 1.77 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.817 -0.629 . . . . 1.0 111.239 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 34.7 mtt-85 -99.18 165.25 11.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.278 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 . . . . . 0 CA--C 1.511 -0.551 0 CA-C-N 115.648 -0.705 . . . . 1.0 110.06 178.806 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.321 0 N-CA-C 110.393 -1.083 . . . . 1.0 110.393 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -66.2 140.23 58.16 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.535 -0.466 . . . . 1.0 110.235 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.8 ptm -132.26 154.19 49.89 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.122 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tt -148.16 140.6 18.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.436 -0.579 . . . . 1.0 109.436 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.53 143.04 44.37 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.717 0.77 . . . . 1.0 110.68 -179.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.832 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 88.0 m-85 -129.38 154.25 47.09 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 114.764 -1.107 . . . . 1.0 110.472 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.24 22.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.541 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.61 -170.66 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.625 -0.43 . . . . 1.0 110.552 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 54.5 p-10 -77.91 144.15 37.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.741 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.8 m -137.0 93.1 2.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.09 -31.21 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.034 0.445 . . . . 1.0 111.086 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.7 m -136.82 90.3 2.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.408 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.832 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.9 tp -60.48 -39.84 89.13 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.19 -178.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.627 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 18.4 mp0 -43.69 -9.19 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.147 -0.479 . . . . 1.0 112.268 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.8 t0 -94.69 -22.07 18.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.163 0.506 . . . . 1.0 110.215 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 112' ' ' LEU . 82.5 mmt-85 -107.93 -37.14 6.17 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.446 -0.797 . . . . 1.0 112.821 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.664 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.67 136.84 54.73 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 122.51 1.148 . . . . 1.0 110.752 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.444 ' O ' ' C ' ' A' ' 118' ' ' PHE . 71.1 mtp180 -72.55 -71.46 0.29 Allowed 'General case' 0 C--N 1.315 -0.933 0 O-C-N 120.718 -1.239 . . . . 1.0 110.684 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.608 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.1 m-85 -34.61 146.4 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.631 . . . . 1.0 110.31 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -105.14 8.02 33.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.796 0.332 . . . . 1.0 110.713 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -139.02 142.27 38.28 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.238 0.542 . . . . 1.0 110.816 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.71 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.5 mm -121.3 123.2 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 115.566 -0.743 . . . . 1.0 109.267 178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.404 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 19.6 m-70 -112.14 24.54 12.49 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.501 -0.318 . . . . 1.0 111.634 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 1.6 p 166.28 150.54 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.074 0.464 . . . . 1.0 109.94 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.477 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 0.9 OUTLIER -161.29 156.94 24.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.286 -178.78 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.76 115.7 22.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.429 HG22 HD12 ' A' ' 90' ' ' ILE . 24.4 t -100.56 105.18 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.111 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.885 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.21 -44.39 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 1.0 110.774 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -159.1 158.56 33.18 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.747 0.308 . . . . 1.0 110.861 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.54 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.16 73.84 0.68 Allowed Glycine 0 CA--C 1.508 -0.348 0 C-N-CA 121.45 -0.405 . . . . 1.0 112.38 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 129' ' ' GLY . 8.1 t -31.87 146.78 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.899 0.381 . . . . 1.0 110.596 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.54 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 30.8 m95 -122.1 169.23 11.07 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.075 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.3 p -141.47 96.86 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 121.017 0.437 . . . . 1.0 110.756 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.4 mt -68.04 142.01 56.01 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.04 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -118.15 130.75 56.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.785 -0.643 . . . . 1.0 109.98 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -44.25 -48.61 9.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.999 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.68 175.28 6.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.442 0.639 . . . . 1.0 110.57 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.8 m -81.45 172.35 13.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.522 -0.763 . . . . 1.0 110.817 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 63.0 t30 64.04 17.24 10.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 37.01 78.88 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.952 -0.567 . . . . 1.0 111.665 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.43 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 49.6 ttp180 -148.52 39.7 0.9 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.12 0.486 . . . . 1.0 110.302 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.448 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -152.83 -137.67 2.57 Favored Glycine 0 N--CA 1.465 0.571 0 N-CA-C 111.157 -0.777 . . . . 1.0 111.157 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -80.27 167.81 19.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.102 0.477 . . . . 1.0 110.308 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.573 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -146.58 141.97 27.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.544 -0.753 . . . . 1.0 111.11 -179.08 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 9.0 m-85 -130.76 142.27 50.4 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.341 -0.985 . . . . 1.0 108.341 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.57 ' C ' HD22 ' A' ' 146' ' ' LEU . 46.2 tp -94.84 124.2 38.74 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.169 0.509 . . . . 1.0 111.329 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.846 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.7 88.94 2.96 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.529 -0.76 . . . . 1.0 108.951 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 4.5 mtm -70.82 162.66 70.39 Favored Pre-proline 0 CA--C 1.531 0.246 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.22 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.23 116.69 3.22 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 121.621 1.547 . . . . 1.0 111.221 178.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.88 -157.46 22.61 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 110.698 -0.961 . . . . 1.0 110.698 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -128.04 114.52 17.18 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.04 0.447 . . . . 1.0 110.519 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 31.2 m-85 -106.01 130.69 53.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 1.0 109.954 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -116.12 -0.69 12.63 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.792 0.329 . . . . 1.0 110.491 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.686 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.2 ptm180 -158.97 165.7 33.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.362 0.601 . . . . 1.0 110.484 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.413 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -77.19 -23.14 51.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.295 -0.866 . . . . 1.0 112.615 -178.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.686 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.9 mt-30 -67.53 -20.36 65.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.447 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -49.97 -48.72 52.06 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.381 -0.372 . . . . 1.0 110.808 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.679 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 23.1 p90 -96.6 20.96 9.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.09 -0.504 . . . . 1.0 110.573 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.59 74.78 0.27 Allowed Glycine 0 CA--C 1.521 0.446 0 N-CA-C 111.204 -0.758 . . . . 1.0 111.204 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.679 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.1 148.53 42.94 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.257 0.551 . . . . 1.0 110.377 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.6 t -77.76 -10.86 59.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.969 -1.014 . . . . 1.0 110.356 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.518 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 32.6 t-20 -171.76 -169.02 0.64 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.45 -0.5 . . . . 1.0 110.366 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.71 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -109.12 -8.69 15.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.625 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -44.3 116.25 0.99 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.891 0.377 . . . . 1.0 111.772 -178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 162' ' ' ALA . 36.8 t -128.31 131.25 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.814 -0.63 . . . . 1.0 109.677 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.438 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -108.65 -28.42 4.55 Favored Glycine 0 N--CA 1.463 0.443 0 N-CA-C 111.694 -0.562 . . . . 1.0 111.694 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.8 p -160.74 -168.58 2.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.704 0.288 . . . . 1.0 110.514 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.604 HD21 HD13 ' A' ' 112' ' ' LEU . 1.8 pp -173.06 137.1 0.69 Allowed 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.532 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.642 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 1.3 ttm180 -131.04 149.77 52.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.559 0.695 . . . . 1.0 109.706 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.598 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -81.87 155.97 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.951 -1.022 . . . . 1.0 109.953 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.685 ' C ' HD12 ' A' ' 171' ' ' ILE . 45.9 t -93.29 79.39 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.879 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.685 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.5 mp . . . . . 0 N--CA 1.464 0.256 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.654 179.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.566 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -174.1 101.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.925 -0.31 . . . . 1.0 110.56 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.404 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -120.2 168.78 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 CA-C-N 116.47 -0.332 . . . . 1.0 110.533 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.486 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.6 m -127.44 122.17 32.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 176.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.7 mt -104.79 132.7 50.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.328 -0.851 . . . . 1.0 110.438 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.486 ' CE1' HG22 ' A' ' 5' ' ' THR . 49.8 m-85 -114.82 126.87 55.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.373 -0.83 . . . . 1.0 110.863 -178.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.512 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.2 tt0 -54.49 -32.23 57.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.597 -0.728 . . . . 1.0 110.72 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -115.22 152.16 33.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.217 0.532 . . . . 1.0 110.262 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 12' ' ' PHE . 19.3 ptt-85 -56.83 -171.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.393 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.63 23.97 0.07 OUTLIER Glycine 0 N--CA 1.46 0.292 0 N-CA-C 111.135 -0.786 . . . . 1.0 111.135 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 10' ' ' ARG . 11.8 m-85 52.64 69.02 0.74 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.47 -0.365 . . . . 1.0 110.213 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -129.76 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.917 0.389 . . . . 1.0 110.473 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.33 -151.22 0.11 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.03 -0.828 . . . . 1.0 111.03 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.512 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.6 mtm180 -68.73 146.61 52.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.771 0.32 . . . . 1.0 110.755 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -136.49 143.88 44.04 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.155 0.502 . . . . 1.0 110.261 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE1' ' O ' ' A' ' 18' ' ' GLU . 11.3 t80 -137.39 141.52 41.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.293 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.445 ' O ' ' CE1' ' A' ' 17' ' ' TYR . 19.5 tt0 -110.33 127.84 55.25 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.403 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -115.45 127.11 55.1 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.607 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -118.41 10.31 12.67 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.894 -0.594 . . . . 1.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.0 m -156.45 169.97 23.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 1.0 110.745 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -59.42 137.49 57.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.947 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.58 150.1 51.64 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.774 -0.648 . . . . 1.0 109.924 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.5 p -119.65 -16.8 8.77 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.524 -0.762 . . . . 1.0 112.131 -178.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.491 ' OD1' ' NE2' ' A' ' 27' ' ' GLN . 15.2 t30 -144.75 111.04 5.56 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.912 0.387 . . . . 1.0 110.188 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.1 mt -117.73 -5.72 11.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.866 -0.606 . . . . 1.0 110.58 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.64 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -45.1 -53.13 17.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.263 179.202 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.64 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 12.8 Cg_endo -54.17 -29.99 58.94 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 C-N-CA 122.078 1.852 . . . . 1.0 111.96 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.49 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -95.17 -51.44 4.62 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 120.751 -0.38 . . . . 1.0 110.43 -178.738 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.6 126.8 52.07 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.5 t -95.89 -11.61 26.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.909 -0.587 . . . . 1.0 111.491 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 26.2 mmt180 -142.22 -53.12 0.42 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.612 -178.242 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . 0.464 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 20.3 t 55.97 67.84 0.95 Allowed 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 1.0 109.885 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -89.05 4.54 47.99 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.161 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.2 p -154.85 157.63 38.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.088 -0.338 . . . . 1.0 110.088 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.56 155.51 36.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.858 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.4 mtp85 -135.21 122.77 22.06 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.802 -0.814 . . . . 1.0 108.802 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.5 t -108.26 133.11 54.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.153 0.501 . . . . 1.0 110.133 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.64 -39.5 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.419 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 96.3 p -162.96 155.72 19.03 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 176.06 49.7 Favored Glycine 0 CA--C 1.522 0.474 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.0 m -111.26 147.53 34.86 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.706 -0.479 . . . . 1.0 109.706 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.47 ' CE2' HD13 ' A' ' 81' ' ' LEU . 56.5 m95 -132.1 150.86 52.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.81 -0.632 . . . . 1.0 111.246 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.627 ' C ' HD23 ' A' ' 45' ' ' LEU . 21.4 tpp -127.38 129.58 47.84 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.881 -0.785 . . . . 1.0 108.881 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.627 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -110.15 137.82 47.37 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.105 -0.498 . . . . 1.0 109.757 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -112.73 129.95 56.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.955 0.407 . . . . 1.0 110.554 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 3.2 pt-20 -54.55 -33.93 60.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.791 -0.64 . . . . 1.0 110.295 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -105.7 154.32 39.35 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.174 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -55.43 150.37 42.47 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.23 1.954 . . . . 1.0 111.212 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.848 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER 78.61 -120.2 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 124.035 0.834 . . . . 1.0 109.103 -178.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.57 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 13.1 m-85 -141.98 79.06 1.65 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.665 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.9 t -152.73 166.22 32.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.825 -0.435 . . . . 1.0 109.825 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.15 -150.07 31.66 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.289 -0.725 . . . . 1.0 111.289 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.631 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.5 tp -78.73 142.78 36.77 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.255 -0.276 . . . . 1.0 110.255 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.15 150.41 41.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.297 -0.26 . . . . 1.0 110.297 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.503 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.1 m-85 -127.5 127.04 43.34 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.389 -0.369 . . . . 1.0 110.732 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.488 ' C ' HD22 ' A' ' 58' ' ' LEU . 41.8 t80 -82.83 122.96 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.392 0.615 . . . . 1.0 109.719 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.488 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.2 mm? -109.71 136.09 49.6 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.136 -0.938 . . . . 1.0 110.343 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 60' ' ' ARG . 38.5 mtm-85 -127.0 149.14 50.03 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.15 -0.932 . . . . 1.0 109.856 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.422 ' C ' ' O ' ' A' ' 59' ' ' ARG . 27.4 ptt180 -34.44 126.93 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.985 -0.552 . . . . 1.0 111.389 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 153.36 -177.38 30.97 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.637 -0.985 . . . . 1.0 110.637 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -115.31 130.81 57.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.869 0.366 . . . . 1.0 110.195 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.89 112.11 16.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 1.0 109.536 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.437 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -89.59 -4.45 57.84 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.827 -0.624 . . . . 1.0 110.991 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 83.2 m-20 -147.3 148.44 31.41 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.723 -0.473 . . . . 1.0 109.723 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.536 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.2 p-80 -67.66 -42.53 82.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.019 0.437 . . . . 1.0 111.338 -179.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.523 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 4.6 pt20 -50.79 -8.58 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.734 -0.666 . . . . 1.0 110.519 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.536 ' H ' ' C ' ' A' ' 66' ' ' HIS . 24.9 mm-40 -82.42 -33.35 28.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.355 -0.384 . . . . 1.0 111.256 -177.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.518 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -98.1 21.72 10.41 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 119.27 -0.395 . . . . 1.0 110.907 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.455 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 57.6 mtp 80.46 10.48 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.58 0.55 . . . . 1.0 110.256 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.42 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.339 0.704 0 N-CA-C 111.096 -0.801 . . . . 1.0 111.096 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.469 0.488 0 N-CA-C 109.884 -0.413 . . . . 1.0 109.884 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -122.68 7.62 9.44 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.553 -0.294 . . . . 1.0 111.092 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.434 ' HB3' ' H ' ' A' ' 50' ' ' ASN . 9.7 p -163.76 161.78 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.428 . . . . 1.0 110.653 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.7 p -154.81 146.05 22.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.026 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.2 ptm180 -127.61 146.66 50.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.102 -0.333 . . . . 1.0 110.102 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.47 HD13 ' CE2' ' A' ' 43' ' ' TRP . 29.8 tp -96.19 130.0 43.37 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.494 -0.558 . . . . 1.0 109.494 178.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.403 ' H ' HD12 ' A' ' 81' ' ' LEU . 3.2 mt -92.05 114.56 62.5 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.017 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo . . . . . 0 N--CA 1.497 1.678 0 C-N-CA 122.439 2.093 . . . . 1.0 112.776 179.892 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m . . . . . 0 CA--C 1.522 -0.118 0 N-CA-C 109.787 -0.449 . . . . 1.0 109.787 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.474 ' CD2' HD11 ' A' ' 171' ' ' ILE . 9.6 m80 -132.43 121.78 23.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.548 -0.296 . . . . 1.0 111.032 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -147.92 136.59 21.77 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 1.0 110.288 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 126' ' ' VAL . 20.6 tt -150.94 149.92 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.517 -0.311 . . . . 1.0 110.535 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -130.09 100.55 5.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.389 0.614 . . . . 1.0 111.445 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.2 mt -77.44 139.43 39.66 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.645 -0.707 . . . . 1.0 110.301 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.603 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 54.6 m-85 -115.27 139.28 50.1 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.603 0.716 . . . . 1.0 111.138 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.509 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.6 OUTLIER -59.27 -63.54 1.27 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.395 -0.821 . . . . 1.0 111.512 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.5 mmm-85 -96.07 174.09 7.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.113 0.482 . . . . 1.0 110.955 -178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 115.547 -0.751 . . . . 1.0 110.988 -179.714 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.323 0 N-CA-C 111.527 -0.629 . . . . 1.0 111.527 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -61.4 146.6 47.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.374 . . . . 1.0 110.398 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.603 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 5.9 ttp -133.36 149.1 51.87 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.82 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.458 HG21 ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -141.19 142.46 29.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 109.8 -0.444 . . . . 1.0 109.8 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -112.38 136.71 51.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.417 0.627 . . . . 1.0 110.647 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.55 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 82.3 m-85 -122.41 156.13 34.65 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.844 -1.071 . . . . 1.0 110.256 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -142.82 13.03 1.88 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.396 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -156.33 -168.69 2.8 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 120.616 -0.434 . . . . 1.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -76.63 145.16 39.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.42 . . . . 1.0 110.801 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.453 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 13.5 m -133.47 93.2 3.11 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.04 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 78.2 p -67.75 -28.29 67.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.319 -0.401 . . . . 1.0 111.247 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.2 t -138.26 97.05 3.29 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.328 0.585 . . . . 1.0 111.174 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.55 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 3.5 mt -63.82 -40.49 96.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.172 -0.922 . . . . 1.0 110.505 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.452 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 25.9 mm-40 -46.21 -11.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.896 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 112' ' ' LEU . 38.5 t70 -96.21 -25.83 15.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.804 0.335 . . . . 1.0 110.547 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.3 mmt180 -110.31 -41.05 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 1.0 111.546 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.489 ' CB ' HD22 ' A' ' 112' ' ' LEU . 5.1 t80 -122.41 116.68 24.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.15 0.5 . . . . 1.0 110.408 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 118' ' ' PHE . 23.5 mmm180 -56.67 -67.81 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.444 -0.798 . . . . 1.0 111.16 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.509 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 80.0 m-85 -38.08 139.98 0.31 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.51 -0.313 . . . . 1.0 110.304 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.452 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 81.2 m-20 -100.43 2.84 42.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.914 -178.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -132.76 142.27 48.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.191 0.52 . . . . 1.0 111.151 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.8 mm -122.92 120.64 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 CA-C-N 115.518 -0.765 . . . . 1.0 109.52 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.456 ' O ' ' CB ' ' A' ' 123' ' ' SER . 30.7 m-70 -110.94 28.48 8.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 1.0 111.514 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.456 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.7 t 162.27 151.06 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 120.986 0.422 . . . . 1.0 110.695 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.439 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.3 pp -163.73 158.79 20.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.573 -0.74 . . . . 1.0 110.371 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . 0.518 HD22 HD11 ' A' ' 127' ' ' LEU . 3.2 t30 -126.33 119.1 26.49 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.848 -0.427 . . . . 1.0 109.848 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.411 HG22 HD12 ' A' ' 90' ' ' ILE . 26.5 t -100.9 105.42 17.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 109.722 -0.473 . . . . 1.0 109.722 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.931 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.69 -41.67 30.53 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.634 -0.712 . . . . 1.0 111.263 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -140.34 146.29 38.26 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.976 0.417 . . . . 1.0 110.87 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 61.21 -175.39 5.46 Favored Glycine 0 CA--C 1.518 0.242 0 N-CA-C 111.183 -0.767 . . . . 1.0 111.183 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.4 t -117.65 154.38 31.7 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.655 -0.498 . . . . 1.0 109.655 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.3 m95 -127.64 160.21 32.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.808 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 65.7 t -132.26 135.38 58.17 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 N-CA-C 109.659 -0.497 . . . . 1.0 109.659 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.517 ' HG ' HD11 ' A' ' 146' ' ' LEU . 23.5 mt -107.77 143.29 36.52 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.238 -0.282 . . . . 1.0 110.238 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -118.79 133.07 56.1 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.755 0.312 . . . . 1.0 110.629 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -43.27 -52.23 5.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.958 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.592 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -121.99 172.3 8.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.176 0.513 . . . . 1.0 110.181 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.7 m -75.56 170.05 16.9 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.529 -0.76 . . . . 1.0 110.918 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 62.0 t30 66.37 16.94 10.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.279 -0.873 . . . . 1.0 109.982 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.478 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 1.4 m-85 38.55 80.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 1.0 111.679 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.53 ' C ' HD11 ' A' ' 136' ' ' LEU . 51.3 ttp180 -149.48 42.11 0.89 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.983 0.421 . . . . 1.0 109.904 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.44 -135.11 2.17 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 111.309 -0.716 . . . . 1.0 111.309 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -82.98 168.54 16.9 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.962 -0.384 . . . . 1.0 109.962 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.38 137.82 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.116 -0.493 . . . . 1.0 110.919 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -128.22 132.11 48.8 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.162 -0.681 . . . . 1.0 109.162 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.8 OUTLIER -87.53 126.65 35.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.083 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.623 ' N ' HD23 ' A' ' 145' ' ' LEU . 21.8 mt -115.43 99.9 7.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.993 -0.549 . . . . 1.0 109.599 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.451 ' HE2' HD22 ' A' ' 145' ' ' LEU . 5.2 mtm -81.94 156.77 69.66 Favored Pre-proline 0 C--N 1.327 -0.373 0 C-N-CA 120.704 -0.398 . . . . 1.0 110.604 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.39 120.33 3.13 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 C-N-CA 122.081 1.854 . . . . 1.0 111.569 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.54 -154.81 24.9 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.431 -1.068 . . . . 1.0 110.431 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -127.02 135.98 51.59 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.835 0.35 . . . . 1.0 110.458 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.518 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 11.9 m-85 -126.87 130.97 51.21 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.754 -0.461 . . . . 1.0 109.754 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -119.39 -0.37 10.94 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.747 0.308 . . . . 1.0 110.589 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -158.15 163.11 37.9 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 121.173 0.511 . . . . 1.0 109.947 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.627 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -76.19 -18.48 59.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.354 -0.839 . . . . 1.0 111.918 -178.436 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.572 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -67.62 -21.68 65.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 1.0 110.712 -179.028 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -50.27 -48.42 54.86 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.614 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.731 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 21.7 p90 -102.27 19.41 18.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 1.0 110.562 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 76.67 0.16 Allowed Glycine 0 CA--C 1.52 0.354 0 N-CA-C 111.272 -0.731 . . . . 1.0 111.272 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.731 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -94.12 -169.75 2.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.037 0.446 . . . . 1.0 110.115 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 1.2 t -123.49 -36.31 2.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.542 -0.754 . . . . 1.0 111.776 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.659 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.2 OUTLIER -145.64 -24.1 0.47 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 1.0 111.61 -178.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 93.23 0.8 0.09 Allowed 'General case' 0 N--CA 1.465 0.305 0 O-C-N 124.031 0.832 . . . . 1.0 110.68 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -67.98 116.07 8.22 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.849 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.2 125.28 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.115 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -102.07 -24.59 8.41 Favored Glycine 0 N--CA 1.464 0.503 0 N-CA-C 111.507 -0.637 . . . . 1.0 111.507 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.9 p -161.51 171.21 18.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.88 0.371 . . . . 1.0 110.68 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.73 148.5 24.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.98 -0.555 . . . . 1.0 111.617 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.478 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 15.4 ptp180 -138.17 154.2 49.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.363 . . . . 1.0 110.094 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -86.66 155.94 20.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.043 -0.526 . . . . 1.0 110.053 178.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.07 85.62 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 1.0 111.191 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.474 HD11 ' CD2' ' A' ' 88' ' ' HIS . 3.5 mp . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.034 -0.53 . . . . 1.0 110.436 179.341 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.532 0 N-CA-C 110.694 -0.963 . . . . 1.0 110.694 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.9 tttt -172.91 106.24 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.891 -0.324 . . . . 1.0 110.321 179.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.26 168.48 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 116.468 -0.333 . . . . 1.0 110.595 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.491 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.0 m -127.63 121.72 31.23 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 177.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.8 mt -105.67 132.97 51.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.047 -0.979 . . . . 1.0 110.262 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.491 ' CE1' HG22 ' A' ' 5' ' ' THR . 49.9 m-85 -115.06 127.26 55.51 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.307 -0.86 . . . . 1.0 110.909 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.426 ' OE1' ' OD1' ' A' ' 9' ' ' ASP . 6.9 tm-20 -53.94 -32.86 55.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.557 -0.747 . . . . 1.0 110.588 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . 0.426 ' OD1' ' OE1' ' A' ' 8' ' ' GLU . 90.4 m-20 -115.74 152.14 33.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.292 0.568 . . . . 1.0 110.292 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.44 ' C ' ' N ' ' A' ' 12' ' ' PHE . 32.5 ptt85 -57.04 -172.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.494 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.81 22.65 0.3 Allowed Glycine 0 CA--C 1.517 0.207 0 N-CA-C 110.918 -0.873 . . . . 1.0 110.918 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.44 ' N ' ' C ' ' A' ' 10' ' ' ARG . 10.3 m-85 53.23 67.37 1.01 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.26 -0.274 . . . . 1.0 110.26 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' A' ' 12' ' ' PHE . 10.9 mm100 -129.8 -158.65 0.9 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.138 0.494 . . . . 1.0 110.594 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.67 -149.97 0.67 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -70.83 147.13 49.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.681 0.277 . . . . 1.0 110.701 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -136.49 146.6 46.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.187 0.518 . . . . 1.0 110.299 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -139.63 141.43 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.383 -0.826 . . . . 1.0 109.978 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 62.1 tt0 -111.07 122.92 49.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.336 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.6 126.83 54.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.464 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.3 p -117.43 10.29 13.55 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.345 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.8 m -156.88 169.02 25.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.732 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.8 139.68 56.03 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.639 -0.709 . . . . 1.0 111.244 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.61 155.33 49.3 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.64 -0.709 . . . . 1.0 110.409 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -123.66 -15.03 7.14 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.382 -0.826 . . . . 1.0 112.326 -179.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -138.08 112.97 9.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.954 0.406 . . . . 1.0 110.408 -178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 mp -115.95 -9.74 11.73 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.063 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.613 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -48.61 -52.53 43.84 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.46 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 16.8 Cg_endo -55.39 -33.69 86.46 Favored 'Trans proline' 0 C--N 1.316 -1.181 0 C-N-CA 121.848 1.699 . . . . 1.0 112.103 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -95.0 -49.43 5.55 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 120.388 -0.525 . . . . 1.0 110.68 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 mt -121.66 126.32 48.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.668 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 t -95.01 -12.85 25.92 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.909 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -143.39 -51.17 0.34 Allowed 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 116.167 -0.469 . . . . 1.0 111.737 -178.099 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.5 t 56.88 78.5 0.22 Allowed 'General case' 0 C--N 1.314 -0.955 0 O-C-N 122.134 -0.354 . . . . 1.0 110.099 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 34.2 m-20 -95.19 5.69 51.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.294 -178.703 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.6 p -158.13 158.32 34.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 1.0 110.254 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.79 154.3 32.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.942 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.9 mtp85 -133.05 121.95 23.45 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.598 -0.89 . . . . 1.0 108.598 178.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.8 133.19 53.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.627 -0.509 . . . . 1.0 109.627 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.59 -43.94 7.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.744 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.2 t -160.82 154.09 21.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.95 177.59 50.99 Favored Glycine 0 C--N 1.317 -0.5 0 N-CA-C 111.194 -0.762 . . . . 1.0 111.194 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.1 m -112.16 134.05 53.93 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.589 -0.522 . . . . 1.0 109.589 178.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.45 ' CE2' HD13 ' A' ' 81' ' ' LEU . 58.4 m95 -121.96 142.41 50.33 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.017 -0.538 . . . . 1.0 111.179 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.69 ' C ' HD23 ' A' ' 45' ' ' LEU . 10.4 tpp -120.15 130.29 54.53 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.546 -0.752 . . . . 1.0 109.172 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.69 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -111.49 138.96 47.33 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.084 -0.507 . . . . 1.0 109.808 -178.823 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -111.58 130.99 55.57 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.322 0.582 . . . . 1.0 110.979 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 54' ' ' LEU . 16.0 pt-20 -55.39 -30.7 60.88 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.12 -0.945 . . . . 1.0 110.532 -178.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.613 HE21 ' CA ' ' A' ' 53' ' ' GLY . 15.0 pt20 -114.87 156.29 45.25 Favored Pre-proline 0 N--CA 1.465 0.297 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.492 ' C ' HD22 ' A' ' 50' ' ' ASN . 14.4 Cg_endo -52.94 152.38 17.96 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 121.753 1.635 . . . . 1.0 111.911 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.766 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER 70.32 -120.48 0.11 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.747 -1.115 . . . . 1.0 109.313 -178.448 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER -153.64 76.28 1.08 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.648 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.545 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 30.7 t -143.29 16.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.541 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . 0.613 ' CA ' HE21 ' A' ' 48' ' ' GLN . . . -133.11 -168.93 12.05 Favored Glycine 0 N--CA 1.464 0.549 0 N-CA-C 111.33 -0.708 . . . . 1.0 111.33 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' A' ' 54' ' ' LEU . 48.4 tp -55.34 145.54 21.82 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 109.522 -0.547 . . . . 1.0 109.522 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -122.33 152.49 40.07 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.903 0.383 . . . . 1.0 110.624 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.48 ' C ' ' SD ' ' A' ' 44' ' ' MET . 6.0 m-85 -130.52 125.92 35.52 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.945 -0.57 . . . . 1.0 110.731 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -84.15 123.93 30.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.885 -0.598 . . . . 1.0 110.26 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.0 mp -121.26 145.91 47.37 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.582 -0.735 . . . . 1.0 110.686 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.406 ' O ' ' C ' ' A' ' 60' ' ' ARG . 43.8 mtp180 -132.51 158.66 41.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.293 179.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 59' ' ' ARG . 40.5 ptt180 -35.14 127.56 0.54 Allowed 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.701 -0.681 . . . . 1.0 111.116 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.79 -178.3 30.0 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 110.873 -0.891 . . . . 1.0 110.873 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.442 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.5 p-10 -116.92 128.01 54.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.08 0.467 . . . . 1.0 110.435 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -120.46 112.72 19.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 1.0 109.6 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.86 -3.71 57.15 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.283 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -148.28 141.34 24.93 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.49 -0.559 . . . . 1.0 109.49 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.494 ' C ' ' H ' ' A' ' 68' ' ' GLN . 25.6 p-80 -62.57 -40.1 95.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.096 0.474 . . . . 1.0 111.166 -179.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -54.56 -6.78 0.12 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.355 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -84.5 -34.65 23.31 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.779 -0.368 . . . . 1.0 111.363 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -95.1 18.42 12.21 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 119.225 -0.417 . . . . 1.0 111.063 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 39.9 mtt 82.37 12.92 0.54 Allowed 'General case' 0 N--CA 1.463 0.225 0 O-C-N 123.884 0.74 . . . . 1.0 110.128 -178.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.416 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.343 0.926 0 C-N-CA 120.526 -0.845 . . . . 1.0 111.311 179.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.471 0.575 0 N-CA-C 110.362 -0.236 . . . . 1.0 110.362 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -126.09 8.51 7.33 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.742 0.306 . . . . 1.0 110.928 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 p -163.45 161.21 24.14 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.144 0.497 . . . . 1.0 110.789 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 27.4 p -154.75 146.98 23.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.456 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.7 ptm180 -127.84 148.01 50.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.224 -0.288 . . . . 1.0 110.224 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.45 HD13 ' CE2' ' A' ' 43' ' ' TRP . 19.9 tp -98.64 127.3 44.52 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.858 -0.793 . . . . 1.0 108.858 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.436 ' N ' HD12 ' A' ' 81' ' ' LEU . 2.8 mt -93.16 120.49 66.8 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.189 -0.459 . . . . 1.0 109.827 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo . . . . . 0 N--CA 1.495 1.591 0 C-N-CA 122.145 1.897 . . . . 1.0 112.884 179.671 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 N--CA 1.462 0.135 0 N-CA-C 109.752 -0.462 . . . . 1.0 109.752 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.773 ' CD2' HD11 ' A' ' 171' ' ' ILE . 5.8 m-70 -132.52 128.43 37.3 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.887 0.375 . . . . 1.0 110.926 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -155.1 133.91 12.11 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.679 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.567 HD12 HG22 ' A' ' 126' ' ' VAL . 16.6 tt -146.21 150.12 15.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.442 -0.344 . . . . 1.0 110.754 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.4 98.28 5.0 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.25 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.24 137.63 38.22 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.326 0.584 . . . . 1.0 111.43 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.45 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 56.9 m-85 -111.93 134.42 53.49 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 115.11 -0.95 . . . . 1.0 110.841 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.466 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.9 tm-20 -52.98 -56.93 12.35 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.511 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -104.1 171.5 7.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.564 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.63 -0.714 . . . . 1.0 110.311 179.088 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.526 0.762 0 N-CA-C 111.407 -0.677 . . . . 1.0 111.407 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -58.31 146.83 32.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.988 -0.375 . . . . 1.0 109.988 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.47 ' HG2' ' N ' ' A' ' 103' ' ' ILE . 11.7 ttp -131.54 153.06 50.22 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.897 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.483 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.9 tt -146.51 142.12 20.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.5 -0.556 . . . . 1.0 109.5 177.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -112.54 143.41 43.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.47 0.653 . . . . 1.0 110.427 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -129.52 156.96 43.31 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 114.814 -1.084 . . . . 1.0 110.567 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.6 p -143.73 15.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.433 -0.803 . . . . 1.0 110.592 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.413 ' C ' ' NE ' ' A' ' 169' ' ' ARG . 16.8 pt-20 -156.6 -168.55 2.73 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.202 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.631 ' N ' ' NE ' ' A' ' 169' ' ' ARG . 49.1 p30 -79.87 147.98 31.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.805 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.408 ' O ' ' OG ' ' A' ' 166' ' ' SER . 2.2 t -138.03 93.95 2.83 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.013 -0.54 . . . . 1.0 109.996 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.3 p -65.04 -22.28 66.96 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.809 -0.357 . . . . 1.0 111.209 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 16.4 t -140.56 94.23 2.71 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.311 0.577 . . . . 1.0 110.618 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.534 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.0 tp -62.62 -43.5 98.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.342 -0.845 . . . . 1.0 110.299 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.679 ' NE2' HD22 ' A' ' 119' ' ' ASN . 22.5 mp0 -48.93 -7.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.925 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.534 ' H ' ' C ' ' A' ' 112' ' ' LEU . 45.7 t0 -94.88 -26.49 16.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.945 0.402 . . . . 1.0 110.346 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.8 mmt180 -108.31 -34.46 6.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.191 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.483 ' CD1' HG21 ' A' ' 103' ' ' ILE . 5.3 t80 -124.23 118.48 26.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.12 0.486 . . . . 1.0 109.871 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -54.51 -67.62 0.25 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.529 -0.76 . . . . 1.0 111.12 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.466 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 92.6 m-85 -40.14 141.66 0.45 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.233 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.679 HD22 ' NE2' ' A' ' 113' ' ' GLN . 19.1 t-20 -102.22 2.32 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.809 0.338 . . . . 1.0 111.35 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -130.24 138.86 50.76 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.219 0.533 . . . . 1.0 111.045 -178.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.717 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 37.4 mm -122.2 125.9 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 CA-C-N 115.303 -0.862 . . . . 1.0 109.358 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.5 m-70 -114.06 17.57 17.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.473 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.584 ' C ' HD13 ' A' ' 124' ' ' LEU . 3.2 m 170.5 156.08 0.06 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.997 0.427 . . . . 1.0 110.965 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.684 HD11 ' CZ3' ' A' ' 157' ' ' TRP . 0.0 OUTLIER -160.11 162.08 33.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.818 179.466 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.57 112.31 16.04 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.045 -0.724 . . . . 1.0 109.045 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.567 HG22 HD12 ' A' ' 90' ' ' ILE . 40.4 t -101.72 103.95 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.634 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.932 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.55 -37.45 36.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.75 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 129' ' ' GLY . 31.1 tp10 -138.87 158.34 44.39 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.875 0.369 . . . . 1.0 110.416 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.433 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.08 -173.2 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 111.078 -0.809 . . . . 1.0 111.078 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.497 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.7 OUTLIER -115.71 176.18 5.2 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.384 -0.598 . . . . 1.0 109.384 179.545 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.497 ' CD1' ' C ' ' A' ' 130' ' ' SER . 67.3 m95 -147.12 161.1 41.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.694 -0.684 . . . . 1.0 110.346 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 60.1 t -132.05 134.01 60.13 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 116.058 -0.519 . . . . 1.0 109.771 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.48 143.53 37.32 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . 0.536 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 13.6 m-85 -119.43 131.9 55.72 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.041 0.448 . . . . 1.0 110.306 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -47.69 -23.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.945 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.479 ' C ' HD12 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -147.75 179.67 7.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.061 0.458 . . . . 1.0 110.199 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.5 p -84.8 170.58 13.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.023 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . 0.642 ' ND2' ' HE ' ' A' ' 140' ' ' ARG . 57.5 t30 66.01 16.37 10.44 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.049 -0.978 . . . . 1.0 110.262 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.545 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 5.1 m-85 40.37 78.66 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.801 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.642 ' HE ' ' ND2' ' A' ' 138' ' ' ASN . 90.9 mtt-85 -147.94 37.38 0.87 Allowed 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 120.905 0.383 . . . . 1.0 110.658 179.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.456 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -148.3 -145.64 4.19 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.428 -0.669 . . . . 1.0 111.428 -178.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -74.34 157.45 35.72 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 110.18 -0.304 . . . . 1.0 110.18 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.472 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 66.1 mt-30 -133.75 133.66 42.02 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.538 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -128.5 133.3 48.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.305 -0.628 . . . . 1.0 109.305 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.618 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.6 OUTLIER -91.54 128.72 37.48 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.363 0.602 . . . . 1.0 110.587 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.639 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.34 90.55 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.194 -0.912 . . . . 1.0 109.103 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -68.86 150.72 97.54 Favored Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 114.857 -1.065 . . . . 1.0 111.097 -178.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -44.93 119.22 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 C-N-CA 121.404 1.403 . . . . 1.0 111.298 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 166.2 -151.0 19.02 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.405 -1.078 . . . . 1.0 110.405 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -136.01 125.54 25.19 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.676 0.274 . . . . 1.0 110.614 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 3.1 m-85 -116.43 129.41 56.21 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.325 -0.62 . . . . 1.0 109.325 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . 0.411 ' C ' ' OG ' ' A' ' 123' ' ' SER . 72.9 mtm-85 -107.24 -1.54 21.69 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.02 0.438 . . . . 1.0 110.432 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.681 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -156.99 163.03 39.56 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.474 0.654 . . . . 1.0 110.867 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.542 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 9.1 p90 -78.28 -21.08 50.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.905 -1.043 . . . . 1.0 112.565 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.681 ' NE2' HH21 ' A' ' 153' ' ' ARG . 55.0 mt-30 -68.8 -20.03 64.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.93 -0.577 . . . . 1.0 111.167 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -51.96 -48.42 64.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.86 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.708 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 16.8 p90 -95.77 20.92 9.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.84 75.76 0.2 Allowed Glycine 0 CA--C 1.521 0.429 0 N-CA-C 111.212 -0.755 . . . . 1.0 111.212 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.708 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.85 149.24 41.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.086 0.469 . . . . 1.0 110.146 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 13.4 t -76.93 -21.3 55.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.254 -0.884 . . . . 1.0 110.207 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -163.33 -170.1 2.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.879 0.371 . . . . 1.0 110.492 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.717 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.91 -7.12 15.5 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.102 -0.499 . . . . 1.0 110.577 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -49.23 119.56 3.39 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.067 0.461 . . . . 1.0 111.121 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.9 t -135.05 121.25 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.372 -0.831 . . . . 1.0 109.382 177.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.438 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -100.54 -23.09 10.48 Favored Glycine 0 N--CA 1.467 0.717 0 N-CA-C 111.716 -0.554 . . . . 1.0 111.716 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.537 ' OG ' ' N ' ' A' ' 167' ' ' LEU . 5.2 t -156.77 179.94 8.8 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.266 -0.573 . . . . 1.0 110.314 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.537 ' N ' ' OG ' ' A' ' 166' ' ' SER . 1.5 pp -166.29 142.65 4.92 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.002 -0.544 . . . . 1.0 111.165 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.545 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 13.4 ptp180 -136.15 152.57 50.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.836 0.351 . . . . 1.0 110.123 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.631 ' NE ' ' N ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -81.01 159.16 24.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.193 -0.669 . . . . 1.0 109.193 177.792 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 170' ' ' VAL . 27.1 m -92.41 66.14 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.791 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.773 HD11 ' CD2' ' A' ' 88' ' ' HIS . 19.5 mt . . . . . 0 C--N 1.327 -0.389 0 CA-C-O 121.441 0.639 . . . . 1.0 110.948 179.441 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.52 0.369 0 N-CA-C 110.726 -0.95 . . . . 1.0 110.726 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -174.77 100.4 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.673 -0.411 . . . . 1.0 110.24 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.99 164.8 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 CA-C-N 116.264 -0.426 . . . . 1.0 110.278 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.522 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.8 m -124.16 118.6 27.25 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.29 -1.004 . . . . 1.0 108.29 177.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.8 mt -102.79 133.14 48.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.853 -1.067 . . . . 1.0 109.853 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.522 ' CE1' HG22 ' A' ' 5' ' ' THR . 66.0 m-85 -115.92 126.1 53.45 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.499 -0.773 . . . . 1.0 111.005 -178.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.533 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 82.0 tt0 -53.51 -31.57 46.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.608 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -115.16 153.67 30.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.283 0.564 . . . . 1.0 110.439 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.42 ' C ' ' N ' ' A' ' 12' ' ' PHE . 4.4 ptm180 -58.63 -173.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.609 -0.723 . . . . 1.0 110.265 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.47 26.84 0.25 Allowed Glycine 0 N--CA 1.462 0.388 0 N-CA-C 110.956 -0.858 . . . . 1.0 110.956 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.42 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.5 m-85 50.28 70.94 0.45 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.362 -0.419 . . . . 1.0 110.279 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -132.0 -158.81 0.92 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.92 0.391 . . . . 1.0 110.532 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.89 -151.93 0.3 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.533 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 89.0 mtm180 -68.77 146.57 52.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 1.0 110.768 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.3 p-80 -136.03 152.66 51.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.247 0.546 . . . . 1.0 110.377 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.531 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -146.69 141.51 26.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.494 -0.776 . . . . 1.0 110.294 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.531 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.0 tt0 -110.2 123.1 49.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.057 -0.52 . . . . 1.0 110.177 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.423 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.1 t -112.69 126.92 55.92 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.86 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -117.49 10.85 13.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.353 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.0 p -154.34 165.95 34.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.61 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 47.1 p-10 -58.32 141.65 50.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.549 -0.75 . . . . 1.0 111.446 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.423 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -136.19 146.22 46.59 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.389 -0.823 . . . . 1.0 110.484 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.6 p -112.78 -16.17 12.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.738 -0.664 . . . . 1.0 111.651 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -151.03 117.48 5.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.271 0.558 . . . . 1.0 110.667 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.4 mt -118.24 -0.41 11.54 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.283 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.608 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 45.6 mt-30 -46.39 -53.44 23.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.795 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.608 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.4 Cg_endo -54.35 -30.35 62.45 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.842 1.695 . . . . 1.0 111.977 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.433 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -96.27 -54.32 3.32 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.586 -0.446 . . . . 1.0 110.664 -179.062 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -117.74 126.95 53.4 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.756 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.2 t -95.28 -9.45 33.07 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.746 -0.661 . . . . 1.0 111.499 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 94.4 mtm-85 -146.36 -59.56 0.3 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t 64.8 76.37 0.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 1.0 110.004 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -92.55 3.78 54.85 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.999 -0.546 . . . . 1.0 111.383 -178.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.0 p -158.67 158.76 34.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.818 0.342 . . . . 1.0 110.274 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.92 155.73 34.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.995 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -134.67 123.62 24.01 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 108.96 -0.756 . . . . 1.0 108.96 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.06 132.66 56.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.364 -0.606 . . . . 1.0 109.364 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -93.92 -43.59 8.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.627 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.7 t -160.99 151.84 18.46 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.269 -0.423 . . . . 1.0 109.874 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.26 175.78 47.58 Favored Glycine 0 C--N 1.319 -0.405 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.4 m -113.02 137.52 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.509 -0.552 . . . . 1.0 109.509 178.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.448 ' CE2' HD13 ' A' ' 81' ' ' LEU . 46.8 m95 -124.02 155.98 37.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.242 0.544 . . . . 1.0 110.904 -178.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.424 ' C ' HD23 ' A' ' 45' ' ' LEU . 1.4 tpt -127.78 129.1 46.47 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.694 -0.854 . . . . 1.0 108.694 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.424 HD23 ' C ' ' A' ' 44' ' ' MET . 2.7 mt -108.69 130.33 55.35 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.451 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 73.3 m-85 -108.26 131.61 54.53 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.665 0.745 . . . . 1.0 110.758 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 4.7 pt-20 -59.25 -35.11 73.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.711 -1.131 . . . . 1.0 110.347 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.3 mt-30 -111.0 153.41 43.85 Favored Pre-proline 0 N--CA 1.462 0.146 0 CA-C-N 116.446 -0.343 . . . . 1.0 110.49 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.93 159.17 43.44 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.443 2.095 . . . . 1.0 112.623 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.681 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.64 39.21 11.53 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.731 -0.668 . . . . 1.0 111.023 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.451 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 5.2 m-85 48.17 74.22 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 1.0 110.746 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.8 m -141.5 153.15 44.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.063 0.459 . . . . 1.0 110.168 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.42 -147.26 19.95 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.91 -0.662 . . . . 1.0 111.675 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.629 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 37.2 tp -80.31 146.0 31.82 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.388 -0.406 . . . . 1.0 110.647 -179.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.429 ' NE2' ' H ' ' A' ' 145' ' ' LEU . 12.1 pt20 -121.78 150.86 41.26 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.839 0.352 . . . . 1.0 110.537 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.425 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 24.7 m-85 -127.53 132.54 49.9 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.236 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.491 ' C ' HD22 ' A' ' 58' ' ' LEU . 57.5 t80 -80.77 118.3 22.18 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.576 0.703 . . . . 1.0 109.961 -178.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.491 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.5 mm? -111.71 133.89 53.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.131 -0.94 . . . . 1.0 109.704 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.4 ptt85 -133.65 162.12 32.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.441 -0.799 . . . . 1.0 110.204 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -41.06 123.88 2.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.322 -0.399 . . . . 1.0 110.91 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.08 178.63 33.27 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.86 -0.896 . . . . 1.0 110.86 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.4 p-10 -115.29 124.43 51.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.206 0.527 . . . . 1.0 110.222 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -119.32 112.46 19.48 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.244 -0.651 . . . . 1.0 109.244 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.24 -4.04 54.65 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.496 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.9 m-20 -147.58 138.34 23.37 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.398 -0.593 . . . . 1.0 109.398 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.611 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 5.7 p80 -58.48 -40.96 84.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.133 0.492 . . . . 1.0 110.969 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -54.3 -7.82 0.17 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.709 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -81.89 -34.82 29.79 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.386 -0.526 . . . . 1.0 111.05 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.75 13.19 18.91 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.963 -0.295 . . . . 1.0 110.311 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.424 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 52.6 mtt 74.51 35.98 0.66 Allowed 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.915 0.759 . . . . 1.0 109.967 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.425 ' HA2' ' CE1' ' A' ' 56' ' ' TYR . . . . . . . . 0 CA--C 1.531 1.057 0 C-N-CA 120.158 -1.02 . . . . 1.0 111.463 179.803 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.518 -0.259 0 N-CA-C 108.607 -0.886 . . . . 1.0 108.607 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -121.49 4.12 10.19 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.867 -0.606 . . . . 1.0 111.566 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.2 p -163.22 162.69 25.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.177 0.513 . . . . 1.0 110.543 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 25.2 p -155.55 147.26 23.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 1.0 110.188 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.08 146.46 50.36 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.933 -0.395 . . . . 1.0 109.933 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.448 HD13 ' CE2' ' A' ' 43' ' ' TRP . 24.0 tp -96.41 136.15 37.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.485 -0.932 . . . . 1.0 108.485 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.443 ' H ' HD12 ' A' ' 81' ' ' LEU . 2.2 mt -96.41 112.91 61.42 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.606 -0.516 . . . . 1.0 109.606 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo . . . . . 0 N--CA 1.498 1.783 0 C-N-CA 122.143 1.895 . . . . 1.0 113.224 179.965 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 m . . . . . 0 CA--C 1.521 -0.135 0 CA-C-O 120.835 0.35 . . . . 1.0 110.244 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -136.06 114.69 11.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 1.0 110.94 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -142.29 133.76 26.55 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.195 -0.298 . . . . 1.0 110.195 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.515 HD12 HG22 ' A' ' 126' ' ' VAL . 16.9 tt -145.93 143.29 21.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.387 -0.37 . . . . 1.0 111.007 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -121.58 101.75 7.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.447 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.9 mt -82.89 139.29 33.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.964 -0.562 . . . . 1.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.471 ' CE1' ' CG ' ' A' ' 102' ' ' MET . 67.7 m-85 -115.15 136.96 52.55 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.527 0.679 . . . . 1.0 111.276 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.614 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 17.4 pt-20 -58.48 -47.12 85.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.278 -0.874 . . . . 1.0 110.354 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.493 ' N ' ' CG ' ' A' ' 94' ' ' GLU . 24.7 mtt85 -115.22 165.91 12.42 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.086 -0.506 . . . . 1.0 111.089 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 . . . . . 0 CA--C 1.507 -0.682 0 CA-C-N 115.312 -0.858 . . . . 1.0 110.354 179.027 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 0.413 0 N-CA-C 110.828 -0.909 . . . . 1.0 110.828 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.614 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 11.6 tp-100 -61.39 139.45 58.19 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.917 -0.313 . . . . 1.0 110.205 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.724 ' SD ' ' N ' ' A' ' 103' ' ' ILE . 4.3 tmm? -131.73 137.66 48.32 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.585 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.724 ' N ' ' SD ' ' A' ' 102' ' ' MET . 8.3 tt -134.37 137.41 51.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.094 -0.706 . . . . 1.0 109.094 178.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -111.33 146.88 36.3 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.526 0.679 . . . . 1.0 110.362 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.838 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 89.0 m-85 -130.27 155.67 45.93 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.037 -0.983 . . . . 1.0 110.466 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.6 p -143.77 27.76 1.47 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.681 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.408 ' CD ' ' N ' ' A' ' 107' ' ' GLU . 1.4 pm0 -168.08 -167.68 0.86 Allowed 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.713 -0.395 . . . . 1.0 110.47 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -81.64 147.34 29.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.419 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.521 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 3.2 m -139.16 97.05 3.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.44 -30.88 71.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.901 0.382 . . . . 1.0 110.983 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 51.5 m -137.74 93.14 2.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.982 -0.553 . . . . 1.0 110.511 -179.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.838 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 13.4 tp -60.59 -39.19 87.19 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.448 -0.796 . . . . 1.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.634 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 25.3 mp0 -43.86 -13.49 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.634 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 112' ' ' LEU . 93.6 m-20 -93.82 2.07 56.29 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.189 0.519 . . . . 1.0 110.751 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.3 mmt180 -133.59 -39.87 0.89 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.886 -1.052 . . . . 1.0 112.654 -177.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.727 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -123.1 136.08 54.65 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 122.061 0.934 . . . . 1.0 111.136 -179.036 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 118' ' ' PHE . 20.3 mmm180 -72.44 -70.09 0.36 Allowed 'General case' 0 C--N 1.315 -0.898 0 O-C-N 121.059 -1.026 . . . . 1.0 110.367 -178.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.672 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 61.0 m-85 -31.51 143.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.618 0.574 . . . . 1.0 110.187 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -105.03 6.79 33.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.998 0.428 . . . . 1.0 110.522 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -139.74 139.86 36.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.937 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.726 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.0 mm -120.11 120.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.385 -0.825 . . . . 1.0 109.108 178.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -110.59 22.29 15.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 1.0 111.584 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.478 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.8 p 169.08 151.71 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.071 0.463 . . . . 1.0 110.015 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.475 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.0 OUTLIER -161.96 157.11 23.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 1.0 110.183 -178.528 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . 0.68 HD22 HD11 ' A' ' 127' ' ' LEU . 11.4 t30 -125.01 117.67 24.53 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.515 HG22 HD12 ' A' ' 90' ' ' ILE . 22.0 t -101.59 105.07 17.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 109.597 -0.52 . . . . 1.0 109.597 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.902 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.8 OUTLIER -78.54 -40.95 33.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.787 -0.642 . . . . 1.0 111.494 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.7 mm-40 -139.69 167.3 22.42 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.443 0.639 . . . . 1.0 110.633 -178.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 44.26 -179.49 0.01 OUTLIER Glycine 0 C--N 1.315 -0.637 0 CA-C-N 113.911 -1.495 . . . . 1.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 20.2 m -119.4 149.63 41.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.358 -0.608 . . . . 1.0 109.358 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.459 ' N ' ' CD1' ' A' ' 131' ' ' TRP . 37.2 m95 -121.61 167.19 13.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.822 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.613 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.0 p -141.8 96.5 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.911 -0.315 . . . . 1.0 110.917 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 7.7 mt -66.53 142.63 57.45 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.389 -0.524 . . . . 1.0 110.966 -178.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -117.8 129.96 55.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.773 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -43.21 -49.11 6.62 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.053 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.39 175.45 7.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.197 0.522 . . . . 1.0 110.559 -179.122 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -81.81 172.78 12.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.562 -0.745 . . . . 1.0 110.508 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 38.4 m-20 63.44 17.65 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.29 -0.868 . . . . 1.0 110.278 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.419 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 7.4 m-85 36.29 77.89 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.174 -0.467 . . . . 1.0 111.71 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.45 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 52.9 ttm-85 -147.0 39.87 1.04 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.953 0.406 . . . . 1.0 110.64 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.452 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -154.51 -138.62 2.65 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.105 -0.798 . . . . 1.0 111.105 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -79.27 169.59 17.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.93 0.395 . . . . 1.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.94 137.91 21.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.747 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 17.8 m-85 -125.48 137.97 53.98 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 108.609 -0.886 . . . . 1.0 108.609 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.585 ' C ' HD22 ' A' ' 146' ' ' LEU . 38.5 tp -95.05 126.37 40.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.339 0.59 . . . . 1.0 111.149 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.838 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.6 mm? -114.33 109.31 18.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.208 -0.905 . . . . 1.0 109.832 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -83.26 166.66 33.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 116.295 -0.411 . . . . 1.0 110.1 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -62.01 114.03 2.13 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.979 1.786 . . . . 1.0 111.223 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.43 -150.87 11.3 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.587 -1.005 . . . . 1.0 110.587 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 66.6 t0 -128.56 134.62 48.68 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.815 0.34 . . . . 1.0 110.551 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.6 m-85 -125.95 131.4 52.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.209 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -117.22 -1.31 11.86 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.952 0.406 . . . . 1.0 110.419 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.678 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -157.16 165.3 36.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.892 -0.595 . . . . 1.0 110.402 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.458 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 14.4 p90 -79.39 -20.77 46.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.261 -0.881 . . . . 1.0 112.253 -177.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.678 ' NE2' HH21 ' A' ' 153' ' ' ARG . 51.8 mt-30 -68.6 -19.61 64.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 1.0 111.218 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -51.37 -48.81 62.42 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.894 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.723 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 17.8 p90 -97.64 20.74 11.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.714 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.92 75.57 0.21 Allowed Glycine 0 CA--C 1.518 0.223 0 N-CA-C 111.125 -0.79 . . . . 1.0 111.125 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.723 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.84 149.59 40.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 121.069 0.461 . . . . 1.0 110.274 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.3 t -79.11 -12.46 60.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.354 -0.839 . . . . 1.0 110.238 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.53 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 9.0 t-20 -170.5 -171.25 1.04 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.996 0.427 . . . . 1.0 110.486 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.726 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.98 -8.83 15.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.624 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -48.37 123.88 7.18 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 121.498 0.666 . . . . 1.0 111.171 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 41.5 t -131.28 133.78 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.924 178.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.518 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -111.19 -31.18 2.92 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 111.715 -0.554 . . . . 1.0 111.715 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 9.3 p -158.84 -169.46 2.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.763 0.316 . . . . 1.0 110.462 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.547 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -173.03 138.1 0.74 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.794 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.613 ' O ' HG12 ' A' ' 132' ' ' VAL . 0.3 OUTLIER -129.6 141.96 50.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.57 0.7 . . . . 1.0 109.878 179.414 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.84 ' H ' ' CD ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -77.22 145.91 37.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.155 178.135 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.476 ' C ' HD12 ' A' ' 171' ' ' ILE . 48.7 t -82.52 88.32 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.691 -0.404 . . . . 1.0 111.839 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.476 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.1 mp . . . . . 0 C--N 1.33 -0.242 0 CA-C-N 116.187 -0.46 . . . . 1.0 110.496 179.368 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.228 -0.246 0 N-CA-C 110.752 -0.939 . . . . 1.0 110.752 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 tttt -176.34 100.87 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.498 -0.481 . . . . 1.0 110.319 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -118.89 165.38 14.26 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.659 -179.401 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.472 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.9 m -124.0 120.3 32.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.542 -0.91 . . . . 1.0 108.542 177.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.4 mt -104.11 132.87 49.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.94 -1.027 . . . . 1.0 109.845 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.472 ' CE1' HG22 ' A' ' 5' ' ' THR . 67.1 m-85 -115.05 124.99 53.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.938 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -52.71 -29.85 29.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.596 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -117.23 154.96 30.26 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.112 0.482 . . . . 1.0 110.298 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 12' ' ' PHE . 11.5 ptm180 -59.86 -172.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.548 -0.751 . . . . 1.0 110.362 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.11 25.71 0.27 Allowed Glycine 0 N--CA 1.461 0.336 0 N-CA-C 111.086 -0.805 . . . . 1.0 111.086 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.55 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 51.44 69.17 0.69 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.527 -0.337 . . . . 1.0 110.25 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -131.28 -156.58 0.76 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.032 0.444 . . . . 1.0 110.521 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.12 -153.15 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.071 -0.812 . . . . 1.0 111.071 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -69.25 148.33 49.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.74 0.305 . . . . 1.0 110.712 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -136.64 152.57 50.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.138 0.494 . . . . 1.0 110.453 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.526 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -145.13 140.98 28.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.2 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.526 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.8 tt0 -110.3 123.63 50.17 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.269 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.499 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.2 t -112.58 127.0 55.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.737 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.7 t -118.06 15.52 14.16 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.026 -0.533 . . . . 1.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.1 p -158.89 167.58 29.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.458 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 54.1 p-10 -57.75 141.36 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.502 -0.772 . . . . 1.0 111.388 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.499 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.43 145.14 44.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.198 179.693 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 p -112.16 -16.66 12.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.735 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.403 ' ND2' ' H ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -150.8 120.34 6.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.1 0.476 . . . . 1.0 110.624 -179.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.3 mt -119.1 0.11 11.19 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 31.5 mt-30 -48.41 -52.13 45.62 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.784 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.617 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.8 Cg_endo -54.55 -32.58 74.92 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.933 1.756 . . . . 1.0 112.22 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -94.37 -52.37 4.37 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 120.527 -0.469 . . . . 1.0 110.555 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.2 mt -116.95 127.07 53.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.714 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -95.13 -10.56 30.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.47 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 3.0 tpt85 -145.55 -61.97 0.34 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.28 -0.418 . . . . 1.0 111.475 -178.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.8 t 66.83 81.32 0.2 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.779 -0.452 . . . . 1.0 109.779 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.517 ' OD1' ' CE1' ' A' ' 66' ' ' HIS . 2.4 t30 -96.93 1.78 50.84 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 120.687 0.28 . . . . 1.0 110.966 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.55 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.9 t -155.2 156.51 35.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.835 0.35 . . . . 1.0 110.087 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.4 153.72 34.15 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.912 -0.585 . . . . 1.0 110.926 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.409 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.5 mtp180 -136.05 123.41 21.94 Favored 'General case' 0 C--O 1.206 -1.189 0 N-CA-C 109.347 -0.612 . . . . 1.0 109.347 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.542 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.5 p -109.66 132.0 59.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.036 0.446 . . . . 1.0 110.259 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -85.41 -42.59 14.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.231 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 t -163.95 150.42 11.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.937 -0.394 . . . . 1.0 109.937 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.56 177.81 42.73 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 110.745 -0.942 . . . . 1.0 110.745 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -111.85 140.8 46.2 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.594 -0.521 . . . . 1.0 109.594 178.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.409 ' CE2' HD13 ' A' ' 81' ' ' LEU . 57.2 m95 -128.46 133.75 48.58 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.495 0.664 . . . . 1.0 111.355 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.572 ' C ' HD12 ' A' ' 45' ' ' LEU . 27.5 tpp -107.45 129.37 54.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.294 -0.866 . . . . 1.0 109.233 178.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.572 HD12 ' C ' ' A' ' 44' ' ' MET . 9.9 mp -109.32 130.86 55.48 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.868 -0.605 . . . . 1.0 109.832 -179.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -111.09 130.65 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 1.0 111.402 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.634 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 9.3 pt-20 -56.69 -37.26 70.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.767 -0.651 . . . . 1.0 111.214 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 5.2 mt-30 -106.29 153.53 40.33 Favored Pre-proline 0 C--O 1.233 0.203 0 CA-C-N 115.83 -0.623 . . . . 1.0 110.688 -178.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.26 159.23 48.21 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.386 2.058 . . . . 1.0 112.208 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.675 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.4 45.04 6.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.744 -0.662 . . . . 1.0 111.149 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 42.96 74.93 0.1 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.419 -0.81 . . . . 1.0 110.837 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 m -145.38 157.31 44.05 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.061 0.458 . . . . 1.0 109.867 -178.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.7 -148.15 23.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.732 -0.746 . . . . 1.0 111.683 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.634 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.7 tp -76.83 142.41 40.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.44 -0.38 . . . . 1.0 110.202 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -119.41 150.42 40.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.487 -0.19 . . . . 1.0 110.487 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.43 ' C ' ' SD ' ' A' ' 44' ' ' MET . 18.5 m-85 -126.18 124.15 39.82 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 116.52 -0.309 . . . . 1.0 110.771 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.406 ' C ' HD12 ' A' ' 58' ' ' LEU . 46.6 t80 -84.23 123.64 30.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.255 -0.43 . . . . 1.0 109.893 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.5 mp -118.32 147.33 43.59 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.82 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' A' ' 60' ' ' ARG . 31.4 mtm-85 -134.74 155.02 51.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.89 -178.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' A' ' 59' ' ' ARG . 27.7 tpt85 -32.41 125.46 0.31 Allowed 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.542 0.526 . . . . 1.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.542 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 153.62 -177.34 31.2 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.242 -1.143 . . . . 1.0 110.242 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -115.6 136.18 53.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.825 0.345 . . . . 1.0 110.186 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -128.25 112.41 14.46 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.819 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.51 -4.57 55.34 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.677 -0.692 . . . . 1.0 111.339 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 19.6 m-20 -147.14 141.94 26.81 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.417 -0.586 . . . . 1.0 109.417 179.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.517 ' CE1' ' OD1' ' A' ' 34' ' ' ASN . 29.9 p-80 -63.6 -39.92 95.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.979 0.419 . . . . 1.0 111.367 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -54.43 -6.77 0.12 Allowed 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.244 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.496 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.3 mm-40 -83.65 -35.28 24.7 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.676 -0.41 . . . . 1.0 111.402 -177.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.477 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -95.92 19.53 11.36 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 119.229 -0.415 . . . . 1.0 110.978 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.45 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 48.6 mtt 81.46 12.15 0.73 Allowed 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.91 0.756 . . . . 1.0 110.35 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.403 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.342 0.88 0 C-N-CA 120.548 -0.834 . . . . 1.0 111.152 179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . 0.427 HG22 ' O ' ' A' ' 76' ' ' VAL . 1.4 p . . . . . 0 N--CA 1.474 0.766 0 CA-C-O 120.689 0.28 . . . . 1.0 110.487 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -102.24 8.74 40.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.795 -0.362 . . . . 1.0 110.656 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.2 p -163.81 162.69 23.89 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.068 0.461 . . . . 1.0 110.828 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.3 p -155.34 146.88 23.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.689 -0.687 . . . . 1.0 110.273 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.3 ptm180 -128.4 150.05 50.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.455 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.409 HD13 ' CE2' ' A' ' 43' ' ' TRP . 38.0 tp -96.99 133.94 41.0 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.033 -0.729 . . . . 1.0 109.033 177.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.0 mt -97.18 112.7 61.6 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo . . . . . 0 N--CA 1.499 1.817 0 C-N-CA 122.353 2.035 . . . . 1.0 112.983 -179.948 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 CA--C 1.519 -0.234 0 N-CA-C 109.718 -0.475 . . . . 1.0 109.718 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -128.94 109.02 10.88 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 121.061 -0.256 . . . . 1.0 111.166 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -138.46 141.9 39.46 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 120.384 -0.526 . . . . 1.0 110.516 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.486 HD12 HG22 ' A' ' 126' ' ' VAL . 19.4 tt -155.52 149.86 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.491 -0.322 . . . . 1.0 110.637 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.518 ' HE ' ' CB ' ' A' ' 125' ' ' ASN . 22.8 ptt180 -131.47 103.94 6.7 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.558 0.694 . . . . 1.0 111.048 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.59 150.15 26.11 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.598 -0.728 . . . . 1.0 111.801 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 99.6 m-85 -122.55 136.93 55.01 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.26 -0.882 . . . . 1.0 111.371 -179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.23 -52.95 61.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.276 -0.875 . . . . 1.0 111.017 179.55 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.631 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 74.5 mtp180 -109.12 177.02 4.88 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 120.843 0.354 . . . . 1.0 110.138 -178.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 57.6 mp0 . . . . . 0 CA--C 1.508 -0.668 0 CA-C-N 115.45 -0.796 . . . . 1.0 110.229 179.861 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.556 0 N-CA-C 111.076 -0.809 . . . . 1.0 111.076 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.466 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 66.4 tp60 -65.91 148.67 51.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.554 0.692 . . . . 1.0 111.174 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.64 149.17 47.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.34 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.519 HG21 ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -140.5 140.46 34.09 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 109.437 -0.579 . . . . 1.0 109.437 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -113.71 132.09 55.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.369 0.604 . . . . 1.0 110.935 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.485 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 96.9 m-85 -116.06 155.87 27.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 114.658 -1.155 . . . . 1.0 110.106 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.2 p -144.38 20.18 1.71 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.532 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -159.43 -170.8 3.07 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.595 -0.442 . . . . 1.0 110.109 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.452 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 53.6 p-10 -73.82 141.83 46.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 1.0 111.2 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.414 ' O ' ' OH ' ' A' ' 139' ' ' TYR . 2.8 m -131.17 118.91 21.14 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.259 -0.645 . . . . 1.0 109.259 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.6 p -95.86 -22.42 17.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 1.0 111.006 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 50.3 t -146.07 96.82 2.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.299 0.571 . . . . 1.0 111.839 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.572 HD11 HD22 ' A' ' 167' ' ' LEU . 8.3 mt -62.45 -41.19 98.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.025 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -45.15 -12.58 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.139 -0.482 . . . . 1.0 111.098 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 112' ' ' LEU . 64.5 t0 -96.77 -27.18 14.85 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.958 0.409 . . . . 1.0 110.508 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.4 mmt180 -108.77 -40.64 4.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.103 -0.498 . . . . 1.0 111.497 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.519 ' CD1' HG21 ' A' ' 103' ' ' ILE . 5.9 t80 -121.94 118.52 29.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.208 0.528 . . . . 1.0 110.341 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -56.51 -69.07 0.16 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.215 -0.902 . . . . 1.0 111.079 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -39.72 138.46 0.74 Allowed 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 110.059 -0.348 . . . . 1.0 110.059 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -99.81 -0.41 39.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.515 -0.312 . . . . 1.0 111.038 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -125.52 138.36 53.97 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.538 0.685 . . . . 1.0 110.854 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.5 mm -121.17 119.01 58.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 CA-C-N 114.973 -1.012 . . . . 1.0 109.617 178.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.417 ' O ' ' CB ' ' A' ' 123' ' ' SER . 23.0 m-70 -110.92 22.02 15.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.694 -0.685 . . . . 1.0 111.675 -178.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.565 ' C ' HD13 ' A' ' 124' ' ' LEU . 1.8 p 166.97 152.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.865 0.364 . . . . 1.0 110.651 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -162.32 163.94 27.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.557 -179.518 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . 0.518 ' CB ' ' HE ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -126.92 116.06 20.24 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.009 -0.737 . . . . 1.0 109.009 179.634 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.486 HG22 HD12 ' A' ' 90' ' ' ILE . 58.0 t -99.72 106.38 19.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 O-C-N 123.553 0.533 . . . . 1.0 110.649 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.896 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.99 -42.74 23.3 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 124.025 0.828 . . . . 1.0 110.556 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -157.77 145.38 18.54 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.457 -0.497 . . . . 1.0 110.625 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.516 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 72.6 82.83 0.29 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 115.827 -0.624 . . . . 1.0 113.061 177.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.461 ' O ' ' O ' ' A' ' 129' ' ' GLY . 13.7 t -31.51 150.24 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.162 0.506 . . . . 1.0 110.616 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.516 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 53.3 m95 -124.12 163.49 21.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.13 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 46.4 t -134.22 137.93 50.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-N 115.881 -0.6 . . . . 1.0 109.479 179.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.641 ' HG ' HD11 ' A' ' 146' ' ' LEU . 28.5 mt -109.02 140.39 42.6 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 109.166 -0.679 . . . . 1.0 109.166 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . 0.624 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 30.8 m-85 -117.27 132.36 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.89 0.376 . . . . 1.0 110.875 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.439 ' OE2' ' CZ ' ' A' ' 163' ' ' ARG . 84.6 tt0 -40.7 -55.18 2.45 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.053 -0.522 . . . . 1.0 111.08 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.575 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -121.26 172.84 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.122 0.487 . . . . 1.0 110.098 -178.87 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . 0.42 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -74.7 169.5 17.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.546 179.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.9 t30 66.96 15.77 10.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.231 -0.895 . . . . 1.0 110.019 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 109' ' ' CYS . 2.5 m-85 40.21 80.66 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 1.0 111.698 179.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.548 ' C ' HD11 ' A' ' 136' ' ' LEU . 61.8 ttt180 -149.89 40.57 0.81 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.2 0.524 . . . . 1.0 109.786 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -150.84 -140.43 3.18 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.281 -0.728 . . . . 1.0 111.281 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.442 ' C ' HE21 ' A' ' 143' ' ' GLN . 80.7 mtp85 -76.25 171.25 14.86 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 110.121 -0.325 . . . . 1.0 110.121 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.442 HE21 ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -150.3 137.42 19.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.012 -179.706 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 6.8 m-85 -127.52 141.28 51.69 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.195 -0.668 . . . . 1.0 109.195 178.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 59.1 tp -93.83 126.78 39.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.422 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.641 HD11 ' HG ' ' A' ' 133' ' ' LEU . 13.4 mt -116.33 90.46 3.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.83 -0.623 . . . . 1.0 109.397 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.6 mtm -73.59 161.61 78.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.939 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -49.94 113.58 1.05 Allowed 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.934 1.756 . . . . 1.0 111.31 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 173.08 -152.28 15.68 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.454 -1.058 . . . . 1.0 110.454 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.462 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 p-10 -135.48 127.19 29.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.831 0.348 . . . . 1.0 111.248 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 1.8 m-85 -118.58 133.66 55.7 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 109.385 -0.598 . . . . 1.0 109.385 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -112.85 -4.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.814 0.34 . . . . 1.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -153.42 162.81 40.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.251 0.548 . . . . 1.0 110.208 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.615 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.04 -19.83 59.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.134 -0.939 . . . . 1.0 112.202 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.557 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -67.48 -20.88 65.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.85 -179.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -51.64 -47.94 63.54 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 120.252 -0.579 . . . . 1.0 110.793 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.637 ' CZ3' HD11 ' A' ' 124' ' ' LEU . 37.9 p90 -101.9 18.53 20.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 1.0 110.305 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.69 77.85 0.13 Allowed Glycine 0 C--N 1.331 0.265 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.615 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . . . -96.12 -170.42 2.11 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.093 0.473 . . . . 1.0 109.995 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -34.92 2.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.462 -0.79 . . . . 1.0 111.621 -179.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.673 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.6 OUTLIER -150.17 -15.81 0.25 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.85 0.315 . . . . 1.0 111.85 -178.86 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.745 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 88.52 -23.61 0.11 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.787 -0.642 . . . . 1.0 110.827 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.439 ' CZ ' ' OE2' ' A' ' 135' ' ' GLU . 34.2 ptt180 -42.17 119.4 1.35 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.568 0.699 . . . . 1.0 110.866 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.745 HG23 ' O ' ' A' ' 162' ' ' ALA . 30.4 t -121.33 132.09 71.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.504 -0.771 . . . . 1.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -108.73 -26.87 5.15 Favored Glycine 0 N--CA 1.465 0.608 0 N-CA-C 111.338 -0.705 . . . . 1.0 111.338 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.7 p -163.88 169.02 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.961 0.41 . . . . 1.0 110.784 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.572 HD22 HD11 ' A' ' 112' ' ' LEU . 0.5 OUTLIER -153.32 146.38 24.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.899 -0.592 . . . . 1.0 111.552 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.624 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 7.0 ptp180 -136.94 148.8 47.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.615 -0.513 . . . . 1.0 109.615 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.873 ' H ' HH11 ' A' ' 169' ' ' ARG . 0.0 OUTLIER -82.06 152.59 26.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.219 -0.901 . . . . 1.0 109.622 177.735 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.793 ' C ' HD12 ' A' ' 171' ' ' ILE . 59.2 t -85.67 85.23 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.935 0.398 . . . . 1.0 111.453 -179.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.793 HD12 ' C ' ' A' ' 170' ' ' VAL . 2.3 mp . . . . . 0 N--CA 1.464 0.267 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.35 179.131 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.664 0 N-CA-C 110.504 -1.038 . . . . 1.0 110.504 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -172.92 106.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.062 -0.255 . . . . 1.0 110.698 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.454 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.55 173.31 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 120.813 0.34 . . . . 1.0 111.264 -179.311 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.543 HG22 ' CE1' ' A' ' 7' ' ' TYR . 33.5 m -130.24 120.96 25.27 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.456 -0.942 . . . . 1.0 108.456 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -105.91 133.09 51.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.044 -0.98 . . . . 1.0 110.058 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.543 ' CE1' HG22 ' A' ' 5' ' ' THR . 56.9 m-85 -114.29 129.55 56.64 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.553 -0.749 . . . . 1.0 111.231 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 79.4 tt0 -56.15 -20.98 19.95 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.789 . . . . 1.0 110.324 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -127.14 154.56 44.6 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.146 0.498 . . . . 1.0 110.086 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 12' ' ' PHE . 29.0 ptt85 -58.95 -172.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.619 -0.719 . . . . 1.0 110.299 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.15 26.1 0.16 Allowed Glycine 0 N--CA 1.463 0.44 0 N-CA-C 111.083 -0.807 . . . . 1.0 111.083 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.436 ' N ' ' O ' ' A' ' 10' ' ' ARG . 5.7 m-85 50.54 66.99 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.934 -0.395 . . . . 1.0 109.934 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -126.15 -155.84 0.7 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.825 0.345 . . . . 1.0 110.469 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 39.78 -149.1 0.14 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -71.19 149.0 46.75 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.906 0.384 . . . . 1.0 110.497 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -135.01 144.78 47.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.353 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.561 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.5 t80 -140.94 142.34 34.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 1.0 110.039 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.561 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 40.5 tt0 -110.82 122.1 47.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.269 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.46 127.21 54.24 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.187 -0.461 . . . . 1.0 110.513 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -117.56 14.6 14.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 95.5 p -159.62 169.17 24.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.538 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 81' ' ' LEU . 47.7 m-20 -57.82 139.88 53.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.722 -0.672 . . . . 1.0 110.884 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.83 148.58 50.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.552 -0.749 . . . . 1.0 110.146 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -118.84 -18.84 8.8 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.654 -0.703 . . . . 1.0 112.07 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -143.87 108.66 4.91 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.197 0.522 . . . . 1.0 109.954 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 26.0 mt -111.78 0.41 16.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.747 -0.661 . . . . 1.0 110.172 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.8 mt-30 -55.28 -42.97 98.71 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.621 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.3 Cg_exo -58.85 -36.89 96.22 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.277 1.985 . . . . 1.0 112.029 -179.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -93.33 -44.61 8.21 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.962 0.41 . . . . 1.0 111.067 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.74 127.8 49.67 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.766 -0.652 . . . . 1.0 111.444 -178.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -91.44 -11.41 37.69 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.143 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 42.0 ttm180 -176.16 120.39 0.16 Allowed 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t -101.49 107.42 18.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.115 -0.366 . . . . 1.0 110.394 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -103.56 -4.71 23.54 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.375 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.6 p -156.18 156.41 34.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.965 0.412 . . . . 1.0 110.333 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.84 155.14 36.54 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.897 -0.592 . . . . 1.0 110.997 -179.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.3 mtt-85 -136.03 122.34 20.51 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.74 -0.664 . . . . 1.0 109.567 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.481 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.4 p -110.47 129.39 65.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.981 0.42 . . . . 1.0 110.948 179.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -81.06 -46.02 15.63 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.453 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.5 t -162.37 153.33 17.55 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.018 -0.364 . . . . 1.0 110.018 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.54 175.27 43.17 Favored Glycine 0 C--N 1.32 -0.357 0 N-CA-C 110.876 -0.89 . . . . 1.0 110.876 179.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 84.5 m -111.0 132.36 54.27 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.209 -0.663 . . . . 1.0 109.209 178.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.526 ' CE2' HD13 ' A' ' 81' ' ' LEU . 50.3 m95 -118.62 146.93 44.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 1.0 111.195 -179.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.587 ' C ' HD12 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -117.99 127.18 53.57 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 109.246 -0.649 . . . . 1.0 109.246 178.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.587 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -108.27 127.38 53.8 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.53 -0.544 . . . . 1.0 109.53 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -103.88 131.12 51.4 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.579 0.704 . . . . 1.0 111.429 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.593 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.1 pt-20 -60.53 -35.34 75.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.908 -1.042 . . . . 1.0 109.557 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.418 ' O ' ' OG ' ' A' ' 78' ' ' SER . 6.8 mt-30 -102.24 152.59 38.3 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.066 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.547 ' C ' HD22 ' A' ' 50' ' ' ASN . 18.1 Cg_endo -56.94 151.16 51.01 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.752 1.635 . . . . 1.0 110.796 179.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.746 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER 70.26 -116.11 0.1 Allowed 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.241 -1.022 . . . . 1.0 108.241 -177.711 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -152.83 70.94 0.9 Allowed 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 178.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.7 t -137.18 18.08 2.97 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 120.785 0.326 . . . . 1.0 110.888 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -134.68 -171.18 12.42 Favored Glycine 0 CA--C 1.519 0.341 0 N-CA-C 111.069 -0.812 . . . . 1.0 111.069 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.593 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.2 tp -58.54 151.03 21.32 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.524 -0.338 . . . . 1.0 110.153 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -121.08 149.24 43.03 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.631 0.253 . . . . 1.0 111.196 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -126.09 129.18 48.6 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 116.42 -0.355 . . . . 1.0 110.849 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.515 ' C ' HD22 ' A' ' 58' ' ' LEU . 21.8 t80 -82.94 120.43 25.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.419 0.628 . . . . 1.0 110.138 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.515 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.9 mm? -110.79 133.78 53.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.135 -0.939 . . . . 1.0 109.678 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.707 ' NH1' HH12 ' A' ' 168' ' ' ARG . 76.6 mtm180 -127.92 145.67 50.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.266 -0.879 . . . . 1.0 109.534 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.466 ' HA ' HG13 ' A' ' 38' ' ' VAL . 73.1 ttt-85 -31.71 126.8 0.22 Allowed 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.447 0.467 . . . . 1.0 111.323 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.481 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 152.09 -174.34 31.1 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.472 -1.051 . . . . 1.0 110.472 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.63 133.36 56.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.004 0.43 . . . . 1.0 110.353 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -127.39 113.33 16.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.042 -0.526 . . . . 1.0 109.646 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.39 -3.68 54.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.302 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -146.63 143.48 28.84 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.395 -0.594 . . . . 1.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.521 ' C ' ' H ' ' A' ' 68' ' ' GLN . 22.7 p-80 -66.03 -42.43 89.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 1.0 110.928 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -52.01 -7.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.802 -0.635 . . . . 1.0 110.449 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.521 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.5 mm-40 -82.38 -36.14 27.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.825 -0.35 . . . . 1.0 111.212 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.7 p90 -93.53 19.58 8.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 119.391 -0.338 . . . . 1.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.463 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 66.6 mtp 79.88 17.19 0.75 Allowed 'General case' 0 C--O 1.233 0.209 0 O-C-N 123.942 0.776 . . . . 1.0 109.749 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.972 0 C-N-CA 120.898 -0.668 . . . . 1.0 112.123 179.563 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 5.4 t . . . . . 0 CA--C 1.518 -0.255 0 N-CA-C 109.053 -0.721 . . . . 1.0 109.053 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.8 mtm180 -127.94 6.25 6.02 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.477 -178.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 11.5 p -161.65 159.98 28.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.147 0.498 . . . . 1.0 110.305 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.6 p -155.8 146.98 22.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.109 -178.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -127.26 145.51 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.862 -0.421 . . . . 1.0 109.862 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.526 HD13 ' CE2' ' A' ' 43' ' ' TRP . 34.3 tp -95.04 134.36 37.81 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.052 -0.722 . . . . 1.0 109.052 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.497 HD11 ' SD ' ' A' ' 44' ' ' MET . 2.2 mt -95.33 113.53 61.83 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 109.543 -0.54 . . . . 1.0 109.543 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo . . . . . 0 N--CA 1.498 1.763 0 C-N-CA 122.257 1.971 . . . . 1.0 112.968 179.98 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 CA--C 1.52 -0.183 0 CA-C-O 120.767 0.318 . . . . 1.0 110.377 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.537 ' CD2' HD11 ' A' ' 171' ' ' ILE . 5.5 m80 -136.54 111.9 9.18 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.341 -0.39 . . . . 1.0 110.981 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 43.5 mtm-85 -142.32 139.21 31.75 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.755 -0.378 . . . . 1.0 110.425 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.4 tt -152.81 153.63 8.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.063 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -133.36 112.96 12.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.294 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.82 ' N ' HD22 ' A' ' 92' ' ' LEU . 1.5 mm? -88.92 123.47 33.3 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.419 -0.809 . . . . 1.0 109.821 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.585 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 26.6 m-85 -100.04 135.43 41.47 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 115.308 -0.86 . . . . 1.0 110.757 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.486 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.5 tm-20 -57.2 -60.58 3.4 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.585 -0.734 . . . . 1.0 111.394 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.466 ' O ' ' OG ' ' A' ' 123' ' ' SER . 84.4 mtp180 -102.2 166.8 10.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.748 -178.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 . . . . . 0 CA--C 1.516 -0.333 0 CA-C-N 115.641 -0.709 . . . . 1.0 110.711 178.812 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.837 0 N-CA-C 111.142 -0.783 . . . . 1.0 111.142 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -62.12 143.15 57.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 121.071 -0.251 . . . . 1.0 110.392 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.585 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 11.3 ttp -133.38 149.57 51.84 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.814 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.411 ' N ' ' HG2' ' A' ' 102' ' ' MET . 11.0 tt -143.0 141.8 26.48 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 N-CA-C 109.57 -0.53 . . . . 1.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -113.93 143.98 43.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 1.0 110.715 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.66 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 82.6 m-85 -131.36 154.83 48.18 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.011 -0.995 . . . . 1.0 110.489 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.6 p -144.52 19.85 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.805 -0.634 . . . . 1.0 111.137 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 1.019 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.0 pt-20 -167.45 83.35 0.21 Allowed 'General case' 0 C--O 1.213 -0.865 0 CA-C-O 118.025 -0.988 . . . . 1.0 109.967 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 1.019 ' O ' ' O ' ' A' ' 107' ' ' GLU . 51.9 p30 16.49 163.0 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 122.359 1.076 . . . . 1.0 113.358 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 108' ' ' ASP . 8.8 m -146.66 107.17 4.07 Favored 'General case' 0 C--N 1.308 -1.235 0 O-C-N 120.18 -1.575 . . . . 1.0 109.545 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.416 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.6 p -66.33 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.317 -0.401 . . . . 1.0 110.969 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 15.7 t -142.52 88.9 2.1 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.13 0.491 . . . . 1.0 110.208 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.66 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 11.7 tp -61.55 -41.71 97.77 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 115.553 -0.749 . . . . 1.0 110.265 -178.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.644 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 22.2 mp0 -43.15 -10.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.258 -0.428 . . . . 1.0 111.719 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 112' ' ' LEU . 62.7 t0 -95.29 -21.81 18.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.055 0.455 . . . . 1.0 110.748 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 112' ' ' LEU . 25.2 mmt85 -108.86 -36.71 6.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.899 0.703 . . . . 1.0 112.899 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.706 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.16 138.37 54.24 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 122.2 1.0 . . . . 1.0 110.861 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.3 mmt-85 -75.33 -73.72 0.24 Allowed 'General case' 0 C--N 1.312 -1.041 0 O-C-N 120.641 -1.287 . . . . 1.0 110.62 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.683 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.4 m-85 -31.31 144.77 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.564 0 O-C-N 123.508 0.505 . . . . 1.0 110.314 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -105.6 9.25 33.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.826 0.346 . . . . 1.0 111.075 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -137.85 138.75 39.43 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.008 -0.542 . . . . 1.0 111.173 -178.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.734 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.6 mm -120.98 121.35 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.426 -0.807 . . . . 1.0 109.183 178.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -111.24 20.74 17.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.883 -0.599 . . . . 1.0 111.634 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 3.1 p 169.85 153.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.069 0.461 . . . . 1.0 110.273 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.434 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.5 pp -165.94 161.59 17.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.662 -0.699 . . . . 1.0 110.788 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . 0.471 HD22 HD11 ' A' ' 127' ' ' LEU . 3.0 t30 -128.55 120.85 27.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.368 -0.378 . . . . 1.0 110.152 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.0 t -100.93 105.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.1 -0.704 . . . . 1.0 109.1 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.915 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.44 -42.2 30.62 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.932 -0.576 . . . . 1.0 111.212 -179.507 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.0 mm-40 -138.8 166.97 23.03 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.534 0.683 . . . . 1.0 110.498 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 42.96 -176.99 0.01 OUTLIER Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.953 -1.476 . . . . 1.0 111.007 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.36 152.9 35.99 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.379 -0.6 . . . . 1.0 109.379 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 39.6 m95 -125.25 168.09 13.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.697 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 168' ' ' ARG . 1.9 p -141.83 99.27 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.733 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.57 141.08 56.93 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 120.275 -0.57 . . . . 1.0 110.789 -178.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -118.51 131.63 56.23 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.843 -0.617 . . . . 1.0 109.703 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -46.93 -49.17 20.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.033 -0.53 . . . . 1.0 111.679 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.53 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.2 175.63 6.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.318 0.58 . . . . 1.0 110.383 -178.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.7 p -82.7 170.68 14.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.437 -0.801 . . . . 1.0 110.355 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 138' ' ' ASN . 41.1 t-20 66.22 17.34 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.261 -179.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 37.13 79.25 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.0 111.751 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 28.2 ttm180 -149.59 39.24 0.79 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.026 0.441 . . . . 1.0 110.508 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.448 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -152.93 -143.11 3.61 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.374 -0.691 . . . . 1.0 111.374 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -74.41 168.45 19.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.985 0.421 . . . . 1.0 110.24 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.486 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 6.6 pt20 -150.57 141.35 22.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.77 -0.65 . . . . 1.0 111.449 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . 0.449 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.8 m-85 -131.02 139.33 49.95 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.494 -0.928 . . . . 1.0 108.494 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.617 ' C ' HD22 ' A' ' 146' ' ' LEU . 49.4 tp -92.67 126.47 37.77 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.634 0.584 . . . . 1.0 111.617 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.826 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.7 mm? -114.83 102.71 10.25 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.437 -0.802 . . . . 1.0 109.608 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 3.6 mtm -81.99 164.82 46.68 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.451 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.62 119.28 6.44 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 121.968 1.779 . . . . 1.0 111.312 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.65 -153.17 21.22 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.536 -1.026 . . . . 1.0 110.536 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -128.36 132.63 48.56 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.755 0.312 . . . . 1.0 110.387 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.466 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 33.5 m-85 -123.26 132.07 53.89 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.003 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -117.03 -6.72 11.39 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -153.05 163.96 38.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.34 0.591 . . . . 1.0 110.03 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.4 p90 -76.76 -20.55 56.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.061 -0.972 . . . . 1.0 112.239 -178.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -68.82 -19.64 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 1.0 111.065 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.76 -49.56 57.76 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.934 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.689 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 17.3 p90 -96.84 22.54 8.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.317 -0.402 . . . . 1.0 110.713 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 75.56 0.21 Allowed Glycine 0 CA--C 1.517 0.195 0 N-CA-C 111.223 -0.751 . . . . 1.0 111.223 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.689 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.37 147.05 43.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 110.26 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.9 t -78.21 -10.09 59.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.097 178.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.514 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 8.1 t-20 -171.99 -169.15 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.583 -0.447 . . . . 1.0 110.259 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.734 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -110.28 -18.86 13.18 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.375 -0.375 . . . . 1.0 110.659 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 162' ' ' ALA . 20.0 ptp180 -37.22 123.69 0.93 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.309 0.576 . . . . 1.0 111.695 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 162' ' ' ALA . 22.0 t -127.32 159.84 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.02 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.52 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -135.27 -35.7 0.23 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.689 -0.687 . . . . 1.0 111.543 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.416 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.6 m -158.88 -168.36 2.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.702 0.287 . . . . 1.0 110.278 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.521 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -173.36 134.24 0.52 Allowed 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.472 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.707 HH12 ' NH1' ' A' ' 59' ' ' ARG . 1.8 ttm180 -129.32 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.409 0.623 . . . . 1.0 109.643 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.421 ' H ' ' HG2' ' A' ' 169' ' ' ARG . 10.4 ptt180 -80.27 153.44 28.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.841 -1.072 . . . . 1.0 110.075 178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.742 ' C ' HD12 ' A' ' 171' ' ' ILE . 47.9 t -90.33 86.03 2.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.861 0.363 . . . . 1.0 111.851 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.742 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.0 mp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.264 179.099 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.523 0.558 0 N-CA-C 110.39 -1.084 . . . . 1.0 110.39 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -171.7 105.06 0.2 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.021 -0.271 . . . . 1.0 110.398 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 167.8 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.111 0.481 . . . . 1.0 111.399 -178.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.5 m -124.87 121.4 34.4 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.029 -1.1 . . . . 1.0 108.029 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -106.39 133.82 50.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.015 -0.993 . . . . 1.0 110.364 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.479 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.6 m-85 -115.8 126.85 54.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.539 -0.755 . . . . 1.0 111.256 -178.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -53.88 -28.07 34.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 1.0 110.515 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -119.45 151.4 38.61 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.433 0.635 . . . . 1.0 110.621 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.8 ptt-85 -56.87 -175.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 1.0 110.847 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.3 25.54 0.78 Allowed Glycine 0 N--CA 1.462 0.397 0 N-CA-C 110.912 -0.875 . . . . 1.0 110.912 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 51.61 67.16 1.0 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.198 -0.297 . . . . 1.0 110.198 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -128.86 -157.91 0.85 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.085 0.469 . . . . 1.0 110.555 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.59 -151.31 0.31 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.822 -0.911 . . . . 1.0 110.822 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -70.14 148.36 48.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.871 -0.332 . . . . 1.0 110.87 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -136.0 149.48 48.86 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.37 0.605 . . . . 1.0 110.374 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.4 t80 -143.95 142.45 30.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.255 -0.884 . . . . 1.0 110.014 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 70.5 tt0 -110.83 121.43 45.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.264 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -108.71 126.79 53.38 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.739 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.0 m -117.61 12.08 13.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.751 -0.659 . . . . 1.0 110.56 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.5 m -157.48 168.46 27.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.177 0.513 . . . . 1.0 110.447 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -58.51 140.7 53.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.054 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.71 148.99 49.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.966 -0.561 . . . . 1.0 110.338 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.6 p -118.79 -13.54 9.54 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.748 -0.66 . . . . 1.0 112.047 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -150.28 111.99 4.51 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.314 0.578 . . . . 1.0 109.773 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.3 mt -116.02 -0.55 12.73 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.402 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -53.16 -42.28 90.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.3 -179.775 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 34.3 Cg_exo -58.23 -34.91 99.04 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.03 1.82 . . . . 1.0 111.548 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -95.98 -52.82 3.89 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 121.037 -0.265 . . . . 1.0 111.072 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -118.57 127.41 53.59 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.976 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -95.06 -7.52 39.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.794 -0.639 . . . . 1.0 111.955 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -146.75 -60.46 0.29 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.418 0.525 . . . . 1.0 112.418 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 50.3 t 64.99 75.38 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 122.499 0.319 . . . . 1.0 110.158 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -92.01 4.33 53.29 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.305 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -156.9 157.58 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.969 0.414 . . . . 1.0 110.19 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.81 154.46 32.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.813 -0.631 . . . . 1.0 111.336 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -132.1 121.0 23.1 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.83 -0.804 . . . . 1.0 108.83 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -107.21 114.82 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.63 0.582 . . . . 1.0 110.424 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.37 -44.37 45.34 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.101 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.1 p -160.91 159.07 29.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 109.38 -0.6 . . . . 1.0 109.38 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.14 175.79 50.8 Favored Glycine 0 C--N 1.315 -0.586 0 N-CA-C 111.026 -0.83 . . . . 1.0 111.026 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 85.6 m -113.46 136.99 52.19 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.0 -0.741 . . . . 1.0 109.0 178.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.528 ' CE2' HD13 ' A' ' 81' ' ' LEU . 58.2 m95 -124.66 142.42 51.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.247 0.546 . . . . 1.0 111.415 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.537 ' C ' HD23 ' A' ' 45' ' ' LEU . 10.4 tpp -115.91 129.01 56.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.331 -0.85 . . . . 1.0 109.164 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.537 HD23 ' C ' ' A' ' 44' ' ' MET . 1.0 OUTLIER -107.97 130.17 55.07 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -104.81 131.87 51.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.674 0.75 . . . . 1.0 111.17 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.49 ' HG2' ' H ' ' A' ' 54' ' ' LEU . 0.4 OUTLIER -60.33 -33.82 72.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 1.0 110.808 -178.159 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.878 ' NE2' ' H ' ' A' ' 52' ' ' SER . 3.1 pp0? -108.54 154.64 41.46 Favored Pre-proline 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 1.0 108.861 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.463 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 20.9 Cg_endo -56.38 148.76 60.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 121.372 1.381 . . . . 1.0 111.621 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.858 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.3 OUTLIER 74.83 -123.92 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.812 -0.81 . . . . 1.0 108.812 -178.685 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -150.83 74.65 1.17 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.198 0.523 . . . . 1.0 110.695 179.061 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.878 ' H ' ' NE2' ' A' ' 48' ' ' GLN . 1.4 t -142.72 20.59 2.0 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.764 -0.653 . . . . 1.0 111.893 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -139.2 -159.53 8.03 Favored Glycine 0 N--CA 1.46 0.282 0 N-CA-C 111.181 -0.768 . . . . 1.0 111.181 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.574 HD23 ' OH ' ' A' ' 56' ' ' TYR . 46.5 tp -64.77 146.47 54.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.818 -0.353 . . . . 1.0 110.499 -178.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -122.73 150.5 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 1.0 110.971 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.574 ' OH ' HD23 ' A' ' 54' ' ' LEU . 63.7 m-85 -125.61 123.66 39.5 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.569 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.629 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 46.1 t80 -83.94 121.73 27.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.237 0.541 . . . . 1.0 110.201 -178.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.414 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.5 mp -117.22 143.46 45.85 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.586 -0.734 . . . . 1.0 109.972 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.436 ' O ' ' C ' ' A' ' 60' ' ' ARG . 28.6 mtt85 -129.67 153.67 47.9 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.58 -0.736 . . . . 1.0 109.398 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 59' ' ' ARG . 17.0 ptm180 -32.69 127.58 0.27 Allowed 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.294 0.371 . . . . 1.0 111.431 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 151.4 -175.47 30.26 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.814 -0.914 . . . . 1.0 110.814 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.8 p-10 -116.2 134.2 55.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.085 0.469 . . . . 1.0 110.696 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -127.57 114.56 17.56 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.937 -0.574 . . . . 1.0 109.792 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.414 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.58 -3.78 52.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.152 -0.477 . . . . 1.0 111.605 -179.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -147.64 142.74 27.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.979 -0.749 . . . . 1.0 108.979 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.511 ' C ' ' H ' ' A' ' 68' ' ' GLN . 11.6 p-80 -62.11 -46.06 90.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.119 0.485 . . . . 1.0 111.116 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -49.22 -8.97 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.945 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.511 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.4 mm-40 -82.84 -35.32 26.43 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.513 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -91.49 19.73 5.94 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 118.956 -0.545 . . . . 1.0 111.571 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.513 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 61.6 mtp 87.38 8.33 0.19 Allowed 'General case' 0 N--CA 1.461 0.111 0 O-C-N 124.22 0.95 . . . . 1.0 109.368 -178.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.813 0 N-CA-C 110.238 -1.145 . . . . 1.0 110.238 178.405 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 t . . . . . 0 CA--C 1.519 -0.236 0 N-CA-C 108.836 -0.802 . . . . 1.0 108.836 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -120.32 1.95 10.78 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.796 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 6.1 p -161.44 160.69 29.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.404 0.621 . . . . 1.0 110.808 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.0 p -154.32 146.33 23.6 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.177 -0.919 . . . . 1.0 110.034 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.86 146.05 50.74 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.889 -0.411 . . . . 1.0 109.889 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.528 HD13 ' CE2' ' A' ' 43' ' ' TRP . 31.1 tp -96.96 134.79 39.86 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.815 -0.809 . . . . 1.0 108.815 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.45 ' H ' HD12 ' A' ' 81' ' ' LEU . 2.3 mt -96.24 111.26 55.99 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.485 -0.561 . . . . 1.0 109.485 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.501 1.948 0 C-N-CA 121.872 1.715 . . . . 1.0 113.285 -179.283 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.9 m . . . . . 0 CA--C 1.522 -0.128 0 N-CA-C 109.667 -0.494 . . . . 1.0 109.667 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.589 ' CD2' HD11 ' A' ' 171' ' ' ILE . 4.5 m80 -130.28 104.73 7.45 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 121.124 -0.23 . . . . 1.0 110.999 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -137.06 141.15 42.41 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.804 -0.359 . . . . 1.0 110.951 179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.445 HD12 HG22 ' A' ' 126' ' ' VAL . 19.9 tt -150.63 144.25 17.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.157 -0.474 . . . . 1.0 111.272 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -120.11 97.85 5.79 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.948 -0.569 . . . . 1.0 111.626 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 28.6 mt -78.54 142.67 37.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.966 -0.561 . . . . 1.0 109.936 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -121.18 138.93 53.98 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.339 0.59 . . . . 1.0 111.801 -178.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.524 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 8.9 tp10 -63.1 -37.72 88.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.649 -0.705 . . . . 1.0 110.829 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -128.2 169.27 14.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.364 0.602 . . . . 1.0 111.075 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 93.6 mt-10 . . . . . 0 C--N 1.327 -0.378 0 CA-C-N 114.928 -1.033 . . . . 1.0 110.717 179.723 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.954 0 N-CA-C 111.189 -0.764 . . . . 1.0 111.189 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 67.9 tp60 -68.16 142.91 55.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 1.0 110.878 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.9 ptm -133.27 155.25 49.73 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.612 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.511 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.8 tt -147.97 142.0 19.25 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 N-CA-C 109.817 -0.438 . . . . 1.0 109.817 178.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -112.8 142.39 45.5 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.809 0.814 . . . . 1.0 110.811 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.12 157.05 40.73 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.441 -1.254 . . . . 1.0 110.506 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.6 p -142.27 19.11 2.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.3 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -164.13 -167.18 1.27 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.938 0.399 . . . . 1.0 110.87 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.437 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 51.2 p30 -78.9 148.4 32.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.262 0.553 . . . . 1.0 111.021 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.439 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.8 t -135.65 93.98 3.02 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.592 -0.731 . . . . 1.0 109.759 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -65.31 -27.68 68.78 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.618 -0.433 . . . . 1.0 111.274 -179.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . 0.501 ' O ' ' SG ' ' A' ' 111' ' ' CYS . 28.2 p -139.28 95.67 2.97 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.415 0.626 . . . . 1.0 110.849 -179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 114' ' ' ASP . 19.3 tp -62.47 -41.22 98.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.285 -0.87 . . . . 1.0 110.121 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.596 HE21 HD22 ' A' ' 119' ' ' ASN . 27.8 mp0 -45.23 -11.96 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.327 -0.397 . . . . 1.0 111.435 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.535 ' C ' ' HE ' ' A' ' 115' ' ' ARG . 21.8 m-20 -95.07 -25.11 16.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.095 0.474 . . . . 1.0 110.73 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.535 ' HE ' ' C ' ' A' ' 114' ' ' ASP . 6.4 mmp_? -107.87 -41.73 4.9 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.785 -0.643 . . . . 1.0 111.937 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.511 ' CD1' HG21 ' A' ' 103' ' ' ILE . 2.3 t80 -123.54 122.24 37.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.217 0.532 . . . . 1.0 109.68 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.2 mtt-85 -61.64 -46.16 90.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.514 -0.766 . . . . 1.0 111.059 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.524 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 97.3 m-85 -58.05 139.67 54.12 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.691 -0.686 . . . . 1.0 109.616 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . 0.596 HD22 HE21 ' A' ' 113' ' ' GLN . 19.3 t-20 -100.89 4.14 42.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.886 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -135.11 141.41 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.193 0.52 . . . . 1.0 110.913 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.5 mm -122.94 117.25 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.658 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 123' ' ' SER . 27.2 m-70 -105.9 27.56 8.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.188 -0.46 . . . . 1.0 112.03 -178.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 10.3 t 163.39 152.65 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 123.495 0.497 . . . . 1.0 109.818 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.48 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.0 OUTLIER -163.58 158.09 20.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.476 -178.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.74 116.98 24.67 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 109.411 -0.588 . . . . 1.0 109.411 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.445 HG22 HD12 ' A' ' 90' ' ' ILE . 39.1 t -101.63 105.58 18.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 116.143 -0.481 . . . . 1.0 109.791 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.865 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.78 -45.1 21.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.725 179.633 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -156.99 149.94 23.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.745 -0.382 . . . . 1.0 111.043 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 70.07 79.57 0.32 Allowed Glycine 0 C--N 1.329 0.163 0 CA-C-N 116.198 -0.456 . . . . 1.0 112.384 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.431 ' C ' ' O ' ' A' ' 129' ' ' GLY . 45.7 p -32.17 149.44 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 121.219 0.533 . . . . 1.0 111.202 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.512 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 44.1 m95 -123.38 164.99 17.77 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.466 -0.788 . . . . 1.0 111.521 -178.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 29.0 t -131.88 133.99 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 178.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.47 142.22 39.17 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -120.54 136.82 54.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.084 0.24 . . . . 1.0 110.917 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -48.94 -44.93 41.09 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.474 -0.49 . . . . 1.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.494 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.7 178.01 5.67 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.321 0.582 . . . . 1.0 110.684 -178.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.2 m -82.52 171.71 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.523 -0.762 . . . . 1.0 111.022 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 62.78 20.43 12.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 1.0 110.18 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 139' ' ' TYR . 1.0 OUTLIER 35.59 78.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.067 -0.515 . . . . 1.0 111.644 179.056 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.41 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 30.5 ttm180 -148.3 38.58 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.02 0.438 . . . . 1.0 110.408 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.438 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -153.6 -137.67 2.52 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.13 -0.788 . . . . 1.0 111.13 -178.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? -72.42 164.38 26.46 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.658 0.266 . . . . 1.0 110.439 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.629 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 5.7 pt20 -149.31 139.2 21.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.886 -0.597 . . . . 1.0 110.839 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -131.09 135.94 47.95 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.698 -0.852 . . . . 1.0 108.698 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.681 HD22 ' SD ' ' A' ' 147' ' ' MET . 0.8 OUTLIER -91.13 129.45 37.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.382 0.61 . . . . 1.0 109.649 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.627 ' N ' HD23 ' A' ' 145' ' ' LEU . 1.6 mm? -114.43 102.92 10.54 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.212 -1.033 . . . . 1.0 108.212 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.681 ' SD ' HD22 ' A' ' 145' ' ' LEU . 1.8 mpp? -80.53 165.95 42.76 Favored Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 109.72 -0.474 . . . . 1.0 109.72 -179.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -60.53 122.99 12.15 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.624 1.55 . . . . 1.0 111.406 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.31 -154.14 23.78 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 -179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -126.46 133.4 51.22 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.893 0.378 . . . . 1.0 110.327 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.1 m-85 -122.94 128.25 50.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.549 -0.537 . . . . 1.0 109.549 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -114.08 -5.13 13.09 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 110.341 -0.244 . . . . 1.0 110.341 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -154.96 163.22 40.62 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.494 0.664 . . . . 1.0 110.513 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.02 -22.01 58.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.175 -0.92 . . . . 1.0 111.807 -178.582 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.23 -22.39 66.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.134 -0.485 . . . . 1.0 111.361 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . 0.498 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.2 t0 -47.59 -50.03 25.16 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.333 -178.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.599 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.3 p90 -99.59 19.32 16.0 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.029 0.442 . . . . 1.0 110.131 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.93 72.72 0.47 Allowed Glycine 0 CA--C 1.522 0.481 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.43 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.599 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.25 -171.66 2.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.689 0.757 . . . . 1.0 110.84 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.13 -35.69 3.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.696 -1.138 . . . . 1.0 112.089 -178.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.597 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.2 OUTLIER -146.58 -25.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.006 -0.278 . . . . 1.0 111.64 -178.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.819 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 97.96 -19.87 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 124.301 1.001 . . . . 1.0 110.255 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -42.15 116.29 0.8 Allowed 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 115.145 -0.934 . . . . 1.0 111.345 -178.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 162' ' ' ALA . 60.8 t -123.3 124.41 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.393 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.454 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -103.42 -24.76 7.7 Favored Glycine 0 N--CA 1.462 0.407 0 N-CA-C 111.055 -0.818 . . . . 1.0 111.055 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 109' ' ' CYS . 5.7 t -160.14 171.34 19.43 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.644 -0.422 . . . . 1.0 110.311 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 166' ' ' SER . 0.9 OUTLIER -157.92 144.29 17.58 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.524 . . . . 1.0 111.699 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -133.42 162.35 32.1 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.604 -0.517 . . . . 1.0 109.604 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.465 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.42 153.9 17.57 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.446 -0.797 . . . . 1.0 109.261 178.922 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.424 HG21 ' OG ' ' A' ' 130' ' ' SER . 48.1 t -89.7 82.05 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.969 -0.457 . . . . 1.0 111.788 -178.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.589 HD11 ' CD2' ' A' ' 88' ' ' HIS . 1.2 mp . . . . . 0 N--CA 1.471 0.576 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.166 179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.621 0 N-CA-C 110.609 -0.997 . . . . 1.0 110.609 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -171.76 105.81 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.856 -0.338 . . . . 1.0 110.589 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.18 168.8 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-O 120.908 0.385 . . . . 1.0 110.942 -178.841 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.489 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.3 m -126.28 120.73 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.263 -1.014 . . . . 1.0 108.263 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -105.4 132.91 50.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.1 -0.954 . . . . 1.0 110.242 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.489 ' CE1' HG22 ' A' ' 5' ' ' THR . 70.6 m-85 -115.58 126.55 54.35 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.224 -0.898 . . . . 1.0 111.201 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.13 -31.66 31.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.487 -0.779 . . . . 1.0 110.464 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -116.75 160.26 21.05 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.285 0.564 . . . . 1.0 110.486 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.414 ' C ' ' N ' ' A' ' 12' ' ' PHE . 11.2 ptm180 -63.87 -173.16 0.07 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.338 -0.846 . . . . 1.0 110.702 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.43 24.66 0.4 Allowed Glycine 0 N--CA 1.459 0.224 0 N-CA-C 110.732 -0.947 . . . . 1.0 110.732 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 8.3 m-85 50.43 70.09 0.55 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.527 -0.336 . . . . 1.0 110.275 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -131.83 -155.37 0.68 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.045 0.45 . . . . 1.0 110.309 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.64 -150.06 0.16 Allowed Glycine 0 CA--C 1.526 0.764 0 N-CA-C 111.036 -0.826 . . . . 1.0 111.036 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -69.36 145.92 52.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.774 0.321 . . . . 1.0 110.682 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -135.86 149.86 49.18 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.179 0.514 . . . . 1.0 110.296 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.1 t80 -144.32 141.57 29.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.36 -0.837 . . . . 1.0 110.204 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 33.0 tt0 -110.53 122.63 48.21 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.304 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -109.89 126.23 53.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.638 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.9 p -117.99 9.55 12.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.934 -0.576 . . . . 1.0 110.475 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.5 p -154.91 167.1 31.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.713 -178.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -58.08 137.45 56.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.557 -0.747 . . . . 1.0 111.512 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.37 141.47 47.91 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.685 -0.689 . . . . 1.0 110.156 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.9 p -108.92 -14.49 14.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.679 -0.691 . . . . 1.0 111.841 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -152.6 118.16 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.103 0.478 . . . . 1.0 110.602 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.437 HD11 ' SG ' ' A' ' 79' ' ' CYS . 11.0 mt -117.46 0.84 12.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.582 -0.736 . . . . 1.0 110.266 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.609 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 55.5 mt-30 -48.8 -51.4 54.44 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.124 -0.489 . . . . 1.0 110.759 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.609 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.8 Cg_endo -55.93 -32.94 87.46 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 121.544 1.496 . . . . 1.0 112.33 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -94.27 -52.02 4.54 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.296 -0.562 . . . . 1.0 110.644 -178.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -117.28 127.73 54.37 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.0 110.551 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.1 t -95.51 -10.23 30.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.527 -0.761 . . . . 1.0 111.631 -179.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -147.12 -55.32 0.24 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.392 -0.367 . . . . 1.0 111.824 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 t 59.96 75.48 0.4 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -92.88 4.12 54.46 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.339 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.543 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -154.69 155.44 34.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.906 0.384 . . . . 1.0 110.036 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.2 154.53 35.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.153 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -134.46 122.41 22.45 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 108.554 -0.906 . . . . 1.0 108.554 178.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.9 t -107.61 117.39 53.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.276 0.56 . . . . 1.0 109.869 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -79.81 -43.33 22.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.395 -0.821 . . . . 1.0 110.76 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 t -161.64 155.91 22.43 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.48 173.87 50.0 Favored Glycine 0 C--N 1.317 -0.523 0 N-CA-C 110.97 -0.852 . . . . 1.0 110.97 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.2 m -110.28 140.77 44.1 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.456 -0.572 . . . . 1.0 109.456 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.418 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 56.1 m95 -128.3 155.76 44.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.322 0.582 . . . . 1.0 111.063 -179.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.511 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 15.7 ttm -131.17 131.28 43.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.827 -0.805 . . . . 1.0 108.827 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.495 HD23 ' C ' ' A' ' 44' ' ' MET . 0.8 OUTLIER -108.62 131.1 55.22 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 108.948 -0.76 . . . . 1.0 108.948 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.427 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 61.6 m-85 -107.37 131.54 54.14 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.725 0.774 . . . . 1.0 110.667 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.616 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.1 pt-20 -58.35 -36.35 73.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.917 -1.038 . . . . 1.0 110.974 -178.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.452 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.6 mt-30 -109.88 152.81 43.19 Favored Pre-proline 0 C--O 1.232 0.153 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.47 -178.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 157.28 54.02 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.378 2.052 . . . . 1.0 112.591 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.698 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 64.86 36.57 7.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.871 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.427 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.7 m-85 50.83 75.1 0.2 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.051 -0.977 . . . . 1.0 111.038 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.4 m -142.61 154.27 44.25 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.884 0.373 . . . . 1.0 110.139 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.2 -148.13 22.06 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.854 -0.688 . . . . 1.0 111.728 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.616 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.8 tp -77.9 146.81 35.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.466 -0.367 . . . . 1.0 110.597 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.511 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 18.0 pt20 -122.86 153.72 39.24 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.065 -0.346 . . . . 1.0 110.065 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.457 ' CE1' ' O ' ' A' ' 70' ' ' MET . 20.6 m-85 -129.38 129.67 45.05 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.923 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.427 ' C ' HD22 ' A' ' 58' ' ' LEU . 45.6 t80 -82.53 121.22 26.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.389 0.614 . . . . 1.0 109.814 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.427 HD22 ' C ' ' A' ' 57' ' ' PHE . 2.8 mm? -109.94 136.75 48.73 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.56 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 60' ' ' ARG . 23.0 mtm-85 -129.05 154.89 46.22 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.485 -0.779 . . . . 1.0 109.934 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 78.8 ttt-85 -38.29 125.9 1.33 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.668 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.0 -177.84 32.85 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.625 -0.99 . . . . 1.0 110.625 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.1 p-10 -116.16 125.38 52.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.151 0.501 . . . . 1.0 110.517 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -119.23 112.49 19.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 1.0 109.35 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.428 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.46 -2.43 56.27 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.923 -0.58 . . . . 1.0 111.762 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -149.48 131.86 15.63 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.201 -0.666 . . . . 1.0 109.201 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.699 ' CE1' HE21 ' A' ' 67' ' ' GLN . 5.4 p80 -53.67 -37.68 63.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.974 0.416 . . . . 1.0 110.963 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.699 HE21 ' CE1' ' A' ' 66' ' ' HIS . 98.1 mm-40 -56.4 -7.89 0.45 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.948 -0.569 . . . . 1.0 110.537 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.6 mm-40 -82.31 -32.91 29.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 120.546 -0.461 . . . . 1.0 111.107 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.2 p90 -96.21 13.47 27.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.868 -0.333 . . . . 1.0 110.586 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.457 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 58.3 mtt 74.77 31.61 0.91 Allowed 'General case' 0 C--O 1.225 -0.211 0 O-C-N 124.481 1.113 . . . . 1.0 110.306 -179.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.409 ' HA3' ' HE1' ' A' ' 69' ' ' TRP . . . . . . . . 0 C--N 1.333 0.404 0 C-N-CA 120.448 -0.882 . . . . 1.0 111.877 -179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.7 t . . . . . 0 CA--C 1.517 -0.31 0 N-CA-C 109.585 -0.524 . . . . 1.0 109.585 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -128.38 4.58 5.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.241 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.4 p -163.38 162.66 25.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.051 0.453 . . . . 1.0 110.851 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . 0.437 ' SG ' HD11 ' A' ' 26' ' ' LEU . 19.2 p -153.66 144.85 22.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.752 -0.658 . . . . 1.0 109.744 -178.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -127.37 150.08 49.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.411 HD13 ' CE2' ' A' ' 43' ' ' TRP . 17.2 tp -95.37 125.84 40.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.461 -1.311 . . . . 1.0 107.461 177.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.403 ' N ' HD12 ' A' ' 81' ' ' LEU . 22.9 mt -78.43 114.75 45.64 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 120.539 -0.464 . . . . 1.0 110.812 -178.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 47.9 Cg_endo . . . . . 0 N--CA 1.49 1.274 0 C-N-CA 122.017 1.811 . . . . 1.0 111.755 179.804 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 m . . . . . 0 CA--C 1.515 -0.373 0 N-CA-C 109.967 -0.383 . . . . 1.0 109.967 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.1 m170 -124.31 99.51 6.25 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.898 -0.321 . . . . 1.0 111.736 -179.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -135.4 137.67 42.52 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 120.558 -0.457 . . . . 1.0 110.359 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.522 HG22 ' CH2' ' A' ' 131' ' ' TRP . 16.8 tt -149.18 145.48 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.604 -0.271 . . . . 1.0 111.026 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.61 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.4 mtp180 -124.39 98.83 5.92 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.051 -0.522 . . . . 1.0 111.633 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 20.5 mt -79.01 137.79 37.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.873 -0.603 . . . . 1.0 110.878 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 44.6 m-85 -116.5 135.29 53.95 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.638 -0.71 . . . . 1.0 110.711 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.527 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 1.0 OUTLIER -53.97 -67.01 0.3 Allowed 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.516 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 123' ' ' SER . 77.0 mtp85 -96.03 169.45 9.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.465 -179.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 . . . . . 0 C--N 1.332 -0.168 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.495 179.528 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.524 0.636 0 N-CA-C 111.013 -0.835 . . . . 1.0 111.013 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.55 147.95 13.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.356 . . . . 1.0 110.348 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.61 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 8.1 ttp -130.88 151.17 51.6 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.352 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.462 ' N ' ' HG2' ' A' ' 102' ' ' MET . 10.7 tt -146.42 141.06 20.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 177.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.41 143.96 42.66 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.677 0.751 . . . . 1.0 110.506 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.768 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 88.2 m-85 -130.52 156.49 44.72 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 114.742 -1.117 . . . . 1.0 110.678 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.2 p -143.93 32.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.731 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -171.14 -166.71 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.557 178.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 51.8 t0 -81.78 148.11 29.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.503 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.494 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.7 t -136.96 98.61 3.8 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.165 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.77 -23.84 64.36 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.878 0.371 . . . . 1.0 111.554 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.2 p -144.48 88.86 1.95 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.388 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.768 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.9 tp -60.65 -40.91 93.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.368 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.63 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 17.4 mp0 -43.85 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.999 -0.546 . . . . 1.0 112.072 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 112' ' ' LEU . 95.9 m-20 -94.78 -22.08 18.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.191 0.519 . . . . 1.0 110.42 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.5 mmt180 -107.93 -36.28 6.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.346 -0.843 . . . . 1.0 112.448 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.677 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.55 136.52 54.95 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 122.47 1.129 . . . . 1.0 110.812 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 15.0 mmp_? -73.43 -71.16 0.33 Allowed 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.609 -1.307 . . . . 1.0 110.669 -178.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.633 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.9 m-85 -34.2 147.88 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.295 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -106.98 8.19 30.31 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.758 0.313 . . . . 1.0 110.949 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -138.0 139.1 39.48 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.307 0.575 . . . . 1.0 111.118 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.73 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.7 mm -120.96 119.64 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 115.438 -0.801 . . . . 1.0 109.029 177.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -110.02 20.86 17.49 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.433 -178.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.2 p 170.94 150.76 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.089 0.471 . . . . 1.0 109.859 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.463 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.0 OUTLIER -162.11 157.26 23.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.659 -0.7 . . . . 1.0 110.313 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.57 112.95 18.62 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.349 -0.612 . . . . 1.0 109.349 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.515 HG22 HD12 ' A' ' 90' ' ' ILE . 21.4 t -100.34 105.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.048 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.882 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.6 OUTLIER -78.36 -43.04 28.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.981 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 26.0 tp10 -160.54 158.82 29.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.913 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.521 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 68.23 76.25 0.44 Allowed Glycine 0 CA--C 1.509 -0.324 0 CA-C-N 115.796 -0.638 . . . . 1.0 112.359 178.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.487 ' OG ' HD11 ' A' ' 145' ' ' LEU . 30.8 t -31.71 149.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.074 0.464 . . . . 1.0 111.021 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.522 ' CH2' HG22 ' A' ' 90' ' ' ILE . 33.0 m95 -124.42 169.14 12.14 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.72 -0.673 . . . . 1.0 110.835 -178.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 25.1 t -138.2 103.52 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.364 -0.38 . . . . 1.0 109.995 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.7 mt -77.38 141.77 39.65 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.787 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -120.54 133.82 55.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.618 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.564 ' CD ' HH21 ' A' ' 142' ' ' ARG . 48.0 tp10 -44.91 -49.95 10.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.453 -0.34 . . . . 1.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.77 171.06 10.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.411 0.624 . . . . 1.0 110.186 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.6 m -75.76 179.47 5.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.086 -0.961 . . . . 1.0 111.12 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 139' ' ' TYR . 10.3 m120 58.16 21.99 8.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.42 -1.264 . . . . 1.0 109.555 -179.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.445 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.4 m-85 33.82 77.67 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.21 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -148.75 44.1 1.0 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.245 0.545 . . . . 1.0 109.859 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.44 -135.15 2.1 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 111.423 -0.671 . . . . 1.0 111.423 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.628 HH12 ' CG2' ' A' ' 160' ' ' THR . 84.0 mtm180 -84.19 166.59 17.44 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.936 -0.394 . . . . 1.0 109.936 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.75 137.4 26.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.912 -0.586 . . . . 1.0 110.841 -179.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -128.69 145.01 51.28 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.109 -0.7 . . . . 1.0 109.109 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.554 ' C ' HD22 ' A' ' 146' ' ' LEU . 39.5 tp -94.28 122.56 36.95 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.479 0.487 . . . . 1.0 111.937 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.851 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.1 mm? -112.87 100.29 8.54 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.52 -0.764 . . . . 1.0 109.483 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 163.42 62.44 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 114.914 -1.039 . . . . 1.0 109.904 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 27.6 Cg_endo -63.67 107.23 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.301 2.001 . . . . 1.0 111.532 179.104 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -175.73 -153.04 9.95 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.598 -1.001 . . . . 1.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.453 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.0 p-10 -124.8 125.82 44.63 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.054 0.454 . . . . 1.0 110.61 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.4 m-85 -117.84 129.59 55.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.953 -0.567 . . . . 1.0 109.83 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -115.66 -4.24 12.22 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.809 0.338 . . . . 1.0 110.134 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -155.54 161.62 40.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.618 0.723 . . . . 1.0 110.148 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.429 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.8 p90 -75.02 -19.2 60.17 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.654 -1.157 . . . . 1.0 112.227 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -70.05 -19.36 63.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.279 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -50.62 -49.14 57.44 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.048 -179.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.616 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 19.4 p90 -96.81 22.45 8.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.483 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.77 75.92 0.2 Allowed Glycine 0 CA--C 1.521 0.457 0 N-CA-C 111.326 -0.71 . . . . 1.0 111.326 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.616 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -122.0 145.52 48.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.06 0.457 . . . . 1.0 110.327 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . 0.628 ' CG2' HH12 ' A' ' 142' ' ' ARG . 14.7 t -74.15 -15.06 61.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.144 -0.934 . . . . 1.0 110.028 177.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.561 HD22 ' N ' ' A' ' 161' ' ' ASN . 0.0 OUTLIER -166.44 -167.4 1.01 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.132 0.492 . . . . 1.0 110.308 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.73 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -109.37 -15.9 14.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.869 -0.605 . . . . 1.0 110.264 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -37.74 121.97 0.94 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.023 0.439 . . . . 1.0 111.889 -178.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.719 HG23 ' O ' ' A' ' 162' ' ' ALA . 24.7 t -125.39 158.68 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.438 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.502 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -136.23 -36.77 0.19 Allowed Glycine 0 C--N 1.334 0.431 0 N-CA-C 111.461 -0.656 . . . . 1.0 111.461 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.4 m -156.77 -170.47 3.32 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.046 -0.353 . . . . 1.0 110.046 -179.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.686 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -174.74 138.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.492 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -132.33 162.67 30.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.409 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -91.76 146.24 23.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.773 ' C ' HD12 ' A' ' 171' ' ' ILE . 42.2 t -79.22 84.62 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.186 -0.461 . . . . 1.0 111.506 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.773 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.9 mp . . . . . 0 N--CA 1.464 0.256 0 CA-C-O 121.076 0.465 . . . . 1.0 109.972 178.953 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.539 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.526 0.772 0 N-CA-C 110.371 -1.092 . . . . 1.0 110.371 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -175.86 109.03 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.636 -0.426 . . . . 1.0 110.366 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.4 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -120.06 169.21 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.952 0.406 . . . . 1.0 110.833 -179.08 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.467 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.9 m -127.89 119.72 26.18 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.203 -1.036 . . . . 1.0 108.203 177.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.8 mt -105.55 133.14 50.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.68 -1.145 . . . . 1.0 109.819 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.467 ' CE1' HG22 ' A' ' 5' ' ' THR . 70.8 m-85 -115.1 130.09 56.84 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.623 -0.717 . . . . 1.0 111.644 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.478 ' O ' ' O ' ' A' ' 32' ' ' ARG . 80.8 tt0 -54.9 -24.44 23.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.402 -0.817 . . . . 1.0 110.459 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -125.39 161.06 27.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.284 0.564 . . . . 1.0 110.004 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 8.3 ptp180 -65.28 -175.33 0.22 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.311 -0.859 . . . . 1.0 110.929 -177.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.36 29.31 1.69 Allowed Glycine 0 C--N 1.335 0.482 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 48.36 68.03 0.75 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.489 -0.355 . . . . 1.0 110.288 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -129.78 -158.5 0.89 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.966 0.412 . . . . 1.0 110.454 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.48 -148.66 0.77 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.861 -0.895 . . . . 1.0 110.861 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.11 148.51 45.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.767 0.318 . . . . 1.0 110.463 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.7 146.84 48.16 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.381 0.61 . . . . 1.0 110.256 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.521 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -142.26 142.41 32.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.107 -0.951 . . . . 1.0 109.76 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.521 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 75.1 tt0 -111.7 123.48 50.33 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.229 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.6 126.54 54.57 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.306 -0.406 . . . . 1.0 110.67 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.3 p -118.17 11.06 13.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.861 -0.609 . . . . 1.0 110.425 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.6 p -156.45 169.36 24.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.579 -178.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -58.94 136.09 57.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.786 -0.643 . . . . 1.0 111.104 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.39 146.53 52.03 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.676 -0.693 . . . . 1.0 110.423 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -117.52 -19.98 9.22 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.478 -0.783 . . . . 1.0 112.774 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -141.29 106.28 4.96 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.461 0.648 . . . . 1.0 109.652 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 mt -109.62 -3.38 16.9 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.171 -0.922 . . . . 1.0 110.058 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.578 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 1.4 mt-30 -52.23 -51.11 75.09 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.921 -0.581 . . . . 1.0 110.735 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.578 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.0 Cg_endo -56.04 -35.08 94.21 Favored 'Trans proline' 0 N--CA 1.487 1.127 0 C-N-CA 121.22 1.28 . . . . 1.0 112.759 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -90.79 -40.97 11.49 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.314 -0.555 . . . . 1.0 111.027 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.4 mt -126.14 127.76 46.25 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.423 -0.808 . . . . 1.0 111.284 -178.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 t -90.36 -14.15 33.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.191 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' GLU . 44.3 ttm180 -175.64 120.62 0.18 Allowed 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 108.89 -0.781 . . . . 1.0 108.89 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.5 t -100.22 106.36 18.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 1.0 110.258 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.9 m-20 -101.59 -5.17 25.45 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.521 179.504 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.449 ' OG ' ' C ' ' A' ' 64' ' ' ALA . 71.9 m -155.74 156.99 35.83 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.977 0.417 . . . . 1.0 110.54 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.56 155.48 37.48 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.949 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -133.99 123.81 25.22 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.71 -0.848 . . . . 1.0 108.71 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.8 t -109.0 134.71 50.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.098 -0.704 . . . . 1.0 109.098 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -97.42 -42.83 7.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.505 -0.771 . . . . 1.0 110.51 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 m -161.45 160.46 29.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.426 -0.583 . . . . 1.0 109.426 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.51 176.26 48.73 Favored Glycine 0 C--N 1.316 -0.538 0 N-CA-C 111.085 -0.806 . . . . 1.0 111.085 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.8 m -112.4 140.96 46.69 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.884 -0.784 . . . . 1.0 108.884 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.619 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 48.2 m95 -127.42 150.44 49.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.63 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.523 ' C ' HD23 ' A' ' 45' ' ' LEU . 0.8 OUTLIER -124.37 130.05 51.8 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.179 -0.674 . . . . 1.0 109.179 178.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.523 HD23 ' C ' ' A' ' 44' ' ' MET . 0.5 OUTLIER -109.78 131.71 54.81 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.673 -0.862 . . . . 1.0 108.673 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -106.19 131.45 53.43 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.374 0.607 . . . . 1.0 111.279 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.671 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -56.04 -34.8 66.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.398 -0.819 . . . . 1.0 110.367 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -104.82 153.64 39.17 Favored Pre-proline 0 C--N 1.327 -0.41 0 O-C-N 121.945 -0.472 . . . . 1.0 109.918 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -55.68 150.84 42.23 Favored 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 121.363 1.375 . . . . 1.0 110.873 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.837 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER 79.68 -122.95 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.735 0.814 . . . . 1.0 109.115 -178.82 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.525 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 15.3 m-85 -138.73 78.42 1.68 Allowed 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.017 -0.538 . . . . 1.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.0 m -152.3 163.53 39.26 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.738 -0.467 . . . . 1.0 109.738 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.04 -153.16 33.81 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 115.627 -0.715 . . . . 1.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.671 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.3 tp -77.73 144.47 37.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.343 -0.429 . . . . 1.0 109.987 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -121.41 154.17 36.87 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.691 0.282 . . . . 1.0 110.261 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.468 ' CE1' ' O ' ' A' ' 70' ' ' MET . 36.2 m-85 -127.04 129.56 48.27 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.113 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.425 ' C ' HD22 ' A' ' 58' ' ' LEU . 36.8 t80 -81.64 119.42 23.79 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.689 -0.687 . . . . 1.0 109.704 -179.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.425 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.3 mm? -111.36 134.42 52.96 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.9 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.4 ' O ' ' C ' ' A' ' 60' ' ' ARG . 18.3 mtm-85 -129.52 154.84 46.63 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.301 -0.863 . . . . 1.0 109.931 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.4 ' C ' ' O ' ' A' ' 59' ' ' ARG . 34.5 ptt180 -36.6 128.54 0.81 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.186 0.517 . . . . 1.0 111.696 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.18 179.92 29.88 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 111.117 -0.793 . . . . 1.0 111.117 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -115.79 124.1 49.9 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -118.92 113.5 21.12 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.131 -0.692 . . . . 1.0 109.131 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.449 ' C ' ' OG ' ' A' ' 35' ' ' SER . . . -93.99 3.42 55.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.015 0.436 . . . . 1.0 111.756 -179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 67.3 m-20 -152.14 140.68 20.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.77 -0.826 . . . . 1.0 108.77 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.659 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 5.6 p80 -64.36 -40.66 96.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.974 0.416 . . . . 1.0 110.846 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.67 -8.17 0.14 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.899 -0.591 . . . . 1.0 110.248 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.472 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.5 mm-40 -80.93 -32.95 34.43 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 120.43 -0.508 . . . . 1.0 111.306 -178.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.41 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -96.1 13.33 27.56 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 121.05 -0.26 . . . . 1.0 110.69 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.468 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 54.9 mtt 76.26 30.01 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 124.278 0.986 . . . . 1.0 109.807 -179.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.762 0 C-N-CA 119.852 -1.166 . . . . 1.0 112.181 -179.052 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.5 p . . . . . 0 N--CA 1.467 0.379 0 CA-C-O 121.032 0.444 . . . . 1.0 110.106 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -137.39 14.25 3.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.743 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.3 p -162.04 161.13 28.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.218 0.532 . . . . 1.0 110.795 178.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.2 p -155.67 146.94 22.63 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.471 -0.786 . . . . 1.0 110.662 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.603 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.7 ptm180 -126.82 150.55 49.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.467 -0.568 . . . . 1.0 109.467 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -102.41 124.92 48.85 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.911 -1.144 . . . . 1.0 107.911 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.721 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.2 mt -84.2 116.58 65.62 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.146 -178.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.501 1.96 0 C-N-CA 121.906 1.737 . . . . 1.0 113.229 179.676 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m . . . . . 0 CA--C 1.52 -0.203 0 N-CA-C 110.011 -0.366 . . . . 1.0 110.011 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.442 ' CD2' HD11 ' A' ' 171' ' ' ILE . 9.0 m80 -135.04 110.78 9.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 1.0 111.162 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.8 mtp180 -143.54 135.61 26.75 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.746 -0.381 . . . . 1.0 110.068 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.5 HD12 HG22 ' A' ' 126' ' ' VAL . 17.6 tt -146.59 146.59 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.622 -0.263 . . . . 1.0 110.614 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -125.88 104.89 8.56 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.488 0.492 . . . . 1.0 111.424 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.4 mp -85.42 139.07 31.82 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.416 0.627 . . . . 1.0 111.87 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -116.44 136.25 53.15 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.798 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.51 ' OE1' ' CB ' ' A' ' 118' ' ' PHE . 78.2 mm-40 -55.72 -64.4 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.455 -0.793 . . . . 1.0 112.702 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -93.93 167.75 11.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.224 -177.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.6 mt-10 . . . . . 0 CA--C 1.507 -0.697 0 CA-C-N 115.316 -0.857 . . . . 1.0 110.264 178.778 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 0.331 0 N-CA-C 110.175 -1.17 . . . . 1.0 110.175 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -60.83 145.99 47.94 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.607 -0.437 . . . . 1.0 109.837 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.2 ttp -131.08 145.55 52.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.324 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.1 tt -138.8 138.35 42.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -111.59 143.66 42.1 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.511 0.672 . . . . 1.0 110.66 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.812 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 77.6 m-85 -129.15 153.15 47.97 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.586 -1.188 . . . . 1.0 110.537 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 58.4 p -143.73 10.67 1.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 1.0 111.01 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.978 ' O ' ' O ' ' A' ' 108' ' ' ASP . 6.3 pt-20 -161.16 83.19 0.64 Allowed 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 118.657 -0.687 . . . . 1.0 110.016 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.978 ' O ' ' O ' ' A' ' 107' ' ' GLU . 53.4 p-10 14.99 164.83 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.021 1.119 . . . . 1.0 114.021 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -149.62 109.27 4.02 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 120.144 -1.597 . . . . 1.0 110.021 178.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 m -64.07 -31.88 73.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.651 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 t -135.41 89.68 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.246 0.546 . . . . 1.0 110.1 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.812 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.8 tp -61.4 -42.47 98.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.378 -0.828 . . . . 1.0 109.829 -178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.406 ' HG2' ' H ' ' A' ' 113' ' ' GLN . 79.0 mm-40 -42.93 -8.31 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.864 -0.607 . . . . 1.0 112.028 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 112' ' ' LEU . 47.0 t0 -97.2 -22.32 16.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.118 0.485 . . . . 1.0 110.66 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 112' ' ' LEU . 5.0 mmp_? -106.09 -37.21 6.68 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.183 0.809 . . . . 1.0 113.183 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.656 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.21 136.44 54.97 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.887 0.851 . . . . 1.0 110.128 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 118' ' ' PHE . 68.6 mtt85 -72.73 -69.61 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.632 -1.293 . . . . 1.0 110.371 -177.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.596 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -33.54 146.77 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.426 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -106.69 7.33 30.45 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.729 0.299 . . . . 1.0 111.326 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -138.41 139.74 39.04 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.11 0.481 . . . . 1.0 111.098 -178.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.722 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.0 mm -122.9 124.92 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.493 -0.776 . . . . 1.0 109.24 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.521 ' O ' ' OG ' ' A' ' 123' ' ' SER . 40.9 m-70 -116.0 21.62 13.62 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.543 -178.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.521 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 11.4 m 171.94 153.25 0.07 Allowed 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.161 0.505 . . . . 1.0 110.558 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.471 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 2.0 pp -165.72 157.7 14.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.321 -0.854 . . . . 1.0 110.788 -178.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.51 120.53 31.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.056 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.5 HG22 HD12 ' A' ' 90' ' ' ILE . 40.7 t -103.23 104.38 16.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 109.681 -0.488 . . . . 1.0 109.681 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.934 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.25 -40.68 36.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.231 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.476 ' O ' ' O ' ' A' ' 129' ' ' GLY . 36.9 mm-40 -133.81 162.01 33.16 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.835 0.826 . . . . 1.0 110.933 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 38.11 -165.51 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 CA-C-N 113.474 -1.694 . . . . 1.0 110.91 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.478 ' OG ' ' CG2' ' A' ' 170' ' ' VAL . 32.1 p -119.73 162.41 19.09 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -134.49 160.9 36.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.069 -0.514 . . . . 1.0 109.995 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.09 139.39 50.36 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 N-CA-C 109.296 -0.631 . . . . 1.0 109.296 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.492 ' HG ' HD11 ' A' ' 146' ' ' LEU . 38.5 mt -111.11 141.73 44.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 110.184 -0.302 . . . . 1.0 110.184 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -117.41 132.84 56.5 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.26 0.35 . . . . 1.0 110.812 179.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -45.3 -36.85 4.33 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.371 -0.377 . . . . 1.0 110.725 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -137.01 175.46 9.59 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.289 0.566 . . . . 1.0 110.767 -179.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.1 p -81.75 172.48 13.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.496 -0.775 . . . . 1.0 110.678 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 64.5 19.19 11.72 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.833 -1.076 . . . . 1.0 109.839 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.511 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 13.2 m-85 35.8 79.36 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.919 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -148.97 38.89 0.83 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.393 0.616 . . . . 1.0 109.989 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.437 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -151.72 -140.8 3.21 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 -178.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 28.8 mmt180 -74.64 165.44 25.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.918 -0.401 . . . . 1.0 109.918 -179.865 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.52 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 1.3 pt20 -146.83 135.3 21.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.955 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . 0.408 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 7.2 m-85 -128.01 131.62 49.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.457 ' HB2' ' HE2' ' A' ' 44' ' ' MET . 41.6 tp -87.72 126.37 34.94 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.29 0.567 . . . . 1.0 110.8 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.492 HD11 ' HG ' ' A' ' 133' ' ' LEU . 28.6 mt -115.17 108.51 16.7 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.039 -0.982 . . . . 1.0 109.694 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.603 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 3.3 mtm -88.43 163.23 37.11 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.699 -0.4 . . . . 1.0 110.247 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -52.84 124.32 15.15 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 121.608 1.538 . . . . 1.0 111.393 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 165.64 -155.27 26.49 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 110.565 -1.014 . . . . 1.0 110.565 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 68.3 t0 -127.38 130.42 49.36 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.803 0.335 . . . . 1.0 110.299 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.2 m-85 -121.36 129.26 52.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 1.0 109.952 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . 0.5 ' C ' ' OG ' ' A' ' 123' ' ' SER . 13.5 ptm180 -118.95 5.99 11.37 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.838 0.351 . . . . 1.0 110.199 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.683 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.4 ptm180 -163.76 160.02 22.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.463 0.649 . . . . 1.0 110.319 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.465 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.4 p90 -75.99 -19.63 58.54 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.697 -1.138 . . . . 1.0 112.613 -177.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.683 ' NE2' HH21 ' A' ' 153' ' ' ARG . 40.3 mt-30 -70.52 -17.81 62.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.843 0.354 . . . . 1.0 111.228 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -54.68 -46.81 74.12 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.388 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.698 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 14.3 p90 -97.45 20.47 11.62 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.266 -0.425 . . . . 1.0 110.738 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.82 75.32 0.23 Allowed Glycine 0 CA--C 1.521 0.439 0 N-CA-C 111.21 -0.756 . . . . 1.0 111.21 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.698 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.32 147.9 43.78 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 121.088 0.47 . . . . 1.0 110.336 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . 0.411 ' O ' ' CG ' ' A' ' 161' ' ' ASN . 15.1 t -76.02 -20.46 57.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.894 -1.048 . . . . 1.0 110.106 177.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.411 ' CG ' ' O ' ' A' ' 160' ' ' THR . 13.1 m120 -163.56 -170.65 2.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.437 . . . . 1.0 110.503 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.722 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.27 -22.33 12.39 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.993 -0.548 . . . . 1.0 110.557 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -36.98 120.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.252 0.549 . . . . 1.0 111.651 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 162' ' ' ALA . 21.3 t -124.23 162.12 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.714 -0.675 . . . . 1.0 109.794 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.529 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -141.94 -33.67 0.11 Allowed Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 14.5 p -159.67 169.35 23.91 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.656 -0.417 . . . . 1.0 110.853 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.649 ' H ' HD23 ' A' ' 167' ' ' LEU . 1.3 pt? -153.67 146.82 24.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.849 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.511 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 11.3 ptp180 -135.81 147.99 48.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.403 0.62 . . . . 1.0 110.01 178.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.426 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -83.12 150.69 26.12 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.144 -0.934 . . . . 1.0 108.902 178.204 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.743 ' C ' HD12 ' A' ' 171' ' ' ILE . 35.6 t -83.71 85.25 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 111.837 0.31 . . . . 1.0 111.837 -177.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.743 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp . . . . . 0 N--CA 1.468 0.426 0 N-CA-C 109.491 -0.559 . . . . 1.0 109.491 179.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.605 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.525 0.712 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -168.22 140.93 3.03 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.25 -0.278 . . . . 1.0 110.25 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.429 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -148.46 167.43 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-N 116.448 -0.342 . . . . 1.0 110.912 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.2 m -127.09 121.09 30.51 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 108.278 -1.008 . . . . 1.0 108.278 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.3 mt -105.77 133.09 51.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.871 -1.059 . . . . 1.0 110.097 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.479 ' CE1' HG22 ' A' ' 5' ' ' THR . 68.1 m-85 -115.92 126.52 54.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.361 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -53.75 -29.31 39.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.561 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -118.19 153.29 34.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.206 0.527 . . . . 1.0 110.365 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -58.38 -174.51 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.348 -0.842 . . . . 1.0 110.348 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.13 26.45 0.53 Allowed Glycine 0 N--CA 1.461 0.32 0 N-CA-C 110.798 -0.921 . . . . 1.0 110.798 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 50.29 68.98 0.67 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.395 -0.403 . . . . 1.0 110.304 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -129.35 -156.48 0.76 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.958 0.409 . . . . 1.0 110.485 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.41 -151.68 0.1 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.088 -0.805 . . . . 1.0 111.088 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.1 147.16 51.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.319 . . . . 1.0 110.689 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.8 p-80 -135.84 150.57 49.45 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.363 0.601 . . . . 1.0 110.25 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.54 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.1 t80 -145.22 142.13 29.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.22 -0.9 . . . . 1.0 110.203 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.54 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 31.0 tt0 -110.62 122.53 48.0 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.174 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . 0.453 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -110.41 127.05 54.91 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.535 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -119.41 13.6 12.71 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.392 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.8 m -158.29 172.31 18.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 1.0 110.692 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 50.0 p-10 -62.49 137.33 58.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.505 -0.771 . . . . 1.0 112.051 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.453 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -133.08 143.49 49.36 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.463 -0.789 . . . . 1.0 110.404 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.403 HG22 ' CE2' ' A' ' 51' ' ' TYR . 18.4 p -112.36 -16.11 13.0 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.527 -0.76 . . . . 1.0 111.724 -179.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -149.88 115.19 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 1.0 110.32 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.7 mt -117.89 0.51 11.93 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.334 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -52.92 -42.16 88.79 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.043 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 39.1 Cg_exo -59.26 -33.66 97.98 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.078 1.852 . . . . 1.0 111.556 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.94 -53.13 3.78 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.828 0.347 . . . . 1.0 111.012 -179.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -117.3 126.27 52.45 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.463 -178.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.6 t -93.93 -7.68 42.31 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.61 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.424 ' CG ' HD21 ' A' ' 34' ' ' ASN . 15.5 tpp180 -146.97 -60.65 0.29 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.436 -0.347 . . . . 1.0 111.923 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.3 t 64.98 75.81 0.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 O-C-N 123.269 0.356 . . . . 1.0 110.128 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . 0.424 HD21 ' CG ' ' A' ' 32' ' ' ARG . 15.6 m120 -93.1 3.34 55.89 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 116.33 -0.396 . . . . 1.0 111.32 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.9 p -155.41 157.35 36.91 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.959 -0.386 . . . . 1.0 109.959 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.75 155.32 34.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.006 -0.543 . . . . 1.0 111.059 -178.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.478 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 24.3 mtp85 -133.81 122.02 22.65 Favored 'General case' 0 C--O 1.21 -0.98 0 N-CA-C 108.371 -0.974 . . . . 1.0 108.371 178.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.94 114.63 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-O 121.259 0.552 . . . . 1.0 110.05 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -74.22 -44.89 51.38 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.002 -0.999 . . . . 1.0 110.695 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.1 t -162.68 155.13 19.01 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.643 -0.503 . . . . 1.0 109.643 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.89 175.97 50.06 Favored Glycine 0 C--N 1.317 -0.513 0 N-CA-C 110.566 -1.014 . . . . 1.0 110.566 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.1 m -111.94 138.1 49.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.671 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 54.9 m95 -126.04 146.29 49.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.619 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.515 ' C ' HD23 ' A' ' 45' ' ' LEU . 18.5 tpp -121.4 130.78 53.79 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 108.684 -0.858 . . . . 1.0 108.684 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.515 HD23 ' C ' ' A' ' 44' ' ' MET . 1.3 mt -110.1 132.08 54.48 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.026 -0.731 . . . . 1.0 109.026 -179.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.453 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 64.2 m-85 -108.12 130.96 55.08 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.634 0.731 . . . . 1.0 110.306 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.7 -34.61 71.5 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.006 -0.997 . . . . 1.0 110.596 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.0 mt-30 -109.5 153.04 43.04 Favored Pre-proline 0 C--N 1.333 -0.119 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.339 -178.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.29 160.24 35.93 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.308 2.005 . . . . 1.0 112.497 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.655 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.13 38.21 13.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.364 -0.835 . . . . 1.0 111.106 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.453 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.9 m-85 48.99 75.24 0.15 Allowed 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.899 -1.046 . . . . 1.0 111.02 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.6 m -143.91 154.2 43.09 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.021 0.439 . . . . 1.0 110.276 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.65 -150.02 22.15 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.978 -0.63 . . . . 1.0 111.947 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.621 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.8 tp -74.92 144.5 43.25 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.043 -0.579 . . . . 1.0 110.265 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -122.42 151.52 41.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.671 0.272 . . . . 1.0 110.433 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 8.4 m-85 -128.23 126.19 40.44 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.742 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.421 ' C ' HD12 ' A' ' 58' ' ' LEU . 46.8 t80 -83.43 123.81 30.06 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.019 0.437 . . . . 1.0 109.886 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.8 mp -117.3 145.61 43.88 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.079 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtm-85 -131.98 157.11 44.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.401 -0.818 . . . . 1.0 109.767 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 59' ' ' ARG . 71.8 ttt180 -36.32 126.52 0.79 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.69 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.94 -177.89 32.78 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.348 -1.101 . . . . 1.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.478 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 68.6 m-20 -115.99 129.56 56.43 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.86 0.362 . . . . 1.0 110.209 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -123.27 112.86 18.14 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.439 -0.578 . . . . 1.0 109.439 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.6 -4.23 55.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.882 -0.599 . . . . 1.0 111.456 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 76.7 m-20 -147.72 139.33 23.87 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.18 -0.674 . . . . 1.0 109.18 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.483 ' CB ' ' CZ2' ' A' ' 69' ' ' TRP . 15.2 p-80 -59.98 -41.14 91.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.093 0.473 . . . . 1.0 110.971 -179.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . 0.493 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 97.3 mm-40 -53.84 -7.6 0.13 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.67 179.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.479 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.0 mm-40 -83.96 -35.29 24.08 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.58 -0.448 . . . . 1.0 111.506 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.81 15.45 12.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 119.286 -0.388 . . . . 1.0 110.938 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.585 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 77.0 mtp 83.77 16.35 0.26 Allowed 'General case' 0 N--CA 1.463 0.215 0 O-C-N 123.922 0.764 . . . . 1.0 109.932 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . . . . . . 0 C--N 1.344 1.007 0 C-N-CA 120.068 -1.063 . . . . 1.0 110.68 178.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t . . . . . 0 CA--C 1.518 -0.251 0 N-CA-C 109.317 -0.623 . . . . 1.0 109.317 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -124.41 3.14 8.42 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.192 -0.458 . . . . 1.0 111.393 -178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 p -163.47 162.54 24.73 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.062 0.458 . . . . 1.0 110.647 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.4 p -155.49 147.09 23.01 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.748 . . . . 1.0 110.105 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.45 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 2.9 ptm180 -128.02 152.44 47.93 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.796 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.1 tt -104.65 128.54 52.73 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.957 -1.127 . . . . 1.0 107.957 178.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.796 ' N ' HD23 ' A' ' 81' ' ' LEU . 2.3 mt -90.56 115.71 64.76 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.295 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo . . . . . 0 N--CA 1.502 2.013 0 C-N-CA 122.468 2.112 . . . . 1.0 112.97 179.03 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 m . . . . . 0 C--O 1.231 0.111 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -132.2 120.22 21.92 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.624 -0.262 . . . . 1.0 111.179 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -146.92 134.7 21.19 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.957 -0.386 . . . . 1.0 109.957 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.496 HD12 HG22 ' A' ' 126' ' ' VAL . 18.0 tt -147.81 138.61 17.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.71 -0.223 . . . . 1.0 110.83 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -118.03 102.2 8.86 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.457 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.78 147.32 27.66 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.315 -0.402 . . . . 1.0 111.288 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 65.3 m-85 -118.28 133.66 55.7 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 115.554 -0.748 . . . . 1.0 111.508 -179.543 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.648 ' OE1' ' O ' ' A' ' 101' ' ' GLN . 0.5 OUTLIER -55.21 -36.49 66.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.965 -1.016 . . . . 1.0 111.291 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.612 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 36.8 mtp85 -130.98 170.05 14.99 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.419 -0.355 . . . . 1.0 110.131 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 . . . . . 0 C--N 1.332 -0.176 0 CA-C-N 115.837 -0.62 . . . . 1.0 110.723 179.443 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.173 0 N-CA-C 111.413 -0.675 . . . . 1.0 111.413 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.648 ' O ' ' OE1' ' A' ' 94' ' ' GLU . 67.4 tp60 -63.81 134.46 55.29 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 120.992 0.425 . . . . 1.0 111.728 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.402 ' SD ' ' C ' ' A' ' 102' ' ' MET . 0.5 OUTLIER -122.41 138.6 54.48 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.8 tt -139.99 138.57 37.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.246 -0.65 . . . . 1.0 109.246 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -112.95 147.25 37.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.203 0.525 . . . . 1.0 110.359 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.531 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 74.8 m-85 -130.56 154.45 47.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.684 -1.144 . . . . 1.0 110.285 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 18.2 p -143.28 9.3 1.64 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.547 -0.751 . . . . 1.0 111.17 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.956 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.1 pt-20 -158.51 81.08 0.82 Allowed 'General case' 0 C--O 1.216 -0.664 0 CA-C-O 118.488 -0.768 . . . . 1.0 109.884 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.956 ' O ' ' O ' ' A' ' 107' ' ' GLU . 14.0 p-10 18.46 164.99 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.514 1.149 . . . . 1.0 113.482 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 108' ' ' ASP . 98.3 m -148.43 107.58 3.89 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 120.133 -1.604 . . . . 1.0 109.896 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.442 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.0 p -66.28 -19.59 65.86 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.667 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.1 m -146.61 95.09 2.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.269 0.557 . . . . 1.0 109.974 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.531 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -62.39 -42.33 99.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.54 -0.754 . . . . 1.0 110.285 -179.201 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -45.72 -14.65 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.345 -0.388 . . . . 1.0 111.47 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 112' ' ' LEU . 81.3 m-20 -93.05 7.15 45.33 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.582 0.706 . . . . 1.0 110.481 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 112' ' ' LEU . 39.4 mmt180 -136.67 -42.78 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.508 -1.224 . . . . 1.0 113.719 -177.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.625 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -125.26 143.4 50.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.646 0.736 . . . . 1.0 110.667 -178.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 87.1 mtt180 -72.63 -73.7 0.19 Allowed 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.748 -0.781 . . . . 1.0 110.616 -177.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.606 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 93.2 m-85 -30.46 142.18 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 O-C-N 123.821 0.701 . . . . 1.0 110.391 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -104.3 12.44 33.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.851 0.358 . . . . 1.0 110.905 -178.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -142.02 138.48 31.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.536 0.684 . . . . 1.0 111.012 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.9 mm -120.43 118.09 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-N 115.067 -0.97 . . . . 1.0 109.088 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -109.9 24.09 13.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.629 -0.714 . . . . 1.0 111.497 -178.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.3 p 170.17 150.0 0.04 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.046 0.451 . . . . 1.0 109.825 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.403 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.8 pp -163.48 157.97 20.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.353 -0.84 . . . . 1.0 110.232 -178.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.16 120.27 30.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.529 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.496 HG22 HD12 ' A' ' 90' ' ' ILE . 43.5 t -103.83 104.21 16.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 178.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.916 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.13 -40.32 31.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.564 -0.744 . . . . 1.0 111.22 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -139.88 148.21 41.74 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.106 0.479 . . . . 1.0 110.766 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 59.11 -176.86 2.46 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.029 -0.828 . . . . 1.0 111.029 179.625 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.427 ' OG ' HG21 ' A' ' 170' ' ' VAL . 22.0 p -117.46 151.71 36.52 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -127.56 168.21 15.27 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.53 -0.759 . . . . 1.0 110.526 -178.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.54 144.84 25.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.516 ' HG ' HD11 ' A' ' 146' ' ' LEU . 48.3 mt -111.48 142.83 43.24 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . 0.419 ' CE2' ' HG2' ' A' ' 143' ' ' GLN . 39.1 m-85 -117.55 131.61 56.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.801 0.334 . . . . 1.0 110.247 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -43.82 -44.74 7.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.283 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -130.77 169.25 15.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.999 0.428 . . . . 1.0 110.001 -179.345 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . 0.441 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 3.1 t -73.64 168.81 18.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.849 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . 0.493 ' ND2' ' HE ' ' A' ' 140' ' ' ARG . 57.8 t30 69.32 14.82 8.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.142 -0.935 . . . . 1.0 109.911 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 41.42 78.43 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.241 -0.436 . . . . 1.0 111.997 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.562 ' C ' HD11 ' A' ' 136' ' ' LEU . 89.0 mtt-85 -147.46 35.36 0.87 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 120.926 0.393 . . . . 1.0 110.462 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -145.81 -150.14 5.14 Favored Glycine 0 N--CA 1.464 0.516 0 N-CA-C 111.763 -0.535 . . . . 1.0 111.763 -177.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.437 ' NH1' HG21 ' A' ' 160' ' ' THR . 95.2 mtt180 -69.51 165.35 21.16 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.904 -0.406 . . . . 1.0 109.904 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.585 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 42.3 mt-30 -142.8 135.01 27.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.552 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -126.86 124.75 40.32 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 108.807 -0.812 . . . . 1.0 108.807 178.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.651 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -82.2 126.63 32.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.048 -179.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.651 ' N ' HD23 ' A' ' 145' ' ' LEU . 23.7 mt -114.79 100.01 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.206 -0.907 . . . . 1.0 109.391 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.568 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -82.28 158.69 66.27 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.319 -179.199 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -47.36 121.76 5.8 Favored 'Trans proline' 0 N--CA 1.491 1.375 0 C-N-CA 121.632 1.555 . . . . 1.0 111.518 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.53 -154.83 24.93 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.38 -1.088 . . . . 1.0 110.38 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -129.49 129.27 44.35 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.874 0.368 . . . . 1.0 110.226 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.51 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -119.24 130.12 55.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.054 -0.521 . . . . 1.0 109.996 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -118.01 -3.8 11.1 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.843 0.354 . . . . 1.0 110.569 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -155.41 157.73 37.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.26 0.552 . . . . 1.0 109.964 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.544 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -70.3 -21.32 62.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.879 -1.055 . . . . 1.0 111.459 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.533 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.4 mt-30 -66.06 -21.3 66.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.234 0.54 . . . . 1.0 110.971 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -50.21 -47.96 54.59 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.793 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.665 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 19.1 p90 -101.9 18.45 20.57 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.16 0.505 . . . . 1.0 110.167 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.36 75.7 0.21 Allowed Glycine 0 C--N 1.331 0.269 0 N-CA-C 111.103 -0.799 . . . . 1.0 111.103 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.665 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -95.07 -171.05 2.32 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.053 0.454 . . . . 1.0 110.264 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . 0.437 HG21 ' NH1' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -121.74 -35.94 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.342 -0.844 . . . . 1.0 111.588 -178.681 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.638 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.5 OUTLIER -146.31 -18.98 0.44 Allowed 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 111.948 0.351 . . . . 1.0 111.948 -178.376 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.676 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 90.66 -21.95 0.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.658 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -42.39 122.57 2.27 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.565 -0.743 . . . . 1.0 110.72 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 162' ' ' ALA . 26.0 t -123.21 133.24 69.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.275 -0.875 . . . . 1.0 110.106 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.33 -29.5 3.94 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.879 -0.489 . . . . 1.0 111.879 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 110' ' ' SER . 16.0 m -163.56 176.69 9.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.829 0.347 . . . . 1.0 110.188 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -160.2 142.6 13.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.841 -0.618 . . . . 1.0 110.52 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -131.84 157.28 44.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.498 -0.556 . . . . 1.0 109.498 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -88.85 153.11 21.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.832 -0.622 . . . . 1.0 109.411 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.427 HG21 ' OG ' ' A' ' 130' ' ' SER . 59.0 t -88.56 88.43 2.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.588 -0.445 . . . . 1.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.7 mp . . . . . 0 N--CA 1.464 0.253 0 CA-C-N 116.235 -0.439 . . . . 1.0 110.439 179.397 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.503 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.525 0.682 0 N-CA-C 110.429 -1.068 . . . . 1.0 110.429 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -171.38 111.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 121.034 -0.266 . . . . 1.0 110.692 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.83 169.37 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 120.928 0.394 . . . . 1.0 111.049 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.3 m -127.33 120.23 28.09 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.842 -1.17 . . . . 1.0 107.842 177.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -104.72 132.7 50.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.937 -1.029 . . . . 1.0 110.057 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.49 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.8 m-85 -115.15 125.87 53.95 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.394 -0.821 . . . . 1.0 111.022 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -51.63 -34.28 37.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.634 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -114.84 151.54 33.72 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.205 0.526 . . . . 1.0 110.423 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' PHE . 12.0 ptm180 -56.42 -171.96 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.588 -179.3 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.28 23.76 0.17 Allowed Glycine 0 C--N 1.332 0.334 0 N-CA-C 110.937 -0.865 . . . . 1.0 110.937 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.451 ' N ' ' O ' ' A' ' 10' ' ' ARG . 9.6 m-85 52.54 69.59 0.67 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.568 -0.316 . . . . 1.0 110.172 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -131.69 -161.37 1.12 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.944 0.402 . . . . 1.0 110.482 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.76 -148.68 1.86 Allowed Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.951 -0.86 . . . . 1.0 110.951 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -72.48 148.1 45.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.786 0.327 . . . . 1.0 110.735 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.4 p-80 -137.04 151.98 49.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.259 0.552 . . . . 1.0 110.409 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.5 t80 -145.23 141.61 28.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.297 -0.865 . . . . 1.0 110.148 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.519 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.5 tt0 -110.42 123.04 49.14 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.895 -0.593 . . . . 1.0 110.183 -179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -111.69 126.95 55.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.288 -0.415 . . . . 1.0 110.994 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 72.0 p -118.78 11.24 12.62 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.809 -0.632 . . . . 1.0 110.566 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.5 p -156.02 168.81 26.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.477 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 50.2 p-10 -58.86 136.75 57.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.638 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . 0.419 ' CG ' HD21 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.74 142.99 49.92 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.443 -0.798 . . . . 1.0 110.533 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . 0.504 ' O ' ' OG ' ' A' ' 78' ' ' SER . 65.4 p -115.73 -11.96 11.57 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.401 -0.818 . . . . 1.0 111.887 -178.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -149.95 110.96 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.274 0.559 . . . . 1.0 109.777 -179.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.419 HD21 ' CG ' ' A' ' 23' ' ' HIS . 36.4 mt -118.01 -3.55 11.12 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.428 -179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.591 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -47.17 -52.67 33.15 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.488 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.591 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.5 Cg_endo -55.88 -32.45 85.21 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 C-N-CA 121.556 1.504 . . . . 1.0 112.295 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.403 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 1.1 m-85 -91.98 -49.5 6.19 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.362 -0.535 . . . . 1.0 110.38 -178.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.3 mt -121.41 126.95 50.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.44 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -94.7 -14.59 24.67 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.725 -0.671 . . . . 1.0 111.942 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -144.59 -55.84 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.381 . . . . 1.0 111.685 -178.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.0 t 60.75 79.5 0.24 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.096 -0.335 . . . . 1.0 110.096 -178.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -94.25 4.83 53.35 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.243 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.1 p -156.83 158.03 36.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.958 0.409 . . . . 1.0 110.372 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.68 154.45 32.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.624 . . . . 1.0 110.893 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.5 mtp85 -133.16 122.46 24.06 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 108.688 -0.856 . . . . 1.0 108.688 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.7 t -107.82 115.93 50.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.149 0.5 . . . . 1.0 109.873 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -78.44 -43.6 26.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.465 -0.788 . . . . 1.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 57.7 m -160.42 159.81 31.43 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.375 -0.602 . . . . 1.0 109.375 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.93 176.02 48.98 Favored Glycine 0 C--N 1.316 -0.565 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.9 m -112.49 138.02 49.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.091 -0.707 . . . . 1.0 109.091 178.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.598 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 52.4 m95 -127.94 148.82 50.52 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.288 0.566 . . . . 1.0 110.916 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.687 ' C ' HD23 ' A' ' 45' ' ' LEU . 1.9 ttt -128.06 137.04 52.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.413 -0.812 . . . . 1.0 110.021 178.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.687 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -113.27 139.73 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.374 -178.884 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -109.64 134.93 51.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.461 0.648 . . . . 1.0 111.711 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 15.4 pt-20 -57.86 -32.41 67.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.863 -1.062 . . . . 1.0 111.133 -178.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 52' ' ' SER . 10.9 pt20 -115.93 155.16 48.17 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.31 -0.626 . . . . 1.0 109.31 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.434 ' C ' HD22 ' A' ' 50' ' ' ASN . 15.9 Cg_endo -52.82 149.0 26.97 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 121.089 1.193 . . . . 1.0 111.87 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.844 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER 75.78 -123.46 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.566 -1.197 . . . . 1.0 109.403 -178.662 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.543 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -150.96 73.29 1.1 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.18 0.514 . . . . 1.0 110.218 179.034 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . 0.51 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 3.4 m -140.08 18.19 2.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.776 -0.647 . . . . 1.0 112.037 -177.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -137.7 -164.74 10.13 Favored Glycine 0 N--CA 1.467 0.73 0 N-CA-C 111.127 -0.789 . . . . 1.0 111.127 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.571 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 38.9 tp -59.39 146.76 38.8 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.516 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 4.9 pt20 -121.97 150.09 42.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.696 0.284 . . . . 1.0 110.692 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -125.61 123.64 39.47 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.009 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -83.58 122.32 28.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.112 0.482 . . . . 1.0 110.59 -179.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.5 mp -118.36 145.25 45.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.724 -0.671 . . . . 1.0 110.144 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.635 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 64.1 mtm180 -132.11 157.71 43.51 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.468 -0.787 . . . . 1.0 110.025 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.2 ptm180 -34.32 125.23 0.49 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.035 -0.529 . . . . 1.0 110.941 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.65 -178.3 32.32 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.35 129.02 56.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.059 0.457 . . . . 1.0 110.644 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -122.22 113.2 19.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.507 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.81 -3.66 54.33 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.982 -0.554 . . . . 1.0 111.537 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.9 m-20 -147.64 137.26 22.64 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.001 -0.74 . . . . 1.0 109.001 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.574 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 6.1 p80 -58.93 -37.87 77.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.059 0.457 . . . . 1.0 111.035 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.73 -7.83 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.917 -0.583 . . . . 1.0 110.494 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.437 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.7 mm-40 -83.14 -33.9 26.15 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 120.675 -0.41 . . . . 1.0 111.694 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.445 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.0 p90 -94.41 15.57 17.36 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.812 -0.355 . . . . 1.0 110.813 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 53.3 mtt 75.4 27.92 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.912 0.757 . . . . 1.0 109.942 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.727 0 C-N-CA 120.135 -1.031 . . . . 1.0 111.999 -179.46 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.1 p . . . . . 0 N--CA 1.455 -0.184 0 N-CA-C 109.03 -0.73 . . . . 1.0 109.03 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -131.21 12.99 5.12 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.976 -178.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . 0.504 ' OG ' ' O ' ' A' ' 24' ' ' THR . 3.5 m -160.84 159.55 29.99 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.306 0.574 . . . . 1.0 111.104 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.5 p -155.56 146.55 22.42 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.229 -0.896 . . . . 1.0 110.984 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.602 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 7.9 ptm180 -125.49 150.8 47.05 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.706 HD23 ' N ' ' A' ' 82' ' ' ILE . 3.8 tt -102.6 121.84 43.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.347 -1.353 . . . . 1.0 107.347 178.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.706 ' N ' HD23 ' A' ' 81' ' ' LEU . 5.3 mt -84.12 116.64 65.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 116.115 -0.493 . . . . 1.0 109.903 -178.274 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo . . . . . 0 N--CA 1.5 1.884 0 C-N-CA 121.912 1.741 . . . . 1.0 113.219 179.937 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.6 m . . . . . 0 CA--C 1.522 -0.112 0 CA-C-O 120.85 0.357 . . . . 1.0 110.093 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -133.48 110.11 9.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.856 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -137.99 131.69 31.14 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.839 -0.344 . . . . 1.0 110.084 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.428 HG22 ' CZ2' ' A' ' 131' ' ' TRP . 19.5 tt -147.84 148.26 16.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.84 0.352 . . . . 1.0 111.114 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -125.73 98.07 5.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.565 -0.743 . . . . 1.0 111.699 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . 0.428 HD11 HD22 ' A' ' 167' ' ' LEU . 17.4 mt -75.57 135.95 40.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 1.0 110.071 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 63.7 m-85 -117.78 138.28 52.16 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.566 0.698 . . . . 1.0 111.481 -179.439 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.526 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.8 OUTLIER -56.56 -65.04 0.68 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.348 -0.842 . . . . 1.0 111.79 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -96.68 173.25 7.42 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.352 0.596 . . . . 1.0 111.446 -178.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 114.845 -1.071 . . . . 1.0 111.697 179.767 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.67 0 N-CA-C 111.27 -0.732 . . . . 1.0 111.27 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -63.07 146.13 53.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.958 0.408 . . . . 1.0 110.798 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.497 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.1 ppp? -132.49 158.67 41.5 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.743 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.8 tt -148.85 142.07 18.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 73.4 tt0 -113.53 141.94 46.55 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.619 0.723 . . . . 1.0 110.804 -178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.783 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 83.7 m-85 -129.32 151.68 49.71 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 114.669 -1.15 . . . . 1.0 110.267 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.4 p -143.63 16.95 1.82 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.082 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.97 ' O ' ' O ' ' A' ' 108' ' ' ASP . 4.9 pt-20 -166.31 86.14 0.32 Allowed 'General case' 0 C--O 1.213 -0.867 0 CA-C-O 118.328 -0.844 . . . . 1.0 111.013 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.97 ' O ' ' O ' ' A' ' 107' ' ' GLU . 7.8 t70 16.68 154.34 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 122.231 1.015 . . . . 1.0 113.16 178.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 4.1 t -140.99 104.82 4.74 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.098 -1.001 . . . . 1.0 110.531 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.3 m -64.52 -31.72 73.05 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.246 -0.434 . . . . 1.0 110.726 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.2 t -137.09 90.14 2.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.073 -0.512 . . . . 1.0 110.099 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.783 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.2 tp -62.03 -42.86 99.62 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.736 -0.666 . . . . 1.0 110.423 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.615 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 25.8 mp0 -43.08 -9.7 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' A' ' 112' ' ' LEU . 84.0 m-20 -95.31 -20.83 18.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.176 0.512 . . . . 1.0 110.472 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 112' ' ' LEU . 24.9 mmt85 -109.96 -35.72 6.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.405 -0.816 . . . . 1.0 113.149 -178.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.676 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.71 137.24 54.83 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.765 0.793 . . . . 1.0 110.151 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.8 mtt180 -75.27 -70.66 0.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 120.914 -1.116 . . . . 1.0 110.653 -177.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.632 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 87.4 m-85 -33.0 145.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.307 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -104.32 10.49 35.48 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.779 0.323 . . . . 1.0 111.115 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 76.7 mt-10 -141.07 141.72 34.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.087 0.47 . . . . 1.0 111.228 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 35.4 mm -122.68 116.44 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.564 -0.744 . . . . 1.0 109.116 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.463 ' O ' ' CB ' ' A' ' 123' ' ' SER . 41.7 m-70 -109.34 31.13 5.99 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.333 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.6 t 161.59 150.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.14 0.495 . . . . 1.0 110.661 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.437 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 0.9 OUTLIER -159.63 156.05 27.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.524 -0.762 . . . . 1.0 110.529 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.87 107.26 9.95 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.702 -0.481 . . . . 1.0 109.702 -179.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.598 HG13 ' H ' ' A' ' 149' ' ' GLY . 1.1 p -104.57 108.18 24.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 108.666 -0.864 . . . . 1.0 108.666 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.965 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.3 OUTLIER -78.4 -33.25 48.86 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.875 -1.057 . . . . 1.0 110.83 -179.04 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -148.61 164.76 33.34 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.277 0.561 . . . . 1.0 110.859 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 55.81 170.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 110.416 -1.074 . . . . 1.0 110.416 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.514 ' OG ' HD11 ' A' ' 145' ' ' LEU . 4.1 t -115.67 146.76 41.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 41.1 m95 -120.79 161.16 21.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.076 -177.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.7 t -135.84 98.56 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.622 HD13 HD11 ' A' ' 146' ' ' LEU . 5.5 mp -69.71 138.51 52.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.527 -0.306 . . . . 1.0 110.26 -179.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . 0.63 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 43.3 m-85 -118.31 133.4 55.92 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.825 -0.625 . . . . 1.0 110.802 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . 0.448 ' OE2' ' CD ' ' A' ' 163' ' ' ARG . 42.9 tp10 -39.94 -56.14 1.88 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.858 -0.61 . . . . 1.0 111.199 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.59 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -123.92 170.45 10.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.487 -178.494 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 22.0 p -74.7 169.16 18.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.372 -0.831 . . . . 1.0 110.744 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 59.6 t30 67.24 17.27 10.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.268 -0.878 . . . . 1.0 109.667 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . 0.402 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.0 m-85 38.1 80.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.873 -0.603 . . . . 1.0 112.215 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.534 ' C ' HD11 ' A' ' 136' ' ' LEU . 15.9 tpp180 -148.98 39.79 0.86 Allowed 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.815 0.34 . . . . 1.0 110.326 179.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.15 -136.28 2.47 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.197 -0.761 . . . . 1.0 111.197 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . 0.451 ' NH2' HD13 ' A' ' 54' ' ' LEU . 77.1 mtp85 -81.22 172.34 13.75 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.209 -0.293 . . . . 1.0 110.209 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -149.35 134.85 18.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.512 . . . . 1.0 111.188 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -130.05 120.0 24.0 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.924 0.392 . . . . 1.0 110.212 179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.514 HD11 ' OG ' ' A' ' 130' ' ' SER . 53.2 tp -79.97 131.24 35.78 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.614 0.721 . . . . 1.0 110.8 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.622 HD11 HD13 ' A' ' 133' ' ' LEU . 22.9 mt -117.27 105.03 11.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.023 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.602 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.7 mtm -77.52 159.56 76.89 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 109.823 -0.436 . . . . 1.0 109.823 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.45 114.81 2.08 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.207 1.938 . . . . 1.0 111.999 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . 0.598 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 175.21 -154.98 19.46 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 50.5 p-10 -121.23 136.11 55.02 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.061 0.458 . . . . 1.0 110.715 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.542 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 9.8 m-85 -127.29 126.76 43.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 32.1 ptt-85 -117.22 3.67 12.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.874 0.369 . . . . 1.0 110.305 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -162.37 160.72 26.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.532 0.682 . . . . 1.0 110.482 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.581 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -74.68 -17.96 60.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.869 -1.06 . . . . 1.0 111.93 -178.476 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.534 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.5 mt-30 -66.4 -20.55 66.1 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.115 -0.493 . . . . 1.0 111.214 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . 0.542 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 41.6 t0 -50.39 -49.47 54.39 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.067 -178.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.553 ' NE1' ' HB2' ' A' ' 159' ' ' ALA . 36.1 p90 -101.55 19.2 18.42 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.033 0.444 . . . . 1.0 110.323 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.0 75.14 0.24 Allowed Glycine 0 CA--C 1.518 0.253 0 CA-C-N 115.617 -0.719 . . . . 1.0 111.433 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.581 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . . . -95.4 -171.14 2.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 1.0 110.71 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.31 -40.85 2.55 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.295 -0.866 . . . . 1.0 111.955 -178.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.631 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.7 OUTLIER -143.01 -16.52 0.68 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.974 -177.744 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.631 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 90.32 -21.24 0.12 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.832 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.448 ' CD ' ' OE2' ' A' ' 135' ' ' GLU . 17.4 ptp180 -44.35 123.56 3.57 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.593 0.711 . . . . 1.0 110.939 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 162' ' ' ALA . 11.8 t -119.54 156.08 22.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.159 -0.928 . . . . 1.0 110.343 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.532 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -128.11 -34.47 0.54 Allowed Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.711 -0.677 . . . . 1.0 111.512 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 4.9 p -159.17 -167.72 2.15 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.051 -0.351 . . . . 1.0 110.051 -178.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.589 HD21 HD13 ' A' ' 112' ' ' LEU . 1.8 pp -174.49 137.06 0.48 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.283 -0.417 . . . . 1.0 110.357 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.635 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 8.1 ptp180 -131.94 150.18 52.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 1.0 109.845 179.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -81.49 153.25 26.94 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.454 -0.793 . . . . 1.0 108.956 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 54.7 t -87.78 88.19 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.921 0.391 . . . . 1.0 111.309 -179.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.5 mp . . . . . 0 C--N 1.328 -0.345 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.084 179.335 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.704 0 N-CA-C 110.629 -0.988 . . . . 1.0 110.629 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 mttm 179.21 103.84 0.03 OUTLIER 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.676 -0.308 . . . . 1.0 110.289 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.77 170.94 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.838 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.543 HG22 ' CE1' ' A' ' 7' ' ' TYR . 31.4 m -129.53 121.24 26.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.256 -1.016 . . . . 1.0 108.256 177.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.3 mt -106.6 132.79 52.2 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 114.939 -1.028 . . . . 1.0 110.238 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.543 ' CE1' HG22 ' A' ' 5' ' ' THR . 50.9 m-85 -114.42 130.47 56.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.355 -0.839 . . . . 1.0 111.127 -178.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.451 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 83.8 tt0 -55.8 -24.15 34.31 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.464 -0.789 . . . . 1.0 110.403 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -126.91 153.48 45.71 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.173 0.511 . . . . 1.0 110.221 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.6 ptt85 -56.63 -173.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.51 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.69 30.24 0.32 Allowed Glycine 0 C--N 1.333 0.408 0 N-CA-C 110.994 -0.842 . . . . 1.0 110.994 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . 0.557 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 46.38 68.94 0.53 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.472 -0.364 . . . . 1.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -126.88 -157.49 0.81 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.15 -146.9 0.26 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.972 -0.851 . . . . 1.0 110.972 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.2 mmt180 -74.54 150.13 39.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.905 0.383 . . . . 1.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -136.98 145.38 44.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.334 0.588 . . . . 1.0 110.24 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 7.1 t80 -139.89 142.78 36.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.069 -0.969 . . . . 1.0 109.893 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.511 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.1 tt0 -111.24 122.99 49.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.293 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 t -109.51 126.58 53.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.17 -0.468 . . . . 1.0 109.947 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.0 m -117.38 7.32 12.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.308 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 89.5 p -153.84 167.9 28.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.816 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . 0.443 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 51.9 p-10 -57.72 137.46 56.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.708 -0.678 . . . . 1.0 111.493 -179.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.03 149.25 50.11 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.619 -0.718 . . . . 1.0 110.649 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 p -116.75 -18.9 10.14 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.799 -0.637 . . . . 1.0 112.083 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.451 ' OD1' ' CG ' ' A' ' 28' ' ' PRO . 2.3 t-20 -132.1 115.64 16.01 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.246 0.546 . . . . 1.0 110.503 -178.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.8 mp -115.39 -8.14 12.26 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.027 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.621 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 12.6 mt-30 -60.13 -41.41 84.41 Favored Pre-proline 0 CA--C 1.516 -0.358 0 C-N-CA 120.454 -0.498 . . . . 1.0 110.43 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.6 Cg_exo -58.61 -41.28 65.85 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.084 1.856 . . . . 1.0 112.112 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -92.96 -47.41 7.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.164 0.507 . . . . 1.0 111.103 -178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.56 128.02 54.54 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.46 -0.791 . . . . 1.0 111.307 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 t -90.88 -16.31 28.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.133 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 43.9 ttm180 -174.5 119.84 0.24 Allowed 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.955 -0.757 . . . . 1.0 108.955 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.6 t -99.2 112.08 24.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.678 0.275 . . . . 1.0 110.644 179.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -106.25 -3.97 20.67 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.343 -0.39 . . . . 1.0 110.229 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . 0.557 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.6 t -156.16 155.64 32.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.881 0.372 . . . . 1.0 110.309 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.74 155.5 37.32 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.092 -0.503 . . . . 1.0 110.786 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.0 mtt-85 -135.15 122.76 22.11 Favored 'General case' 0 C--O 1.212 -0.872 0 N-CA-C 108.953 -0.758 . . . . 1.0 108.953 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.3 t -107.99 130.08 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.156 0.503 . . . . 1.0 109.66 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -90.07 -43.21 10.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.276 -0.875 . . . . 1.0 110.635 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.2 p -161.8 164.45 28.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.725 -0.472 . . . . 1.0 109.725 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 76.49 175.87 41.29 Favored Glycine 0 C--N 1.316 -0.549 0 N-CA-C 111.278 -0.729 . . . . 1.0 111.278 179.1 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 97.7 m -111.69 129.63 56.04 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.484 -0.562 . . . . 1.0 109.484 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.47 145.81 43.02 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.751 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.567 ' C ' HD12 ' A' ' 45' ' ' LEU . 17.3 tpp -122.05 130.55 53.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.282 -0.872 . . . . 1.0 109.496 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.567 HD12 ' C ' ' A' ' 44' ' ' MET . 10.1 mp -108.69 131.82 54.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.544 -0.753 . . . . 1.0 109.429 -179.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . 0.402 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 85.3 m-85 -111.17 132.28 54.43 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.383 0.611 . . . . 1.0 111.814 -179.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.625 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.7 pt-20 -57.08 -36.14 70.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.271 -0.877 . . . . 1.0 111.261 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . 0.421 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.9 mt-30 -107.31 153.37 41.21 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.598 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.13 159.59 46.04 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.419 2.079 . . . . 1.0 112.045 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.688 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.92 34.66 14.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.545 -0.752 . . . . 1.0 111.388 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.402 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.6 m-85 54.1 76.45 0.23 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.267 -0.878 . . . . 1.0 111.439 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.1 m -146.04 154.15 41.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.077 0.465 . . . . 1.0 110.442 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.64 -148.41 21.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.031 -0.604 . . . . 1.0 111.805 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.625 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.7 tp -75.61 144.11 41.94 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.358 -0.421 . . . . 1.0 110.475 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 2.0 pt20 -119.31 153.57 34.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.549 0.214 . . . . 1.0 110.496 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.448 ' C ' ' SD ' ' A' ' 44' ' ' MET . 39.9 m-85 -125.93 123.63 38.99 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 120.821 0.344 . . . . 1.0 110.457 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.465 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 43.2 t80 -82.87 123.25 29.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.128 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 mp -120.27 145.06 47.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.248 -0.887 . . . . 1.0 110.5 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 44.8 mtp180 -132.13 157.52 44.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.103 -0.953 . . . . 1.0 110.433 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.1 ttp85 -37.54 126.67 1.11 Allowed 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.856 -0.611 . . . . 1.0 110.765 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 179.9 31.9 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.471 -1.051 . . . . 1.0 110.471 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.7 p-10 -114.34 127.68 55.98 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.984 0.421 . . . . 1.0 110.399 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . 0.456 ' O ' ' OG ' ' A' ' 35' ' ' SER . 41.3 m-85 -122.3 113.53 19.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.85 -0.614 . . . . 1.0 109.761 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.94 -4.04 55.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.282 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -146.79 139.21 24.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.495 ' C ' ' H ' ' A' ' 68' ' ' GLN . 16.2 p-80 -60.18 -42.17 94.43 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 120.987 0.423 . . . . 1.0 111.121 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.18 -7.47 0.09 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.498 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.495 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -82.17 -32.25 30.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.269 -178.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.1 p90 -97.09 16.85 18.47 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 120.807 -0.357 . . . . 1.0 110.743 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.409 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 78.6 mtp 73.34 29.84 1.6 Allowed 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.838 0.711 . . . . 1.0 109.857 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.338 0.663 0 C-N-CA 120.122 -1.037 . . . . 1.0 111.606 -179.833 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 N--CA 1.454 -0.251 0 N-CA-C 109.021 -0.733 . . . . 1.0 109.021 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -120.76 14.38 11.69 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.353 -0.385 . . . . 1.0 110.941 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 p -164.91 163.07 21.04 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.05 0.452 . . . . 1.0 110.975 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -154.87 146.24 22.99 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.638 . . . . 1.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . 0.428 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 1.6 ptm180 -127.68 148.01 50.39 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 120.637 0.256 . . . . 1.0 110.514 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 9.4 tp -96.0 111.37 23.4 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.846 -1.168 . . . . 1.0 107.846 177.656 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mt -57.2 110.47 2.47 Favored Pre-proline 0 C--N 1.322 -0.591 0 C-N-CA 120.247 -0.581 . . . . 1.0 110.629 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 37.9 Cg_endo . . . . . 0 N--CA 1.49 1.316 0 C-N-CA 121.989 1.792 . . . . 1.0 111.556 -179.803 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.2 m . . . . . 0 C--O 1.231 0.116 0 N-CA-C 109.663 -0.495 . . . . 1.0 109.663 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.438 ' CD2' HD11 ' A' ' 171' ' ' ILE . 2.5 m80 -131.64 115.28 15.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.115 -0.234 . . . . 1.0 110.811 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 46.3 mtm-85 -143.38 134.64 25.9 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 1.0 110.017 178.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.516 HD12 HG22 ' A' ' 126' ' ' VAL . 15.7 tt -146.58 143.81 20.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.719 0.295 . . . . 1.0 110.967 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -121.33 97.7 5.63 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.872 -0.604 . . . . 1.0 111.427 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.9 mt -76.56 138.29 40.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.559 . . . . 1.0 110.184 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -117.0 136.47 52.92 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 115.432 -0.803 . . . . 1.0 111.093 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.561 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -57.99 -70.28 0.14 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.135 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -96.17 174.51 6.86 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.29 0.567 . . . . 1.0 110.639 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 . . . . . 0 CA--C 1.517 -0.326 0 CA-C-N 115.188 -0.914 . . . . 1.0 110.58 -179.382 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.677 0 N-CA-C 111.025 -0.83 . . . . 1.0 111.025 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -58.01 151.22 18.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 1.0 110.332 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ptm -130.79 156.37 45.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.358 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.9 tt -150.56 142.53 16.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 N-CA-C 109.632 -0.507 . . . . 1.0 109.632 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -113.56 144.09 43.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.435 0.636 . . . . 1.0 110.81 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.647 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 78.0 m-85 -131.01 152.73 50.0 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 114.59 -1.186 . . . . 1.0 110.265 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 p -143.2 10.85 1.73 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.893 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.969 ' O ' ' O ' ' A' ' 108' ' ' ASP . 7.3 pt-20 -158.85 81.49 0.79 Allowed 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.697 -0.668 . . . . 1.0 109.788 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.969 ' O ' ' O ' ' A' ' 107' ' ' GLU . 54.6 p30 19.86 162.02 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 122.336 1.065 . . . . 1.0 113.236 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 5.9 t -144.0 106.09 4.36 Favored 'General case' 0 C--N 1.315 -0.9 0 O-C-N 120.483 -1.386 . . . . 1.0 109.712 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.469 ' O ' ' OG ' ' A' ' 166' ' ' SER . 15.6 m -68.58 -28.02 66.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.667 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 37.1 t -139.38 89.19 2.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.183 0.516 . . . . 1.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.647 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 1.8 mt -62.29 -42.34 99.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.411 -0.813 . . . . 1.0 110.696 -179.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -45.98 -8.07 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.288 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 112' ' ' LEU . 63.8 t0 -96.73 -23.9 16.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.175 0.512 . . . . 1.0 110.526 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' A' ' 112' ' ' LEU . 28.2 mmt180 -104.49 -40.47 6.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.495 -0.775 . . . . 1.0 112.966 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.692 ' CZ ' ' O ' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -123.62 138.72 54.49 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.362 0.601 . . . . 1.0 109.8 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 118' ' ' PHE . 90.6 mtt180 -71.86 -74.06 0.17 Allowed 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.594 -0.691 . . . . 1.0 111.308 -177.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.692 ' O ' ' CZ ' ' A' ' 116' ' ' PHE . 72.4 m-85 -29.56 146.23 0.01 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 O-C-N 123.975 0.797 . . . . 1.0 110.413 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -106.47 13.18 28.79 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.041 0.448 . . . . 1.0 111.155 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -141.73 140.53 33.14 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.912 -0.585 . . . . 1.0 111.113 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.7 mm -120.74 117.12 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 115.38 -0.827 . . . . 1.0 109.036 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . 0.471 ' O ' ' CB ' ' A' ' 123' ' ' SER . 38.3 m-70 -108.53 30.16 6.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.914 -0.584 . . . . 1.0 111.395 -178.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.471 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.5 p 162.06 152.49 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.034 0.445 . . . . 1.0 110.103 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.465 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.1 pp -163.32 157.71 20.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 1.0 110.149 -178.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.75 116.21 21.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.965 0.412 . . . . 1.0 109.999 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.516 HG22 HD12 ' A' ' 90' ' ' ILE . 24.0 t -102.78 104.82 17.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 115.818 -0.628 . . . . 1.0 109.704 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.921 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -78.33 -38.66 41.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.633 -0.712 . . . . 1.0 111.433 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -141.59 155.95 45.72 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 120.536 -0.465 . . . . 1.0 110.757 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.96 -175.03 0.14 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 110.475 -1.05 . . . . 1.0 110.475 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . 0.526 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.9 OUTLIER -116.32 178.53 4.29 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.099 -0.704 . . . . 1.0 109.099 178.856 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.526 ' CD1' ' C ' ' A' ' 130' ' ' SER . 69.7 m95 -148.86 162.87 38.96 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.286 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 24.0 t -136.25 105.53 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.577 -0.283 . . . . 1.0 111.105 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.466 ' HG ' HD11 ' A' ' 146' ' ' LEU . 26.5 mt -77.06 143.0 39.59 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.947 -0.301 . . . . 1.0 110.266 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . 0.52 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 37.8 m-85 -119.29 133.24 55.84 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.68 0.276 . . . . 1.0 110.538 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -43.47 -46.86 7.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.531 -0.304 . . . . 1.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.818 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -129.9 165.91 21.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.062 0.458 . . . . 1.0 110.011 -178.355 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 4.1 t -69.71 174.78 4.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.768 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . 0.491 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.7 t30 63.39 18.78 11.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.046 -0.979 . . . . 1.0 109.752 -178.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 37.42 74.87 0.07 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.163 -0.471 . . . . 1.0 111.318 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.818 ' C ' HD11 ' A' ' 136' ' ' LEU . 45.3 mmt-85 -144.2 40.38 1.35 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.872 0.368 . . . . 1.0 110.09 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.423 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -151.69 -146.82 4.42 Favored Glycine 0 N--CA 1.462 0.399 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -178.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -70.74 171.16 10.97 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.182 -0.303 . . . . 1.0 110.182 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.55 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 5.7 pt20 -149.29 135.48 19.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.203 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -130.15 124.03 31.71 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.757 -0.461 . . . . 1.0 109.757 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 42.7 tp -79.9 127.47 32.29 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.025 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.466 HD11 ' HG ' ' A' ' 133' ' ' LEU . 30.0 mt -117.47 107.86 14.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.42 -0.809 . . . . 1.0 110.5 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.428 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.3 OUTLIER -80.67 171.52 12.11 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.794 -179.589 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -67.45 115.7 3.84 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.225 1.95 . . . . 1.0 111.422 179.132 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 177.85 -152.26 11.61 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.621 -0.992 . . . . 1.0 110.621 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.459 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.3 p-10 -127.75 125.2 39.48 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.193 0.521 . . . . 1.0 110.603 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 12.2 m-85 -115.91 127.69 55.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.823 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -114.15 -3.07 13.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.827 0.346 . . . . 1.0 110.762 -179.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -157.23 164.45 37.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.732 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . 0.572 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.57 -20.76 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.031 -0.986 . . . . 1.0 111.978 -178.547 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -65.55 -21.82 66.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.226 -0.443 . . . . 1.0 111.041 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -48.14 -51.24 25.69 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.029 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.595 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.4 p90 -99.61 19.71 15.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.938 0.399 . . . . 1.0 110.258 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.0 74.36 0.3 Allowed Glycine 0 CA--C 1.518 0.243 0 N-CA-C 111.249 -0.741 . . . . 1.0 111.249 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.595 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.22 -171.13 2.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 1.0 110.233 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 12.6 t -123.15 -33.67 3.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.144 -0.935 . . . . 1.0 111.573 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.629 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.8 OUTLIER -149.43 -15.89 0.28 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.757 0.313 . . . . 1.0 111.646 -178.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.629 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 89.49 -21.71 0.13 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.48 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -42.02 124.49 2.7 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.674 -0.694 . . . . 1.0 110.748 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 162' ' ' ALA . 24.8 t -120.73 160.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.713 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.52 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -138.17 -35.08 0.17 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.282 -0.727 . . . . 1.0 111.282 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -162.06 172.06 16.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.01 0.433 . . . . 1.0 110.577 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . 0.407 ' CD2' HD11 ' A' ' 112' ' ' LEU . 0.4 OUTLIER -154.4 144.17 21.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.325 179.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.52 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 12.5 ptp180 -134.6 150.3 50.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.268 0.556 . . . . 1.0 110.27 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.434 ' N ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -76.88 147.69 36.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.146 -0.934 . . . . 1.0 108.698 177.143 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.462 HG21 ' CB ' ' A' ' 130' ' ' SER . 27.6 m -86.33 68.44 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.934 -0.575 . . . . 1.0 112.384 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.438 HD11 ' CD2' ' A' ' 88' ' ' HIS . 1.3 mp . . . . . 0 N--CA 1.467 0.424 0 CA-C-O 121.173 0.511 . . . . 1.0 109.913 179.75 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' GLY . . . . . 0.573 ' N ' HD11 ' A' ' 81' ' ' LEU . . . . . . . . 0 CA--C 1.527 0.818 0 N-CA-C 110.435 -1.066 . . . . 1.0 110.435 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.2 tttt -172.99 106.82 0.15 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.778 -0.369 . . . . 1.0 110.141 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.452 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.91 169.16 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.346 0.594 . . . . 1.0 111.647 -179.771 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.448 HG22 ' CE1' ' A' ' 7' ' ' TYR . 62.3 m -125.07 121.73 35.15 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.35 -0.982 . . . . 1.0 108.35 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.2 134.2 50.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.176 -0.92 . . . . 1.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' TYR . . . . . 0.448 ' CE1' HG22 ' A' ' 5' ' ' THR . 86.0 m-85 -114.53 129.73 56.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.036 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 80.5 tt0 -55.62 -20.78 14.91 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.571 -0.741 . . . . 1.0 109.894 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -126.93 163.2 24.19 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.399 0.618 . . . . 1.0 111.0 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -67.82 179.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.0 111.37 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.59 25.98 7.11 Favored Glycine 0 C--N 1.335 0.518 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 51.7 66.02 1.32 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -128.51 -155.06 0.68 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.945 0.402 . . . . 1.0 110.535 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.07 -153.62 0.08 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.012 -0.835 . . . . 1.0 111.012 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -68.62 148.08 50.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.688 0.28 . . . . 1.0 110.75 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -135.46 151.32 50.29 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.418 0.628 . . . . 1.0 110.683 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.3 t80 -147.29 141.64 26.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.975 -1.011 . . . . 1.0 109.682 -179.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.8 tt0 -110.07 121.4 45.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.517 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.5 t -107.18 126.0 51.83 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.954 0.407 . . . . 1.0 110.891 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.5 m -118.72 13.22 13.24 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.755 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 49.8 m -158.03 169.49 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.421 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -61.03 136.41 58.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.029 -0.532 . . . . 1.0 111.457 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.34 150.22 51.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.576 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.7 p -117.05 -13.85 10.58 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.084 0.772 . . . . 1.0 113.084 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -152.01 109.43 3.59 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.127 -0.629 . . . . 1.0 111.618 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.3 mp -100.39 -1.76 35.18 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.052 -0.976 . . . . 1.0 110.336 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.611 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 28.5 mt-30 -51.85 -49.96 80.64 Favored Pre-proline 0 C--N 1.327 -0.409 0 C-N-CA 120.368 -0.533 . . . . 1.0 111.04 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 19.6 Cg_endo -57.88 -33.55 97.18 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 121.52 1.48 . . . . 1.0 112.414 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -95.39 -51.48 4.56 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 111.131 -178.09 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LEU . . . . . 0.417 ' N ' ' O ' ' A' ' 26' ' ' LEU . 11.1 mt -121.32 129.94 53.37 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.032 -0.531 . . . . 1.0 111.327 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -93.7 -9.23 38.46 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.177 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.456 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 62.3 ttp180 -179.1 119.29 0.07 Allowed 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 108.637 -0.875 . . . . 1.0 108.637 -179.089 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.6 t -100.95 113.41 26.37 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.739 0.304 . . . . 1.0 110.289 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -105.5 -5.3 20.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.888 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.1 p -156.61 158.26 36.75 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.686 -0.406 . . . . 1.0 110.863 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.6 155.05 34.02 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.347 0.594 . . . . 1.0 112.036 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.7 mtt180 -136.47 122.45 20.15 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.207 -0.906 . . . . 1.0 108.838 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' VAL . . . . . 0.499 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.2 p -110.29 123.17 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.973 0.416 . . . . 1.0 110.016 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -77.19 -45.06 27.92 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.985 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.5 p -159.8 162.87 34.88 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.74 -0.837 . . . . 1.0 108.74 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 173.1 46.01 Favored Glycine 0 C--N 1.314 -0.671 0 N-CA-C 110.253 -1.139 . . . . 1.0 110.253 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.78 142.98 43.45 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.714 -0.847 . . . . 1.0 108.714 178.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' TRP . . . . . 0.626 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 56.4 m95 -130.88 155.56 46.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.455 0.645 . . . . 1.0 111.206 -178.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' MET . . . . . 0.64 ' C ' HD23 ' A' ' 45' ' ' LEU . 9.2 ttm -130.68 131.48 44.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.036 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.64 HD23 ' C ' ' A' ' 44' ' ' MET . 0.3 OUTLIER -107.97 137.45 45.94 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.114 -0.699 . . . . 1.0 109.114 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -113.68 132.18 55.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.178 0.513 . . . . 1.0 110.925 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.645 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.3 pt-20 -60.9 -35.67 77.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.643 -0.708 . . . . 1.0 111.237 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.77 151.66 42.46 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.445 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PRO . . . . . 0.448 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 42.1 Cg_endo -64.01 158.21 48.83 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.69 2.26 . . . . 1.0 113.533 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ASN . . . . . 0.683 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.8 OUTLIER 63.82 36.24 10.56 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.091 -0.959 . . . . 1.0 111.626 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 52.5 72.67 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.995 -1.002 . . . . 1.0 110.852 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.1 p -142.41 159.64 41.83 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 116.004 -0.544 . . . . 1.0 109.679 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.6 -149.15 24.32 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.728 -0.749 . . . . 1.0 112.261 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LEU . . . . . 0.645 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.5 tp -77.8 140.95 39.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.807 -0.697 . . . . 1.0 110.244 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . 0.491 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 13.9 pt20 -120.53 149.31 42.62 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 117.803 0.274 . . . . 1.0 110.663 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -128.49 129.88 46.71 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.622 -0.263 . . . . 1.0 111.276 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' PHE . . . . . 0.496 ' H ' ' NE2' ' A' ' 143' ' ' GLN . 67.6 t80 -82.66 123.52 29.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.506 0.67 . . . . 1.0 110.597 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -110.08 134.5 52.09 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.809 -1.087 . . . . 1.0 108.5 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 60' ' ' ARG . 37.8 ttp180 -130.03 151.68 50.31 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ARG . . . . . 0.456 ' HA ' HG13 ' A' ' 38' ' ' VAL . 78.0 ttt-85 -34.66 125.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.167 -0.47 . . . . 1.0 111.769 -178.113 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLY . . . . . 0.499 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 152.48 -175.29 31.16 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.221 -1.152 . . . . 1.0 110.221 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 49.5 p-10 -117.32 131.29 56.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.182 0.515 . . . . 1.0 111.106 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -125.27 115.14 19.91 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.102 -0.703 . . . . 1.0 109.102 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . 0.439 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -95.51 -5.06 43.72 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.764 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 90.6 m-20 -145.76 136.04 23.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.674 -0.861 . . . . 1.0 108.674 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' HIS . . . . . 0.483 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 6.0 p80 -56.06 -42.64 76.95 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.074 -0.65 . . . . 1.0 110.918 -178.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -50.17 -8.89 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.566 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -85.05 -34.06 22.36 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.336 -0.546 . . . . 1.0 110.983 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' TRP . . . . . 0.425 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -91.91 20.5 5.66 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.32 -0.552 . . . . 1.0 110.873 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' MET . . . . . 0.425 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 43.0 mtt 81.22 12.25 0.76 Allowed 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 123.772 0.67 . . . . 1.0 109.665 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.703 0 N-CA-C 110.962 -0.855 . . . . 1.0 110.962 179.174 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 61.8 t . . . . . 0 C--O 1.232 0.143 0 N-CA-C 109.435 -0.58 . . . . 1.0 109.435 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' ARG . . . . . 0.448 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.3 mtm-85 -114.73 6.68 15.67 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.685 0.254 . . . . 1.0 111.685 -179.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -164.44 163.42 22.24 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.153 -0.619 . . . . 1.0 111.127 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 28.1 p -158.4 149.11 20.39 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.709 -0.678 . . . . 1.0 111.037 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -128.2 150.52 49.98 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.742 0.306 . . . . 1.0 110.208 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LEU . . . . . 0.717 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -101.2 124.76 47.41 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.339 -0.986 . . . . 1.0 108.339 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ILE . . . . . 0.717 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.2 mt -86.03 114.33 56.56 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 116.1 -0.5 . . . . 1.0 110.577 -178.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 N--CA 1.498 1.772 0 C-N-CA 121.844 1.696 . . . . 1.0 112.274 179.687 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.8 m . . . . . 0 C--O 1.232 0.159 0 N-CA-C 109.379 -0.601 . . . . 1.0 109.379 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.572 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 1.9 m170 -129.69 107.69 9.62 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.068 0.395 . . . . 1.0 112.068 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ARG . . . . . 0.412 HH21 ' HG ' ' A' ' 127' ' ' LEU . 57.3 ttp180 -138.21 127.61 24.69 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.468 -0.567 . . . . 1.0 109.468 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' ILE . . . . . 0.514 HG22 ' CH2' ' A' ' 131' ' ' TRP . 18.3 tt -145.85 145.11 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-O 120.758 0.313 . . . . 1.0 111.286 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' ARG . . . . . 0.667 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.2 mtp180 -122.69 98.69 6.03 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.773 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.27 139.06 36.83 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.522 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' TYR . . . . . 0.401 ' CE1' ' HG3' ' A' ' 102' ' ' MET . 78.7 m-85 -115.0 134.05 55.52 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.121 -0.491 . . . . 1.0 111.141 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' GLU . . . . . 0.567 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 20.1 pt-20 -54.33 -41.3 68.88 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.496 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' ARG . . . . . 0.49 ' O ' ' OG ' ' A' ' 123' ' ' SER . 9.9 mtt-85 -121.88 168.24 12.1 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.011 -0.541 . . . . 1.0 110.846 -178.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 . . . . . 0 N--CA 1.463 0.217 0 CA-C-O 121.448 0.642 . . . . 1.0 111.034 179.294 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.527 0.808 0 N-CA-C 111.403 -0.679 . . . . 1.0 111.403 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' GLN . . . . . 0.567 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 67.4 tp60 -65.01 146.78 54.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.071 0.463 . . . . 1.0 110.987 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' MET . . . . . 0.667 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 10.8 ttp -129.92 152.53 49.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.49 -0.777 . . . . 1.0 110.439 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' ILE . . . . . 0.465 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.7 tt -145.01 137.54 21.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 108.459 -0.941 . . . . 1.0 108.459 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 78.0 tt0 -111.78 141.75 45.0 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.449 0.642 . . . . 1.0 110.737 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' PHE . . . . . 0.619 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 92.2 m-85 -127.44 148.88 50.3 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 114.868 -1.06 . . . . 1.0 110.533 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.6 p -139.81 16.67 2.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.704 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 107' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.0 OUTLIER -149.41 -174.95 4.81 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.526 -0.47 . . . . 1.0 110.293 178.961 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 108' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 52.0 p-10 -74.33 141.49 45.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.335 -0.393 . . . . 1.0 111.165 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.07 116.52 16.44 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.324 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 110' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' A' ' 166' ' ' SER . 83.5 p -90.97 -21.64 21.21 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.921 0.391 . . . . 1.0 110.911 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 38.5 m -146.4 94.54 2.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.406 0.622 . . . . 1.0 109.867 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 112' ' ' LEU . . . . . 0.619 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -60.59 -39.54 88.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.821 -1.081 . . . . 1.0 110.673 -178.467 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 113' ' ' GLN . . . . . 0.614 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 11.4 mp0 -49.09 -12.75 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.736 0.643 . . . . 1.0 112.736 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 114' ' ' ASP . . . . . 0.412 ' OD1' ' O ' ' A' ' 114' ' ' ASP . 61.6 t0 -88.87 -10.42 48.03 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.909 -0.774 . . . . 1.0 108.909 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -118.85 -39.52 2.95 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 114.22 1.193 . . . . 1.0 114.22 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 116' ' ' PHE . . . . . 0.623 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.08 135.2 53.4 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 122.523 1.154 . . . . 1.0 112.467 -178.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.13 -68.27 0.37 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.111 -0.949 . . . . 1.0 111.022 -177.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 118' ' ' PHE . . . . . 0.59 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 65.9 m-85 -42.91 141.62 1.07 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.406 -0.816 . . . . 1.0 109.61 -179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -101.15 5.7 42.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.928 0.394 . . . . 1.0 110.269 -179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -134.46 139.13 45.29 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.461 0.648 . . . . 1.0 111.344 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 121' ' ' ILE . . . . . 0.715 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 45.9 mm -119.5 123.39 71.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.853 -1.067 . . . . 1.0 108.895 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -115.08 15.72 17.11 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 111.9 0.333 . . . . 1.0 111.9 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 123' ' ' SER . . . . . 0.49 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 5.7 p 176.93 149.97 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.212 -0.662 . . . . 1.0 109.212 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 124' ' ' LEU . . . . . 0.46 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.1 pp -159.97 156.54 27.3 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.569 -0.742 . . . . 1.0 109.856 -178.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.21 109.31 13.25 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.194 -179.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 126' ' ' VAL . . . . . 0.43 HG22 HD12 ' A' ' 90' ' ' ILE . 4.1 t -96.4 103.95 15.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 109.171 -0.677 . . . . 1.0 109.171 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 127' ' ' LEU . . . . . 0.826 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -74.03 -36.87 64.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.562 179.578 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 128' ' ' GLU . . . . . 0.409 ' O ' ' O ' ' A' ' 129' ' ' GLY . 21.4 pt-20 -151.55 168.58 24.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.734 -0.666 . . . . 1.0 111.007 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 129' ' ' GLY . . . . . 0.409 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 54.41 167.79 0.03 OUTLIER Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.746 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 70.5 m -113.99 145.06 42.08 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.15 -0.685 . . . . 1.0 109.15 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 131' ' ' TRP . . . . . 0.514 ' CH2' HG22 ' A' ' 90' ' ' ILE . 30.3 m95 -120.52 162.24 19.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.474 -0.785 . . . . 1.0 110.64 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 16.3 t -137.03 93.04 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.749 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 133' ' ' LEU . . . . . 0.447 ' CD1' HD11 ' A' ' 146' ' ' LEU . 26.5 mt -66.09 146.15 55.0 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.21 -178.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 134' ' ' TYR . . . . . 0.583 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 60.1 m-85 -121.54 136.43 54.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.793 0.33 . . . . 1.0 111.071 178.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -48.39 -40.69 26.59 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.33 -0.395 . . . . 1.0 111.037 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 136' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -133.13 176.57 8.39 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.273 0.559 . . . . 1.0 111.069 -179.46 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.8 p -80.62 169.7 17.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.488 -0.778 . . . . 1.0 111.628 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 42.9 t30 64.98 15.51 10.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.888 -1.051 . . . . 1.0 110.614 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 42.26 79.32 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 1.0 112.536 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 140' ' ' ARG . . . . . 0.415 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 94.1 mtt-85 -147.39 35.45 0.88 Allowed 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.768 0.318 . . . . 1.0 110.934 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 141' ' ' GLY . . . . . 0.418 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -147.11 -142.52 3.71 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.559 -0.616 . . . . 1.0 111.559 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -77.1 167.1 22.37 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 110.119 -0.326 . . . . 1.0 110.119 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 143' ' ' GLN . . . . . 0.496 ' NE2' ' H ' ' A' ' 57' ' ' PHE . 1.8 pt20 -143.31 138.1 29.28 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.126 -178.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -128.99 123.05 31.39 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.065 0.393 . . . . 1.0 110.304 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 145' ' ' LEU . . . . . 0.591 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.7 OUTLIER -78.74 126.97 31.44 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.435 -0.802 . . . . 1.0 112.345 -178.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 146' ' ' LEU . . . . . 0.591 ' N ' HD23 ' A' ' 145' ' ' LEU . 40.0 mt -116.69 102.45 9.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.418 178.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 147' ' ' MET . . . . . 0.624 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -79.36 160.69 69.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 109.121 -0.696 . . . . 1.0 109.121 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -56.97 113.83 1.65 Allowed 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.888 1.726 . . . . 1.0 111.209 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.92 -153.91 15.95 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 110.539 -1.024 . . . . 1.0 110.539 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 150' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 53.6 p-10 -123.42 141.72 51.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.999 0.428 . . . . 1.0 110.614 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 151' ' ' TYR . . . . . 0.531 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.5 m-85 -133.17 129.32 37.65 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.952 -0.567 . . . . 1.0 109.837 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -118.27 -0.58 11.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.649 0.262 . . . . 1.0 110.331 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 153' ' ' ARG . . . . . 0.702 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.3 ptm180 -157.42 158.58 36.12 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.279 0.561 . . . . 1.0 110.36 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -74.16 -22.48 59.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 1.0 112.651 -177.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 155' ' ' GLN . . . . . 0.702 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.7 mt-30 -68.32 -18.84 64.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.48 -179.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 156' ' ' ASP . . . . . 0.531 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 58.6 t0 -54.17 -47.82 71.58 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.976 -0.289 . . . . 1.0 110.691 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 157' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 24.3 p90 -92.44 21.17 5.51 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 178.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.1 74.32 0.31 Allowed Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.931 -0.868 . . . . 1.0 110.931 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 159' ' ' ALA . . . . . 0.643 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.45 153.66 33.74 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.922 0.868 . . . . 1.0 111.677 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -81.8 -17.24 48.25 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.749 -1.569 . . . . 1.0 110.141 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 161' ' ' ASN . . . . . 0.499 ' ND2' ' H ' ' A' ' 162' ' ' ALA . 2.9 t30 -168.51 -171.38 1.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.821 -0.352 . . . . 1.0 110.351 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 162' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.58 -4.95 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 1.0 110.896 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 163' ' ' ARG . . . . . 0.409 ' HG3' HD22 ' A' ' 161' ' ' ASN . 95.4 mtt-85 -50.93 116.15 1.85 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 120.631 0.253 . . . . 1.0 111.317 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 164' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 162' ' ' ALA . 77.6 t -128.35 133.69 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.495 -0.557 . . . . 1.0 109.495 178.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 165' ' ' GLY . . . . . 0.43 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -110.38 -28.41 4.07 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.017 -0.433 . . . . 1.0 112.017 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 166' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 110' ' ' SER . 32.0 m -158.67 -168.56 2.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.731 0.3 . . . . 1.0 110.367 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.33 139.58 0.61 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.464 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 168' ' ' ARG . . . . . 0.583 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 8.8 ptp180 -129.68 154.2 47.38 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.675 -0.491 . . . . 1.0 109.675 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 169' ' ' ARG . . . . . 0.601 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -88.46 145.08 25.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.933 -0.766 . . . . 1.0 108.933 178.742 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 170' ' ' VAL . . . . . 0.501 ' C ' HD12 ' A' ' 171' ' ' ILE . 57.3 t -77.26 84.74 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.069 0.462 . . . . 1.0 110.862 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 171' ' ' ILE . . . . . 0.501 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.3 mp . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 115.739 -0.664 . . . . 1.0 109.577 179.493 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 88.7 mt-30 . . . . . 0 N--CA 1.49 1.535 0 N-CA-C 109.35 -0.611 . . . . 1.0 109.35 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.522 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -90.37 170.76 35.95 Favored Glycine 0 CA--C 1.524 0.627 0 N-CA-C 110.507 -1.037 . . . . 1.0 110.507 179.703 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 32.7 ttpt -167.66 107.63 0.57 Allowed 'General case' 0 C--N 1.329 -0.298 0 C-N-CA 121.008 -0.277 . . . . 1.0 110.604 179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.456 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.23 168.83 11.06 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.362 0 CA-C-O 121.229 0.538 . . . . 1.0 111.206 -179.128 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' CE1' ' A' ' 7' ' ' TYR . 33.0 m -126.24 121.18 31.97 Favored 'General case' 0 C--N 1.326 -0.449 0 N-CA-C 107.806 -1.183 . . . . 1.0 107.806 177.002 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 48.1 mt -106.59 134.72 49.3 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.008 -0.996 . . . . 1.0 110.117 -179.147 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.476 ' CE1' HG22 ' A' ' 5' ' ' THR . 72.8 m-85 -117.18 128.25 54.92 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.631 -0.713 . . . . 1.0 111.461 -178.252 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.3 tt0 -53.05 -31.87 43.85 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 115.701 -0.681 . . . . 1.0 110.301 179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -115.97 160.41 20.3 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.246 0.546 . . . . 1.0 110.774 179.422 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 10.5 ptm180 -63.76 -173.78 0.08 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.338 -0.846 . . . . 1.0 111.047 -178.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.89 26.69 0.48 Allowed Glycine 0 C--N 1.332 0.36 0 N-CA-C 110.765 -0.934 . . . . 1.0 110.765 178.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 6.4 m-85 50.29 70.41 0.51 Allowed 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.147 -179.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.4 mt-30 -133.69 -159.63 0.98 Allowed 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.915 0.388 . . . . 1.0 110.378 179.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.16 -150.77 0.97 Allowed Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.754 -0.938 . . . . 1.0 110.754 -179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.0 mtt-85 -68.44 145.56 53.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.738 0.304 . . . . 1.0 110.822 -179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 15.3 p-80 -135.59 151.84 50.67 Favored 'General case' 0 C--O 1.231 0.124 0 CA-C-O 121.288 0.566 . . . . 1.0 110.457 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -146.24 141.38 27.32 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.252 -0.886 . . . . 1.0 109.995 -179.919 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 73.4 tt0 -110.22 121.24 44.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 116.28 -0.418 . . . . 1.0 110.317 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.57 127.05 54.22 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-O 120.973 0.416 . . . . 1.0 111.043 -179.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 p -117.15 10.08 13.75 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-N 115.731 -0.668 . . . . 1.0 110.589 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 38.0 t -155.38 166.21 34.24 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.969 -0.56 . . . . 1.0 110.488 -179.236 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 49.2 m-20 -57.74 140.18 52.11 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.659 -179.513 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.51 146.86 48.54 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.589 -0.732 . . . . 1.0 110.743 -179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 34.1 p -114.87 -14.98 11.89 Favored 'General case' 0 CA--C 1.512 -0.484 0 CA-C-N 115.787 -0.642 . . . . 1.0 112.17 -178.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 26.6 t30 -150.87 111.08 4.14 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-O 121.216 0.532 . . . . 1.0 110.352 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 24.7 mt -111.43 0.96 16.74 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-N 115.304 -0.862 . . . . 1.0 110.278 -179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.607 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 20.4 mt-30 -51.65 -48.22 87.66 Favored Pre-proline 0 C--N 1.331 -0.221 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.009 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.607 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 24.5 Cg_endo -57.22 -33.08 95.34 Favored 'Trans proline' 0 N--CA 1.491 1.37 0 C-N-CA 121.322 1.348 . . . . 1.0 112.239 -179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 -94.17 -50.61 5.2 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 120.427 -0.509 . . . . 1.0 110.952 -178.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.7 mt -119.25 128.81 54.52 Favored 'General case' 0 N--CA 1.465 0.291 0 CA-C-N 116.114 -0.494 . . . . 1.0 110.872 -179.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 7.7 t -95.55 -8.2 35.77 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.842 -0.617 . . . . 1.0 111.631 -179.392 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.669 ' O ' ' O ' ' A' ' 75' ' ' SER . 88.6 mtm180 -145.0 -70.82 0.27 Allowed 'General case' 0 C--O 1.21 -1.018 0 N-CA-C 112.427 0.528 . . . . 1.0 112.427 -177.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 33.5 t 76.69 71.68 0.07 Allowed 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 122.757 0.423 . . . . 1.0 110.325 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.6 m-20 -92.76 3.0 56.44 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.609 -0.269 . . . . 1.0 111.378 -178.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.2 p -156.64 158.78 37.64 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-O 120.937 0.399 . . . . 1.0 110.181 179.478 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -156.25 153.84 29.77 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.918 -0.583 . . . . 1.0 111.495 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.5 mtp180 -131.94 122.45 25.63 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 108.771 -0.825 . . . . 1.0 108.771 178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.69 110.83 33.3 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.429 0 CA-C-O 121.254 0.55 . . . . 1.0 109.96 179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.1 m-20 -73.77 -43.5 58.78 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 115.296 -0.865 . . . . 1.0 110.851 179.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 95.7 p -160.83 160.34 30.99 Favored 'General case' 0 N--CA 1.445 -0.69 0 N-CA-C 108.761 -0.829 . . . . 1.0 108.761 -179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.05 168.29 42.8 Favored Glycine 0 CA--C 1.521 0.464 0 N-CA-C 111.158 -0.777 . . . . 1.0 111.158 179.255 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.498 ' SG ' ' O ' ' A' ' 171' ' ' ILE . 64.7 m -110.28 124.55 51.85 Favored 'General case' 0 CA--C 1.519 -0.23 0 N-CA-C 108.919 -0.771 . . . . 1.0 108.919 178.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.456 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 57.0 m95 -115.28 152.42 32.76 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.613 0.721 . . . . 1.0 111.616 -178.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.518 ' C ' HD12 ' A' ' 45' ' ' LEU . 2.1 ttt -127.72 133.92 49.55 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 114.713 -1.131 . . . . 1.0 109.021 177.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.518 HD12 ' C ' ' A' ' 44' ' ' MET . 8.9 mp -109.96 134.83 51.69 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.882 -1.054 . . . . 1.0 110.092 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 35.1 m-85 -111.49 133.45 53.77 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.343 0.592 . . . . 1.0 111.378 179.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.569 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.3 pt-20 -60.4 -37.11 79.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.306 -179.203 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -105.37 153.8 39.44 Favored Pre-proline 0 CA--C 1.533 0.318 0 CA-C-N 115.123 -0.944 . . . . 1.0 111.256 -178.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -66.93 152.51 80.25 Favored 'Trans proline' 0 N--CA 1.497 1.701 0 C-N-CA 122.776 2.318 . . . . 1.0 112.818 178.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.448 ' C ' ' CD1' ' A' ' 51' ' ' TYR . 3.3 m-80 60.71 32.54 20.26 Favored 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 115.237 -0.892 . . . . 1.0 110.955 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.448 ' CD1' ' C ' ' A' ' 50' ' ' ASN . 0.1 OUTLIER 46.6 65.07 1.29 Allowed 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.171 -0.922 . . . . 1.0 109.65 -179.114 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 36.7 m -123.2 17.44 9.91 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.435 -0.802 . . . . 1.0 111.798 -178.111 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -142.05 -154.28 6.13 Favored Glycine 0 N--CA 1.46 0.289 0 C-N-CA 120.687 -0.768 . . . . 1.0 111.572 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.569 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.0 tp -63.48 152.44 38.4 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 115.338 -0.431 . . . . 1.0 109.88 179.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.422 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 9.7 pt20 -123.72 149.28 45.73 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-O 120.646 0.26 . . . . 1.0 111.298 -179.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 -125.99 122.9 37.22 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.16 179.383 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.411 ' C ' HD12 ' A' ' 58' ' ' LEU . 76.8 t80 -82.9 122.38 28.19 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 121.084 0.469 . . . . 1.0 110.139 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.411 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.6 mp -118.21 147.46 43.36 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.712 -0.676 . . . . 1.0 109.521 179.583 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.404 ' O ' ' C ' ' A' ' 60' ' ' ARG . 5.3 ptm180 -136.39 161.82 34.76 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.723 -0.671 . . . . 1.0 109.897 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.404 ' C ' ' O ' ' A' ' 59' ' ' ARG . 62.3 ttp180 -38.49 124.73 1.32 Allowed 'General case' 0 N--CA 1.465 0.276 0 CA-C-O 120.766 0.317 . . . . 1.0 110.75 -178.068 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.6 -178.65 32.08 Favored Glycine 0 CA--C 1.525 0.693 0 N-CA-C 110.702 -0.959 . . . . 1.0 110.702 -179.663 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -115.84 131.52 56.91 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.888 0.375 . . . . 1.0 110.491 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.5 m-85 -125.09 113.4 17.69 Favored 'General case' 0 N--CA 1.467 0.381 0 N-CA-C 109.419 -0.585 . . . . 1.0 109.419 179.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.48 -1.87 55.13 Favored 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 116.275 -0.421 . . . . 1.0 111.914 -179.004 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 75.6 m-20 -148.11 146.76 28.93 Favored 'General case' 0 C--N 1.326 -0.442 0 N-CA-C 108.189 -1.041 . . . . 1.0 108.189 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.481 ' C ' ' H ' ' A' ' 68' ' ' GLN . 8.7 p-80 -66.13 -45.61 80.44 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.047 0.451 . . . . 1.0 111.296 -179.019 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.519 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 98.9 mm-40 -49.5 -9.86 0.04 OUTLIER 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 115.741 -0.663 . . . . 1.0 110.93 -179.66 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.481 ' H ' ' C ' ' A' ' 66' ' ' HIS . 14.7 mm-40 -81.46 -37.38 28.09 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 120.481 -0.487 . . . . 1.0 111.007 -179.133 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.453 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -87.89 18.82 3.88 Favored 'General case' 0 CA--C 1.509 -0.62 0 C-N-CA 120.323 -0.551 . . . . 1.0 111.244 179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.55 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 63.8 mtp 80.52 19.16 0.54 Allowed 'General case' 0 CA--C 1.521 -0.138 0 O-C-N 123.929 0.768 . . . . 1.0 109.833 -178.505 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.519 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . -59.24 94.32 0.06 OUTLIER Glycine 0 C--N 1.339 0.697 0 N-CA-C 110.431 -1.067 . . . . 1.0 110.431 178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 21.2 mt -69.4 -33.43 73.01 Favored 'General case' 0 C--N 1.319 -0.727 0 N-CA-C 109.642 -0.503 . . . . 1.0 109.642 177.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.41 ' O ' ' O ' ' A' ' 74' ' ' ASP . 22.8 t -135.59 126.13 26.94 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 116.304 -0.407 . . . . 1.0 110.492 179.426 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.525 ' O ' ' CB ' ' A' ' 75' ' ' SER . 52.9 p-10 -55.57 -172.48 0.0 OUTLIER 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 108.872 -0.788 . . . . 1.0 108.872 178.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.669 ' O ' ' O ' ' A' ' 32' ' ' ARG . 4.5 t 99.25 -122.91 0.0 OUTLIER 'General case' 0 C--O 1.21 -1.014 0 CA-C-O 118.834 -0.603 . . . . 1.0 109.546 179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.606 HG23 ' C ' ' A' ' 75' ' ' SER . 4.6 t 89.65 102.27 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 108.491 -0.929 . . . . 1.0 108.491 -178.275 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 83.7 mtt180 -117.76 7.89 12.59 Favored 'General case' 0 N--CA 1.465 0.31 0 C-N-CA 121.015 -0.274 . . . . 1.0 110.978 -178.557 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 33.6 p -162.49 162.82 27.65 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.143 0.496 . . . . 1.0 110.543 178.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 14.2 p -156.27 147.57 22.44 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.486 -0.779 . . . . 1.0 110.426 -178.247 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 4.9 ptm180 -126.93 151.44 48.48 Favored 'General case' 0 C--N 1.331 -0.233 0 CA-C-O 120.912 0.386 . . . . 1.0 110.241 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.522 HD21 ' H ' ' A' ' 2' ' ' GLY . 17.8 tp -97.45 126.86 42.97 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.302 -1.37 . . . . 1.0 107.302 177.725 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 28.7 mt -83.34 113.8 48.87 Favored Pre-proline 0 CA--C 1.538 0.5 0 C-N-CA 120.807 -0.357 . . . . 1.0 111.337 -177.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.449 ' C ' ' CG ' ' A' ' 84' ' ' HIS . 35.7 Cg_endo -79.14 175.41 10.9 Favored 'Trans proline' 0 N--CA 1.491 1.371 0 C-N-CA 121.811 1.674 . . . . 1.0 111.581 179.141 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.449 ' CG ' ' C ' ' A' ' 83' ' ' PRO . 30.5 m-70 80.92 131.14 0.05 Allowed 'General case' 0 N--CA 1.467 0.4 0 N-CA-C 114.415 1.265 . . . . 1.0 114.415 176.416 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 97.0 p -160.65 -1.51 0.06 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.993 -0.549 . . . . 1.0 111.527 177.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.476 ' O ' ' CE1' ' A' ' 88' ' ' HIS . . . -65.38 -115.38 0.01 OUTLIER Glycine 0 CA--C 1.524 0.651 0 N-CA-C 110.49 -1.044 . . . . 1.0 110.49 179.388 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m -77.58 156.12 31.07 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 109.923 -0.399 . . . . 1.0 109.923 179.485 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.652 ' NE2' HD11 ' A' ' 171' ' ' ILE . 12.6 m80 -128.19 97.15 4.66 Favored 'General case' 0 N--CA 1.466 0.328 0 C-N-CA 121.104 -0.238 . . . . 1.0 111.258 -179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.1 mtm180 -131.59 136.41 47.76 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 120.631 -0.428 . . . . 1.0 110.647 178.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.514 HG22 ' CZ2' ' A' ' 131' ' ' TRP . 18.4 tt -148.21 141.53 18.87 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.402 0 CA-C-O 120.895 0.379 . . . . 1.0 111.486 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.3 mtm180 -119.28 98.06 5.97 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.838 -0.619 . . . . 1.0 111.511 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 29.5 mt -76.9 139.82 40.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.203 0.525 . . . . 1.0 110.171 179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.587 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 55.1 m-85 -119.84 137.44 53.99 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-N 115.658 -0.701 . . . . 1.0 110.984 -179.786 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.527 ' OE2' ' CD1' ' A' ' 118' ' ' PHE . 1.8 tm-20 -56.32 -66.52 0.42 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.722 -0.672 . . . . 1.0 111.446 179.772 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.441 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.2 mtp85 -97.25 167.83 10.79 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.272 0.558 . . . . 1.0 111.715 -177.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -59.52 166.55 2.35 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-N 115.229 -0.896 . . . . 1.0 111.558 179.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.553 ' O ' ' CG ' ' A' ' 98' ' ' TYR . 97.1 m-20 51.29 43.99 29.06 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 114.676 -1.147 . . . . 1.0 111.243 -179.394 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.553 ' CG ' ' O ' ' A' ' 97' ' ' ASP . 12.5 p90 45.08 42.57 6.71 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 115.189 -0.914 . . . . 1.0 110.837 179.518 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 7.2 tpt85 -106.69 155.39 19.73 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 115.956 -0.566 . . . . 1.0 110.381 -179.322 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 86.52 -165.34 36.96 Favored Glycine 0 CA--C 1.526 0.777 0 N-CA-C 110.891 -0.883 . . . . 1.0 110.891 -179.623 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 59.7 tp60 -62.97 144.12 57.11 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.736 0.303 . . . . 1.0 110.81 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.587 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 6.3 ttp -131.67 148.08 52.56 Favored 'General case' 0 N--CA 1.472 0.65 0 CA-C-N 116.345 -0.389 . . . . 1.0 111.013 179.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.52 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.4 tt -141.14 140.93 31.76 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.484 0 N-CA-C 109.464 -0.569 . . . . 1.0 109.464 177.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -112.68 137.73 50.53 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 121.639 0.733 . . . . 1.0 110.895 -178.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -123.55 155.68 37.15 Favored 'General case' 0 CA--C 1.519 -0.244 0 CA-C-N 114.422 -1.263 . . . . 1.0 110.222 -179.36 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 16.7 p -143.07 25.98 1.71 Allowed 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.018 -0.537 . . . . 1.0 110.344 179.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.9 pt-20 -166.5 -166.86 0.91 Allowed 'General case' 0 C--O 1.231 0.12 0 CA-C-N 116.092 -0.504 . . . . 1.0 110.842 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 99.6 m-20 -76.09 141.99 41.85 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 116.125 -0.489 . . . . 1.0 111.111 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.9 m -130.6 92.56 3.27 Favored 'General case' 0 N--CA 1.469 0.489 0 CA-C-N 116.079 -0.51 . . . . 1.0 109.998 179.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.51 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.3 m -68.48 -32.12 71.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.357 -0.383 . . . . 1.0 111.7 -179.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 11.3 t -133.55 93.32 3.12 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.325 0.583 . . . . 1.0 110.479 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.485 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.7 tp -61.21 -42.91 99.43 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.232 -0.895 . . . . 1.0 110.363 -179.383 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 96.2 mm-40 -47.73 -9.28 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.697 -179.673 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.485 ' H ' ' C ' ' A' ' 112' ' ' LEU . 92.5 m-20 -96.4 -25.31 15.76 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 121.035 0.445 . . . . 1.0 110.407 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 35.9 mmt180 -108.28 -39.96 5.31 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.662 -0.699 . . . . 1.0 111.704 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.52 ' CD1' HG21 ' A' ' 103' ' ' ILE . 3.6 t80 -124.81 122.07 36.39 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 109.629 -0.508 . . . . 1.0 109.629 178.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 78.2 mtt-85 -60.69 -56.07 25.61 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.641 -178.534 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.527 ' CD1' ' OE2' ' A' ' 94' ' ' GLU . 95.2 m-85 -46.73 140.04 4.85 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.945 -0.571 . . . . 1.0 109.668 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -101.5 15.02 30.2 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.195 -0.457 . . . . 1.0 111.028 -178.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.476 ' N ' ' OE1' ' A' ' 120' ' ' GLU . 3.4 pm0 -151.51 148.66 28.31 Favored 'General case' 0 N--CA 1.455 -0.222 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.833 -179.067 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.627 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.1 mm -123.71 125.58 71.48 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.482 0 N-CA-C 109.547 -0.538 . . . . 1.0 109.547 178.819 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.557 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 16.3 m-70 -108.89 20.81 18.03 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.239 -0.437 . . . . 1.0 111.078 -178.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.487 ' H ' HG22 ' A' ' 121' ' ' ILE . 2.4 p 167.44 150.96 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.515 -0.55 . . . . 1.0 109.515 179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.457 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.1 pp -161.27 156.79 24.57 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.709 -0.678 . . . . 1.0 110.285 -178.731 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.1 112.03 17.72 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.499 -0.556 . . . . 1.0 109.499 178.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.483 HG22 HD12 ' A' ' 90' ' ' ILE . 23.9 t -98.58 105.81 17.88 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.175 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.207 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.838 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.73 -45.0 22.16 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.957 179.567 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.402 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 29.5 tp10 -156.67 157.52 35.33 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 120.61 -0.436 . . . . 1.0 111.477 -178.085 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.432 ' O ' ' O ' ' A' ' 130' ' ' SER . . . 64.2 78.72 0.19 Allowed Glycine 0 C--N 1.333 0.378 0 CA-C-N 115.99 -0.55 . . . . 1.0 112.365 177.873 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.432 ' O ' ' O ' ' A' ' 129' ' ' GLY . 4.2 m -32.28 151.66 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.251 0 CA-C-O 120.915 0.388 . . . . 1.0 111.599 -179.445 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.514 ' CZ2' HG22 ' A' ' 90' ' ' ILE . 46.9 m95 -122.03 168.21 12.2 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.387 -178.793 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 41.4 t -136.36 99.5 2.05 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-N 116.526 -0.306 . . . . 1.0 110.428 179.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.436 HD23 ' HB3' ' A' ' 167' ' ' LEU . 14.9 mt -74.77 141.35 44.39 Favored 'General case' 0 CA--C 1.513 -0.446 0 CA-C-N 116.174 -0.466 . . . . 1.0 110.612 -179.163 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 72.4 m-85 -120.45 134.66 55.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.02 -0.536 . . . . 1.0 110.366 179.074 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -48.81 -45.03 39.74 Favored 'General case' 0 CA--C 1.517 -0.323 0 CA-C-N 116.289 -0.414 . . . . 1.0 110.79 -179.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.775 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.7 OUTLIER -126.96 169.04 13.72 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 121.261 0.553 . . . . 1.0 110.478 -178.475 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 18.4 m -75.48 176.32 7.65 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.303 -0.862 . . . . 1.0 111.303 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 54.5 t-20 58.21 21.37 8.03 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 114.507 -1.224 . . . . 1.0 109.801 -179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.8 m-85 35.48 78.81 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 115.606 -0.724 . . . . 1.0 111.735 179.23 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.775 ' C ' HD11 ' A' ' 136' ' ' LEU . 63.2 ttt180 -149.01 45.6 1.0 Allowed 'General case' 0 N--CA 1.468 0.446 0 CA-C-O 121.0 0.429 . . . . 1.0 110.298 179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.512 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -157.42 -137.51 2.31 Favored Glycine 0 CA--C 1.525 0.658 0 N-CA-C 110.764 -0.935 . . . . 1.0 110.764 -179.378 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.449 HH12 ' CG2' ' A' ' 160' ' ' THR . 82.1 mtp180 -78.85 163.26 25.46 Favored 'General case' 0 C--N 1.331 -0.209 0 C-N-CA 120.958 -0.297 . . . . 1.0 110.224 179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.55 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.36 136.17 29.36 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.987 -0.551 . . . . 1.0 110.877 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 14.6 m-85 -128.23 140.4 51.92 Favored 'General case' 0 C--O 1.22 -0.476 0 N-CA-C 109.134 -0.691 . . . . 1.0 109.134 178.572 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.52 ' C ' HD22 ' A' ' 146' ' ' LEU . 39.0 tp -96.01 126.38 41.21 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-O 121.725 0.774 . . . . 1.0 111.425 -179.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.828 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.1 mm? -112.68 99.5 7.98 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 114.39 -1.277 . . . . 1.0 109.733 179.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.516 ' SD ' HD21 ' A' ' 145' ' ' LEU . 2.0 mpp? -73.94 167.68 33.17 Favored Pre-proline 0 CA--C 1.541 0.597 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 21.7 Cg_exo -62.91 116.43 3.55 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 C-N-CA 121.56 1.506 . . . . 1.0 111.163 178.192 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 178.08 -158.01 22.58 Favored Glycine 0 CA--C 1.528 0.868 0 N-CA-C 111.021 -0.832 . . . . 1.0 111.021 -179.508 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 45.5 t0 -124.78 115.69 21.11 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.081 0.467 . . . . 1.0 110.537 -179.978 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.462 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 37.1 m-85 -107.1 129.47 54.82 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.708 -0.678 . . . . 1.0 109.878 -179.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.4 mtt85 -113.15 -4.53 13.78 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-O 120.709 0.29 . . . . 1.0 110.604 -179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 9.1 ptp85 -156.38 166.35 33.67 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 121.365 0.603 . . . . 1.0 110.337 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 27.8 p90 -78.09 -20.1 52.89 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 115.016 -0.993 . . . . 1.0 112.249 -178.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 38.8 mt-30 -69.6 -20.02 63.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.786 0.327 . . . . 1.0 111.253 -179.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -50.42 -47.73 56.51 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.993 -179.188 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.599 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 24.5 p90 -97.65 22.22 9.32 Favored 'General case' 0 N--CA 1.463 0.215 0 CA-C-O 121.091 0.472 . . . . 1.0 110.35 179.376 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.19 74.32 0.31 Allowed Glycine 0 CA--C 1.523 0.532 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.54 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.599 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -121.28 149.1 43.41 Favored 'General case' 0 C--O 1.222 -0.379 0 CA-C-O 121.292 0.568 . . . . 1.0 110.593 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . 0.449 ' CG2' HH12 ' A' ' 142' ' ' ARG . 11.6 t -77.37 -10.73 59.62 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.75 -1.114 . . . . 1.0 110.198 178.023 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.45 HD22 ' HG3' ' A' ' 163' ' ' ARG . 3.3 t30 -172.0 -165.49 0.36 Allowed 'General case' 0 C--N 1.319 -0.722 0 C-N-CA 120.492 -0.483 . . . . 1.0 110.131 179.533 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.826 ' O ' HG23 ' A' ' 164' ' ' VAL . . . -111.7 -19.71 12.37 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 115.894 -0.593 . . . . 1.0 110.924 -179.79 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.45 ' HG3' HD22 ' A' ' 161' ' ' ASN . 99.6 mtt180 -31.9 116.77 0.19 Allowed 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.299 0.374 . . . . 1.0 111.881 -179.172 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.826 HG23 ' O ' ' A' ' 162' ' ' ALA . 62.4 t -126.28 137.15 58.67 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 CA-C-N 116.13 -0.486 . . . . 1.0 110.575 178.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -116.47 -34.57 1.29 Allowed Glycine 0 N--CA 1.465 0.581 0 N-CA-C 111.597 -0.601 . . . . 1.0 111.597 179.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.51 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -159.47 172.22 18.28 Favored 'General case' 0 CA--C 1.516 -0.329 0 C-N-CA 120.534 -0.466 . . . . 1.0 110.88 -179.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.436 ' HB3' HD23 ' A' ' 133' ' ' LEU . 0.5 OUTLIER -157.32 142.48 17.06 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.539 -179.209 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -130.66 166.36 20.86 Favored 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 108.351 -0.981 . . . . 1.0 108.351 178.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 14.1 ptt180 -104.01 139.45 39.11 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 115.448 -0.796 . . . . 1.0 109.607 179.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.566 ' C ' HD12 ' A' ' 171' ' ' ILE . 19.0 t -81.48 121.22 34.53 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.437 0 CA-C-N 116.413 -0.358 . . . . 1.0 110.849 -179.787 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.652 HD11 ' NE2' ' A' ' 88' ' ' HIS . 1.6 mp -122.27 129.62 75.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.922 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.189 179.342 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 90.0 m-20 -96.46 -17.65 20.41 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.798 -0.637 . . . . 1.0 110.797 178.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -61.84 -46.05 91.15 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-O 120.862 0.363 . . . . 1.0 110.737 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . 0.416 ' H ' HG22 ' A' ' 171' ' ' ILE . 44.8 t . . . . . 0 C--O 1.219 -0.514 0 CA-C-O 117.997 -1.002 . . . . 1.0 110.558 -179.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' A' ' 1' ' ' GLN . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.182 -0.673 . . . . 1.0 109.182 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.533 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -87.34 178.04 47.55 Favored Glycine 0 CA--C 1.524 0.615 0 N-CA-C 110.459 -1.057 . . . . 1.0 110.459 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 65.1 tttt -172.81 103.31 0.14 Allowed 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 110.124 -0.324 . . . . 1.0 110.124 178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.428 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.38 166.78 12.4 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.347 0 CA-C-O 121.089 0.471 . . . . 1.0 111.175 -178.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.452 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.5 m -124.62 121.19 34.03 Favored 'General case' 0 CA--C 1.513 -0.448 0 N-CA-C 107.86 -1.163 . . . . 1.0 107.86 177.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 39.0 mt -106.19 133.72 50.46 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 114.874 -1.057 . . . . 1.0 110.244 -179.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.452 ' CE1' HG22 ' A' ' 5' ' ' THR . 61.6 m-85 -115.97 125.94 53.18 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.351 -0.84 . . . . 1.0 111.219 -178.908 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.8 tt0 -53.75 -29.7 41.02 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.507 179.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.6 m-20 -117.84 153.85 32.81 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-O 121.292 0.567 . . . . 1.0 110.675 179.658 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.422 ' C ' ' N ' ' A' ' 12' ' ' PHE . 16.3 ptt-85 -59.58 -176.22 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.827 -179.701 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 46.1 22.53 0.9 Allowed Glycine 0 C--N 1.33 0.211 0 N-CA-C 110.552 -1.019 . . . . 1.0 110.552 178.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.537 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 10.6 m-85 54.14 67.85 0.94 Allowed 'General case' 0 C--N 1.322 -0.623 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 89.3 mm-40 -129.92 -155.66 0.71 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 121.029 0.443 . . . . 1.0 110.468 179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.14 -152.46 0.11 Allowed Glycine 0 CA--C 1.527 0.804 0 N-CA-C 110.984 -0.846 . . . . 1.0 110.984 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.3 mtp180 -68.98 146.53 52.66 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-O 120.787 0.327 . . . . 1.0 110.69 -179.704 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -135.55 145.19 46.75 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.265 0.555 . . . . 1.0 110.444 179.985 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.545 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.4 t80 -140.26 142.26 35.76 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.31 -0.859 . . . . 1.0 110.213 -179.88 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.545 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 41.1 tt0 -110.63 122.08 46.89 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.101 -0.499 . . . . 1.0 110.154 -179.53 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.435 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -109.75 126.24 53.53 Favored 'General case' 0 N--CA 1.469 0.478 0 CA-C-O 120.998 0.428 . . . . 1.0 110.67 -179.571 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 7.8 t -117.32 13.96 14.65 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 115.624 -0.716 . . . . 1.0 110.357 179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.9 m -157.91 167.87 28.74 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.119 -0.491 . . . . 1.0 110.582 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 83.8 m-20 -58.67 140.13 55.06 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.577 -0.738 . . . . 1.0 111.549 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.435 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.16 145.31 45.65 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.868 -0.605 . . . . 1.0 110.821 179.943 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 61.2 p -112.64 -11.92 13.48 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.976 -179.308 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 14.7 t30 -149.73 117.92 6.4 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.514 0.673 . . . . 1.0 110.172 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.46 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.8 mp -113.13 -2.44 14.15 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.096 -0.956 . . . . 1.0 110.246 -179.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.629 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.4 OUTLIER -58.15 -41.77 91.43 Favored Pre-proline 0 C--N 1.328 -0.344 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.301 -178.867 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.629 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.9 Cg_exo -58.79 -37.7 92.53 Favored 'Trans proline' 0 C--N 1.304 -1.802 0 C-N-CA 122.175 1.917 . . . . 1.0 111.599 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -97.22 -51.21 4.28 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 120.919 0.39 . . . . 1.0 111.327 -179.264 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.46 ' N ' ' O ' ' A' ' 26' ' ' LEU . 6.9 mt -118.55 127.95 54.1 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 115.965 -0.561 . . . . 1.0 110.735 -178.611 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.4 t -94.75 -8.39 37.77 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.937 -179.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -147.5 -58.04 0.25 Allowed 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 111.955 0.354 . . . . 1.0 111.955 -178.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t 63.08 74.83 0.42 Allowed 'General case' 0 C--N 1.325 -0.475 0 CA-C-O 120.755 0.312 . . . . 1.0 110.174 -177.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.513 ' OD1' ' CE1' ' A' ' 66' ' ' HIS . 1.3 t30 -90.56 3.89 52.77 Favored 'General case' 0 C--O 1.225 -0.236 0 CA-C-N 116.197 -0.456 . . . . 1.0 111.284 -178.825 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.537 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -157.25 155.9 31.58 Favored 'General case' 0 C--N 1.327 -0.373 0 C-N-CA 120.749 -0.38 . . . . 1.0 110.051 179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 155.11 35.39 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.147 -0.479 . . . . 1.0 111.431 -179.101 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -132.74 121.41 23.01 Favored 'General case' 0 C--O 1.217 -0.642 0 N-CA-C 108.602 -0.888 . . . . 1.0 108.602 178.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.3 t -108.53 117.77 54.7 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.305 0 O-C-N 123.629 0.581 . . . . 1.0 109.905 -179.951 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -78.84 -43.81 24.35 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.995 179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 50.1 m -161.2 159.38 28.76 Favored 'General case' 0 N--CA 1.445 -0.692 0 N-CA-C 109.316 -0.624 . . . . 1.0 109.316 -179.788 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.21 174.45 50.39 Favored Glycine 0 C--N 1.316 -0.55 0 N-CA-C 110.96 -0.856 . . . . 1.0 110.96 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 98.3 m -112.85 131.0 55.9 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 108.949 -0.76 . . . . 1.0 108.949 178.523 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.526 ' CE2' HD13 ' A' ' 81' ' ' LEU . 54.6 m95 -119.26 143.21 47.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-O 121.29 0.567 . . . . 1.0 111.438 -179.211 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.544 ' C ' HD12 ' A' ' 45' ' ' LEU . 1.2 tpt -113.93 129.0 56.64 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.393 178.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.544 HD12 ' C ' ' A' ' 44' ' ' MET . 9.6 mp -108.15 127.57 53.93 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.995 -0.743 . . . . 1.0 108.995 179.681 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.1 m-85 -106.85 133.41 51.55 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 121.687 0.756 . . . . 1.0 111.215 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.58 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.4 pt-20 -62.66 -36.7 83.73 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-N 114.828 -1.078 . . . . 1.0 110.296 -179.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -106.59 151.68 40.49 Favored Pre-proline 0 CA--C 1.531 0.249 0 CA-C-N 115.244 -0.889 . . . . 1.0 110.912 -179.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -65.1 154.14 74.91 Favored 'Trans proline' 0 N--CA 1.494 1.518 0 C-N-CA 122.575 2.183 . . . . 1.0 112.737 178.63 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.482 HD22 ' N ' ' A' ' 50' ' ' ASN . 1.4 m-80 59.47 34.8 22.7 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 114.967 -1.015 . . . . 1.0 110.721 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 23' ' ' HIS . 1.5 m-85 42.93 66.22 0.81 Allowed 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.34 -0.846 . . . . 1.0 110.26 -178.105 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 14.4 m -123.58 17.31 9.61 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.283 -0.871 . . . . 1.0 111.298 -178.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -141.29 -155.12 6.37 Favored Glycine 0 N--CA 1.462 0.375 0 C-N-CA 120.693 -0.765 . . . . 1.0 111.553 179.734 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.58 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.4 tp -65.82 151.99 45.41 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 115.459 -0.371 . . . . 1.0 110.426 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.7 pt20 -123.15 152.03 41.54 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 120.742 0.306 . . . . 1.0 111.624 -179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.402 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 27.1 m-85 -127.76 125.82 40.63 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 116.011 -0.541 . . . . 1.0 111.302 179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 57.7 t80 -82.6 121.92 27.44 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-N 116.336 -0.393 . . . . 1.0 109.962 -179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.2 mp -122.34 146.08 47.65 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 121.11 0.481 . . . . 1.0 110.311 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.467 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 42.5 mtp180 -134.69 160.42 38.18 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.494 -0.775 . . . . 1.0 110.283 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.41 ' C ' ' O ' ' A' ' 59' ' ' ARG . 9.7 ptm180 -34.02 127.32 0.42 Allowed 'General case' 0 CA--C 1.531 0.219 0 CA-C-N 115.829 -0.623 . . . . 1.0 111.272 -179.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.63 -179.53 30.66 Favored Glycine 0 CA--C 1.52 0.372 0 N-CA-C 111.084 -0.807 . . . . 1.0 111.084 -179.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.441 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.9 p-10 -116.36 125.19 51.75 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.161 0.505 . . . . 1.0 110.432 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 38.3 m-85 -118.93 113.49 21.09 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.769 -0.651 . . . . 1.0 109.426 179.611 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.422 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.44 -3.31 53.35 Favored 'General case' 0 C--N 1.319 -0.735 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.669 -179.218 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.422 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -148.36 141.63 25.13 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 108.628 -0.879 . . . . 1.0 108.628 179.26 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.513 ' CE1' ' OD1' ' A' ' 34' ' ' ASN . 22.8 p-80 -62.52 -41.41 98.83 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.174 0.512 . . . . 1.0 110.689 -179.037 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.3 mt-30 -51.98 -8.94 0.08 Allowed 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.46 179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.476 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -81.31 -34.93 31.6 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.116 -178.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -92.78 15.65 14.15 Favored 'General case' 0 CA--C 1.511 -0.554 0 C-N-CA 120.813 -0.355 . . . . 1.0 110.515 179.445 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.442 ' C ' ' H ' ' A' ' 72' ' ' LEU . 58.7 mtt 72.55 30.55 1.88 Allowed 'General case' 0 CA--C 1.514 -0.433 0 O-C-N 124.31 1.006 . . . . 1.0 109.633 -178.923 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.692 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -67.75 41.4 0.25 Allowed Glycine 0 CA--C 1.525 0.668 0 CA-C-O 118.786 -1.008 . . . . 1.0 112.834 -178.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.481 ' C ' ' O ' ' A' ' 71' ' ' GLY . 18.3 mt -6.53 -52.61 0.0 OUTLIER 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.808 0.843 . . . . 1.0 111.741 179.63 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.692 ' N ' ' O ' ' A' ' 71' ' ' GLY . 37.1 m -110.78 120.98 44.18 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-N 115.356 -0.838 . . . . 1.0 108.98 177.379 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 40.9 p-10 -67.17 40.51 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.294 0 CA-C-O 120.933 0.397 . . . . 1.0 111.188 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.53 ' H ' ' C ' ' A' ' 73' ' ' SER . 30.0 t -115.23 126.45 54.56 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.951 -0.568 . . . . 1.0 109.712 179.822 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -149.06 112.64 0.66 Allowed 'Isoleucine or valine' 0 C--N 1.322 -0.622 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.1 mtm180 -122.91 4.78 9.38 Favored 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.703 0.287 . . . . 1.0 110.723 -179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.7 t -166.12 163.42 18.06 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-O 121.199 0.523 . . . . 1.0 110.822 178.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -155.89 146.63 22.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.433 -0.803 . . . . 1.0 109.945 -178.107 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.519 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 3.1 ptm180 -126.99 151.51 48.48 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.728 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.533 HD21 ' H ' ' A' ' 2' ' ' GLY . 27.5 tp -100.05 135.22 41.81 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 108.457 -0.942 . . . . 1.0 108.457 178.47 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.451 ' H ' HD12 ' A' ' 81' ' ' LEU . 3.5 mt -96.7 111.32 56.94 Favored Pre-proline 0 CA--C 1.543 0.711 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 -179.821 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -50.71 149.57 13.8 Favored 'Trans proline' 0 N--CA 1.5 1.9 0 C-N-CA 121.901 1.734 . . . . 1.0 113.295 -179.598 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 61.4 m170 -68.91 179.55 1.79 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.144 -0.934 . . . . 1.0 110.311 179.648 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 21.1 m -164.73 153.54 12.71 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.11 -0.495 . . . . 1.0 111.354 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.437 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . -100.78 -69.59 0.88 Allowed Glycine 0 CA--C 1.524 0.604 0 N-CA-C 109.725 -1.35 . . . . 1.0 109.725 178.763 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . 0.405 ' O ' ' CG ' ' A' ' 128' ' ' GLU . 3.8 m -80.62 144.34 32.43 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 109.744 -0.465 . . . . 1.0 109.744 178.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.437 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 4.8 m170 -128.06 104.17 7.63 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.835 -0.166 . . . . 1.0 111.379 -179.654 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.7 mtt180 -136.29 139.64 42.8 Favored 'General case' 0 N--CA 1.47 0.541 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.191 178.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.404 HD12 HG22 ' A' ' 126' ' ' VAL . 19.5 tt -149.6 141.81 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 120.735 0.302 . . . . 1.0 111.389 -179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.5 mtp180 -119.05 98.39 6.15 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.922 -0.581 . . . . 1.0 112.237 -179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.45 HD11 HD22 ' A' ' 167' ' ' LEU . 22.1 mt -79.88 142.91 34.75 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 115.999 -0.546 . . . . 1.0 110.538 179.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.555 ' CG ' ' HB3' ' A' ' 98' ' ' TYR . 25.2 m-85 -125.41 137.68 54.01 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-N 115.822 -0.626 . . . . 1.0 111.923 -179.179 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.505 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 2.3 tm-20 -56.08 -58.14 9.18 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.791 -0.64 . . . . 1.0 111.584 179.718 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 78.6 mtp85 -107.36 172.34 6.88 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-O 121.173 0.511 . . . . 1.0 111.128 -178.657 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.502 ' O ' ' N ' ' A' ' 98' ' ' TYR . 97.4 mt-10 -60.77 164.72 4.49 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 115.432 -0.804 . . . . 1.0 110.735 179.377 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.535 ' C ' ' CD1' ' A' ' 98' ' ' TYR . 24.3 m-20 39.89 23.68 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.533 0 CA-C-N 116.09 -0.505 . . . . 1.0 111.369 179.676 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.612 ' CD2' ' O ' ' A' ' 98' ' ' TYR . 37.9 p90 35.4 75.91 0.05 Allowed 'General case' 0 C--N 1.32 -0.708 0 CA-C-O 121.769 0.795 . . . . 1.0 111.885 179.801 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.464 ' NH1' ' CB ' ' A' ' 97' ' ' ASP . 46.8 mtt85 -111.99 11.13 20.55 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.584 -0.734 . . . . 1.0 111.385 179.495 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -136.54 -141.38 4.28 Favored Glycine 0 N--CA 1.467 0.709 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 179.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 70.4 tp60 -69.04 141.55 54.79 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.006 0.431 . . . . 1.0 110.872 -179.429 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.515 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 154.36 48.22 Favored 'General case' 0 N--CA 1.469 0.522 0 CA-C-N 115.661 -0.7 . . . . 1.0 111.058 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.6 tt -145.77 139.42 21.27 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.421 0 N-CA-C 109.33 -0.619 . . . . 1.0 109.33 177.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -113.39 144.73 42.29 Favored 'General case' 0 N--CA 1.471 0.613 0 CA-C-O 121.681 0.753 . . . . 1.0 111.141 -179.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.785 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 85.2 m-85 -130.61 156.3 45.1 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 114.692 -1.14 . . . . 1.0 110.934 -179.127 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.0 p -143.66 31.57 1.31 Allowed 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.477 179.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 18.7 pt-20 -170.85 -169.08 0.73 Allowed 'General case' 0 C--N 1.33 -0.268 0 C-N-CA 120.628 -0.429 . . . . 1.0 110.796 178.424 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.429 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 55.2 p-10 -82.68 149.29 27.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.353 179.268 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 3.3 t -137.63 101.1 4.38 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.334 179.756 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.444 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.1 p -69.14 -19.47 64.02 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 120.635 -0.426 . . . . 1.0 111.072 -179.512 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 33.7 t -149.83 91.07 1.75 Allowed 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.155 0.502 . . . . 1.0 109.989 -179.634 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.785 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 13.6 tp -58.97 -39.68 82.47 Favored 'General case' 0 C--O 1.219 -0.548 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.32 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.654 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 14.4 mp0 -42.75 -14.01 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.493 0 N-CA-C 111.971 0.36 . . . . 1.0 111.971 178.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.519 ' N ' ' O ' ' A' ' 112' ' ' LEU . 55.3 t0 -93.1 0.45 57.26 Favored 'General case' 0 N--CA 1.473 0.697 0 CA-C-O 121.582 0.706 . . . . 1.0 110.401 -179.534 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.533 ' N ' ' O ' ' A' ' 112' ' ' LEU . 36.8 mmt180 -132.16 -39.13 1.06 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 114.518 -1.219 . . . . 1.0 113.266 -177.438 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.684 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.91 134.7 55.3 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-O 122.19 0.995 . . . . 1.0 110.96 -179.268 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 118' ' ' PHE . 38.1 mmt180 -71.47 -69.97 0.35 Allowed 'General case' 0 C--N 1.323 -0.582 0 O-C-N 121.064 -1.022 . . . . 1.0 110.433 -177.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.625 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -37.29 146.84 0.04 OUTLIER 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.968 -0.56 . . . . 1.0 110.347 179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 44.9 p-10 -105.24 11.19 33.26 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 120.767 0.318 . . . . 1.0 110.962 -178.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -140.49 141.38 35.37 Favored 'General case' 0 CA--C 1.528 0.117 0 CA-C-O 121.267 0.556 . . . . 1.0 111.173 -178.851 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.651 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 39.1 mm -121.09 126.91 75.72 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.439 0 CA-C-N 115.251 -0.886 . . . . 1.0 109.498 178.296 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.453 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.0 m-70 -118.56 26.74 9.37 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-N 116.141 -0.481 . . . . 1.0 111.69 -178.417 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' C ' ' A' ' 152' ' ' ARG . 3.8 m 165.21 151.46 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.044 0.449 . . . . 1.0 110.276 179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.446 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.4 pp -163.79 158.12 19.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.681 -0.69 . . . . 1.0 110.78 -178.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -123.14 117.97 26.59 Favored 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 109.505 -0.554 . . . . 1.0 109.505 178.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.404 HG22 HD12 ' A' ' 90' ' ' ILE . 23.2 t -101.92 105.01 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.256 0 CA-C-N 116.235 -0.438 . . . . 1.0 110.109 179.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.874 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.83 -44.2 28.07 Favored 'General case' 0 C--N 1.324 -0.524 0 CA-C-N 115.82 -0.627 . . . . 1.0 111.177 179.39 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.405 ' CG ' ' O ' ' A' ' 87' ' ' SER . 33.0 tp10 -157.72 150.25 22.7 Favored 'General case' 0 N--CA 1.454 -0.247 0 C-N-CA 120.695 -0.402 . . . . 1.0 111.277 -178.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.554 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.6 79.7 0.29 Allowed Glycine 0 C--O 1.229 -0.199 0 CA-C-N 116.116 -0.493 . . . . 1.0 112.322 177.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.424 ' O ' ' O ' ' A' ' 129' ' ' GLY . 45.3 t -31.6 148.38 0.01 OUTLIER 'General case' 0 C--O 1.233 0.232 0 CA-C-O 121.345 0.593 . . . . 1.0 111.242 179.672 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.554 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 41.7 m95 -124.3 163.07 22.44 Favored 'General case' 0 CA--C 1.505 -0.764 0 CA-C-N 115.096 -0.956 . . . . 1.0 111.289 -177.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 42.9 t -132.46 138.34 52.39 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.446 0 N-CA-C 108.754 -0.832 . . . . 1.0 108.754 178.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.502 ' HG ' HD11 ' A' ' 146' ' ' LEU . 43.4 mt -110.39 141.74 43.04 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 109.679 -0.489 . . . . 1.0 109.679 179.338 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -117.74 135.3 54.13 Favored 'General case' 0 C--N 1.329 -0.309 0 O-C-N 123.209 0.318 . . . . 1.0 110.896 179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 71.5 tt0 -48.35 -42.08 30.41 Favored 'General case' 0 N--CA 1.466 0.342 0 CA-C-N 116.227 -0.442 . . . . 1.0 111.075 179.984 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.769 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -131.33 167.27 19.53 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-O 121.208 0.528 . . . . 1.0 110.181 -178.684 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.4 m -72.94 175.22 6.8 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.858 179.708 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 40.7 m-80 62.0 16.69 8.36 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 114.856 -1.065 . . . . 1.0 109.796 -179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 39.24 77.86 0.05 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.922 -0.581 . . . . 1.0 111.533 179.753 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.769 ' C ' HD11 ' A' ' 136' ' ' LEU . 73.5 mtp180 -146.57 41.18 1.12 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.723 0.297 . . . . 1.0 110.48 179.008 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.475 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -153.5 -142.8 3.54 Favored Glycine 0 N--CA 1.463 0.485 0 N-CA-C 111.31 -0.716 . . . . 1.0 111.31 -178.647 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.0 mtt180 -73.5 166.76 22.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 C-N-CA 120.786 -0.366 . . . . 1.0 110.154 179.737 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -146.27 136.44 23.68 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.009 -179.321 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 -128.1 130.3 47.95 Favored 'General case' 0 N--CA 1.477 0.883 0 N-CA-C 109.557 -0.535 . . . . 1.0 109.557 178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 45.4 tp -85.51 126.95 34.25 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-O 121.342 0.591 . . . . 1.0 111.219 -179.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.502 HD11 ' HG ' ' A' ' 133' ' ' LEU . 25.6 mt -114.75 106.5 14.28 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-N 115.156 -0.929 . . . . 1.0 109.819 179.454 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.59 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.7 160.81 65.97 Favored Pre-proline 0 CA--C 1.533 0.293 0 CA-C-N 116.203 -0.453 . . . . 1.0 110.291 -179.669 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.2 Cg_endo -58.75 112.62 1.26 Allowed 'Trans proline' 0 N--CA 1.495 1.576 0 C-N-CA 122.302 2.001 . . . . 1.0 110.868 178.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.99 -152.55 12.35 Favored Glycine 0 CA--C 1.53 0.991 0 N-CA-C 110.538 -1.025 . . . . 1.0 110.538 -179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 49.0 p-10 -125.94 134.72 51.44 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-O 121.09 0.472 . . . . 1.0 110.821 -179.877 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -124.83 124.62 42.48 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-N 115.924 -0.58 . . . . 1.0 109.638 -179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . 0.53 ' C ' ' OG ' ' A' ' 123' ' ' SER . 95.2 mtt-85 -112.97 1.8 15.54 Favored 'General case' 0 N--CA 1.468 0.43 0 CA-C-O 120.626 0.25 . . . . 1.0 110.369 -179.597 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.689 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.9 ptm180 -160.83 162.61 32.31 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.556 178.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.528 ' CD1' ' N ' ' A' ' 155' ' ' GLN . 0.2 OUTLIER -75.76 -24.06 56.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.138 -0.937 . . . . 1.0 112.314 -178.233 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.689 ' NE2' HH21 ' A' ' 153' ' ' ARG . 1.1 mt-30 -63.89 -20.18 65.64 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.153 -0.476 . . . . 1.0 111.282 -178.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . 0.479 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 52.6 t0 -51.22 -49.31 61.32 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 115.945 -0.57 . . . . 1.0 111.365 -178.677 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.726 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 26.1 p90 -96.58 19.05 12.89 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.026 0.441 . . . . 1.0 110.505 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.07 73.95 0.34 Allowed Glycine 0 CA--C 1.52 0.389 0 N-CA-C 111.227 -0.749 . . . . 1.0 111.227 179.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.726 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -116.45 141.92 47.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 121.52 0.676 . . . . 1.0 111.337 -179.794 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . 0.457 HG23 ' N ' ' A' ' 161' ' ' ASN . 15.0 t -66.79 -38.68 87.0 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 114.5 -1.227 . . . . 1.0 110.238 177.477 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.457 ' N ' HG23 ' A' ' 160' ' ' THR . 21.9 m120 -145.21 -172.51 3.88 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.019 0.438 . . . . 1.0 110.265 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.651 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.83 -2.06 18.76 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.935 -0.575 . . . . 1.0 110.822 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -53.99 118.13 3.76 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-O 121.001 0.429 . . . . 1.0 111.239 -178.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 56.0 t -125.87 131.23 72.09 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.78 0 CA-C-N 115.463 -0.79 . . . . 1.0 109.49 178.08 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.31 -28.57 4.3 Favored Glycine 0 N--CA 1.465 0.605 0 N-CA-C 111.659 -0.576 . . . . 1.0 111.659 -179.506 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 110' ' ' SER . 7.9 m -159.47 -172.3 3.66 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 109.938 -0.393 . . . . 1.0 109.938 -179.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.659 HD21 HD13 ' A' ' 112' ' ' LEU . 2.3 pp -173.57 145.06 1.17 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 120.433 -0.507 . . . . 1.0 111.56 -179.704 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.467 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 6.2 ptm180 -133.84 164.76 26.54 Favored 'General case' 0 N--CA 1.465 0.286 0 CA-C-O 121.067 0.46 . . . . 1.0 110.285 179.151 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.443 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -98.33 147.03 25.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.581 -0.896 . . . . 1.0 108.581 178.45 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.782 ' C ' HD12 ' A' ' 171' ' ' ILE . 61.2 t -79.55 84.07 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.473 0 C-N-CA 120.634 -0.426 . . . . 1.0 111.157 -178.455 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.782 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.8 mp -133.87 118.03 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.291 0 N-CA-C 109.66 -0.496 . . . . 1.0 109.66 179.154 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 30.1 t0 -68.98 -36.19 77.59 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.58 -0.736 . . . . 1.0 110.473 179.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -59.54 -79.89 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.206 0 CA-C-N 116.04 -0.527 . . . . 1.0 110.8 -179.662 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 41.3 t . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.98 -1.01 . . . . 1.0 110.788 179.594 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.539 ' O ' ' NE2' ' A' ' 84' ' ' HIS . 69.6 tp60 . . . . . 0 N--CA 1.491 1.598 0 N-CA-C 109.14 -0.689 . . . . 1.0 109.14 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.04 175.27 44.76 Favored Glycine 0 CA--C 1.522 0.529 0 N-CA-C 110.523 -1.031 . . . . 1.0 110.523 179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.2 ttpt -171.88 106.74 0.21 Allowed 'General case' 0 C--N 1.328 -0.356 0 C-N-CA 120.996 -0.282 . . . . 1.0 110.724 179.29 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.445 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.73 170.36 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 CA-C-O 121.129 0.49 . . . . 1.0 111.059 -178.786 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.5 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.6 m -127.41 120.41 28.38 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 108.226 -1.027 . . . . 1.0 108.226 177.202 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 52.4 mt -105.87 133.43 50.61 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.938 -179.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.5 ' CE1' HG22 ' A' ' 5' ' ' THR . 58.2 m-85 -114.83 129.39 56.69 Favored 'General case' 0 CA--C 1.514 -0.428 0 CA-C-N 115.505 -0.771 . . . . 1.0 111.026 -178.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.535 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.5 tt0 -56.03 -23.16 31.45 Favored 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.308 -179.582 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -123.73 155.22 38.25 Favored 'General case' 0 N--CA 1.471 0.6 0 CA-C-O 121.045 0.45 . . . . 1.0 110.465 179.327 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.0 ptm180 -59.84 -174.48 0.03 OUTLIER 'General case' 0 C--O 1.225 -0.212 0 CA-C-N 115.558 -0.746 . . . . 1.0 110.501 -179.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.46 28.64 0.61 Allowed Glycine 0 C--N 1.332 0.351 0 N-CA-C 110.964 -0.855 . . . . 1.0 110.964 178.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.546 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 6.1 m-85 49.71 67.24 0.93 Allowed 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 109.921 -0.4 . . . . 1.0 109.921 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -128.15 -160.83 1.05 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 120.953 0.406 . . . . 1.0 110.58 -179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 44.92 -151.74 0.73 Allowed Glycine 0 CA--C 1.524 0.624 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.535 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.1 mtm180 -69.3 148.95 49.02 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.705 0.288 . . . . 1.0 110.782 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.5 p-80 -135.42 145.71 47.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.308 0.575 . . . . 1.0 110.284 -179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.9 t80 -140.89 141.95 34.53 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.127 -0.942 . . . . 1.0 109.809 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.558 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 66.7 tt0 -110.53 120.89 43.88 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.124 -179.58 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -107.92 126.52 52.78 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 121.033 0.444 . . . . 1.0 110.747 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -117.58 12.23 14.01 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.55 -0.75 . . . . 1.0 110.385 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 35.5 p -156.94 167.09 31.52 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 121.191 0.52 . . . . 1.0 110.425 -179.396 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.441 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 53.8 p-10 -58.1 142.56 46.63 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.555 -0.748 . . . . 1.0 111.684 -179.814 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.75 147.17 44.48 Favored 'General case' 0 CA--C 1.536 0.407 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.904 -179.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.3 p -115.45 -16.29 11.42 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 115.614 -0.721 . . . . 1.0 111.908 -179.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -150.18 109.96 4.07 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.248 0.547 . . . . 1.0 109.989 -179.204 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 20.9 mt -108.43 2.36 22.32 Favored 'General case' 0 N--CA 1.462 0.139 0 CA-C-N 115.388 -0.823 . . . . 1.0 110.41 -179.62 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.615 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 10.3 mt-30 -56.89 -41.06 89.43 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 116.141 -0.482 . . . . 1.0 110.698 -179.601 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.615 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.3 Cg_exo -59.34 -36.47 94.3 Favored 'Trans proline' 0 C--N 1.306 -1.689 0 C-N-CA 122.058 1.838 . . . . 1.0 111.999 -179.501 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -94.21 -47.51 6.61 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-O 120.843 0.354 . . . . 1.0 111.24 -179.039 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 11.4 mt -120.09 127.79 52.86 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.338 -178.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -91.26 -6.8 52.7 Favored 'General case' 0 C--N 1.321 -0.67 0 CA-C-N 116.086 -0.506 . . . . 1.0 110.854 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.64 ' NE ' HD21 ' A' ' 34' ' ' ASN . 3.4 mmm-85 177.59 120.58 0.03 OUTLIER 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 -178.53 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t -102.09 111.35 23.59 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.805 0.336 . . . . 1.0 110.498 178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.64 HD21 ' NE ' ' A' ' 32' ' ' ARG . 19.2 m120 -106.01 -3.72 21.34 Favored 'General case' 0 C--O 1.223 -0.337 0 CA-C-N 116.405 -0.361 . . . . 1.0 110.247 179.487 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.546 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 3.8 t -157.11 155.64 31.39 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.801 0.334 . . . . 1.0 110.371 -179.765 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.04 155.25 36.52 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.205 -179.177 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp85 -132.7 122.04 24.01 Favored 'General case' 0 C--O 1.217 -0.641 0 N-CA-C 108.794 -0.817 . . . . 1.0 108.794 178.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.6 t -107.67 116.32 50.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 121.29 0.567 . . . . 1.0 109.799 179.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 15.4 t0 -77.29 -43.97 31.35 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.335 -0.848 . . . . 1.0 110.979 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 44.4 t -161.89 152.79 17.85 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 109.226 -0.657 . . . . 1.0 109.226 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 86.82 176.38 49.33 Favored Glycine 0 C--N 1.317 -0.501 0 N-CA-C 111.07 -0.812 . . . . 1.0 111.07 179.518 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.1 m -113.02 139.68 48.46 Favored 'General case' 0 C--N 1.327 -0.401 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 178.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.446 ' CE2' HD13 ' A' ' 81' ' ' LEU . 55.3 m95 -128.18 138.88 52.67 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.225 0.536 . . . . 1.0 111.268 -179.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.536 ' C ' HD12 ' A' ' 45' ' ' LEU . 1.0 OUTLIER -107.43 127.19 53.37 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.357 -0.838 . . . . 1.0 109.282 178.501 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.536 HD12 ' C ' ' A' ' 44' ' ' MET . 10.2 mp -108.65 129.84 55.33 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.536 -0.756 . . . . 1.0 109.297 -179.92 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 97.1 m-85 -112.23 131.65 55.37 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 121.631 0.729 . . . . 1.0 111.094 -179.489 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.642 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.9 pt-20 -58.88 -35.42 72.96 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.067 -0.97 . . . . 1.0 111.072 -179.646 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.4 mt-30 -108.57 154.22 41.72 Favored Pre-proline 0 N--CA 1.467 0.396 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.689 -179.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_endo -66.05 159.12 50.9 Favored 'Trans proline' 0 N--CA 1.499 1.818 0 C-N-CA 122.843 2.362 . . . . 1.0 112.866 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.629 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.8 OUTLIER 62.94 43.3 6.86 Favored 'General case' 0 N--CA 1.462 0.141 0 CA-C-N 115.733 -0.667 . . . . 1.0 110.917 179.805 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 44.2 72.74 0.18 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.836 -179.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.0 m -141.2 157.77 44.8 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 109.743 -0.466 . . . . 1.0 109.743 -178.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.36 -146.84 21.16 Favored Glycine 0 N--CA 1.446 -0.689 0 C-N-CA 120.732 -0.747 . . . . 1.0 111.78 179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.642 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.7 tp -79.72 144.02 34.03 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 114.971 -0.614 . . . . 1.0 110.282 -179.652 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -120.73 150.7 40.57 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.45 0.167 . . . . 1.0 110.872 179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 17.8 m-85 -126.73 126.26 43.18 Favored 'General case' 0 C--N 1.345 0.377 0 CA-C-O 120.83 0.348 . . . . 1.0 111.318 -179.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -82.94 122.74 28.67 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.955 -0.566 . . . . 1.0 109.495 179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.6 mp -121.19 146.21 47.02 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 116.066 -0.516 . . . . 1.0 110.189 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.55 ' NH1' ' NH2' ' A' ' 168' ' ' ARG . 36.9 mtp180 -134.09 159.19 41.59 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.277 179.319 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.6 ptm180 -35.09 125.67 0.57 Allowed 'General case' 0 CA--C 1.528 0.123 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.804 -179.752 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 -178.64 32.92 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.683 -0.967 . . . . 1.0 110.683 -179.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.432 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 42.2 p-10 -116.4 126.99 54.23 Favored 'General case' 0 N--CA 1.463 0.198 0 CA-C-O 121.02 0.438 . . . . 1.0 110.608 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.8 m-85 -121.43 113.94 20.57 Favored 'General case' 0 C--O 1.224 -0.261 0 CA-C-N 115.815 -0.63 . . . . 1.0 109.43 179.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.5 -2.83 53.93 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.637 -179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 55.8 m-20 -147.95 140.77 24.75 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 108.835 -0.802 . . . . 1.0 108.835 179.6 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.474 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.8 p-80 -62.13 -42.03 98.85 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.06 0.457 . . . . 1.0 110.799 -179.054 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -52.16 -8.63 0.08 Allowed 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.606 -0.725 . . . . 1.0 110.665 179.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.474 ' H ' ' C ' ' A' ' 66' ' ' HIS . 16.9 mm-40 -83.58 -36.06 24.23 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 120.552 -0.459 . . . . 1.0 111.363 -178.422 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.458 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.85 15.93 10.35 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 120.709 -0.396 . . . . 1.0 111.265 179.629 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.495 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 44.3 mtt 84.0 14.22 0.3 Allowed 'General case' 0 CA--C 1.52 -0.207 0 O-C-N 124.175 0.922 . . . . 1.0 109.574 -178.254 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -58.8 100.17 0.16 Allowed Glycine 0 C--N 1.339 0.711 0 N-CA-C 110.712 -0.955 . . . . 1.0 110.712 179.188 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 37.4 mt -79.68 -33.41 41.13 Favored 'General case' 0 C--N 1.326 -0.418 0 N-CA-C 109.659 -0.497 . . . . 1.0 109.659 177.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 42.7 t -135.67 121.62 19.96 Favored 'General case' 0 N--CA 1.465 0.285 0 N-CA-C 109.471 -0.566 . . . . 1.0 109.471 178.534 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.515 ' OD2' ' NH1' ' A' ' 32' ' ' ARG . 56.4 p-10 -64.18 -153.07 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 108.85 -0.796 . . . . 1.0 108.85 179.649 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.509 ' O ' ' C ' ' A' ' 76' ' ' VAL . 1.3 t 91.65 -54.89 0.01 OUTLIER 'General case' 0 CA--C 1.51 -0.588 0 C-N-CA 122.376 0.27 . . . . 1.0 111.034 179.381 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.509 ' C ' ' O ' ' A' ' 75' ' ' SER . 3.6 t 22.74 93.44 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.606 0 O-C-N 123.895 0.747 . . . . 1.0 110.785 178.599 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 81.6 mtt180 -104.45 4.95 33.79 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.648 -177.201 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 23.3 p -163.17 162.56 25.56 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-O 121.263 0.554 . . . . 1.0 110.61 178.556 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.0 p -157.46 148.45 21.48 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.383 -0.826 . . . . 1.0 110.058 -177.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.599 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 4.3 ptm180 -127.93 149.86 50.14 Favored 'General case' 0 CA--C 1.517 -0.305 0 CA-C-O 120.75 0.31 . . . . 1.0 110.397 179.692 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.446 HD13 ' CE2' ' A' ' 43' ' ' TRP . 20.9 tp -99.08 129.11 45.33 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 108.253 -1.017 . . . . 1.0 108.253 178.563 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.416 ' N ' HD12 ' A' ' 81' ' ' LEU . 4.5 mt -90.89 114.17 60.52 Favored Pre-proline 0 CA--C 1.544 0.72 0 N-CA-C 109.893 -0.41 . . . . 1.0 109.893 -179.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -52.21 149.67 21.49 Favored 'Trans proline' 0 N--CA 1.5 1.911 0 C-N-CA 121.97 1.78 . . . . 1.0 113.215 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.539 ' NE2' ' O ' ' A' ' 1' ' ' GLN . 40.8 m170 -68.76 -179.76 1.53 Allowed 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 115.306 -0.861 . . . . 1.0 110.295 179.415 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.1 m -160.48 151.42 18.85 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.948 -179.814 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -91.71 -79.73 1.4 Allowed Glycine 0 CA--C 1.52 0.385 0 N-CA-C 109.805 -1.318 . . . . 1.0 109.805 178.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.5 m -85.65 159.06 19.92 Favored 'General case' 0 C--O 1.231 0.122 0 N-CA-C 109.664 -0.495 . . . . 1.0 109.664 179.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 10.7 m80 -129.78 119.26 23.12 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.706 -0.225 . . . . 1.0 110.96 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 3.6 ptp180 -147.86 133.78 19.13 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 178.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.522 HD12 HG22 ' A' ' 126' ' ' VAL . 17.6 tt -147.51 146.94 17.87 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 C-N-CA 121.152 -0.219 . . . . 1.0 110.962 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.3 mtt180 -125.71 103.69 7.96 Favored 'General case' 0 N--CA 1.473 0.705 0 O-C-N 123.389 0.43 . . . . 1.0 111.511 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -86.21 149.1 25.33 Favored 'General case' 0 CA--C 1.512 -0.499 0 CA-C-O 121.157 0.503 . . . . 1.0 111.839 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.439 ' CD2' ' CD1' ' A' ' 98' ' ' TYR . 77.3 m-85 -125.44 138.92 54.02 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 115.823 -0.626 . . . . 1.0 112.396 -179.123 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.469 ' N ' ' CD ' ' A' ' 94' ' ' GLU . 1.2 mm-40 -57.19 -55.25 37.22 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 115.803 -0.635 . . . . 1.0 111.2 178.923 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.424 ' O ' ' OG ' ' A' ' 123' ' ' SER . 75.7 mtp180 -109.68 173.24 6.42 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.238 -178.106 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.7 mt-10 -63.91 164.38 10.39 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.61 -0.723 . . . . 1.0 111.27 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.411 ' C ' ' CG ' ' A' ' 98' ' ' TYR . 92.0 m-20 43.43 25.21 0.07 Allowed 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.614 -0.721 . . . . 1.0 111.256 179.832 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.604 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.1 OUTLIER 63.4 28.53 15.53 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.692 -0.685 . . . . 1.0 111.16 178.946 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -72.49 21.39 0.06 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.88 -0.6 . . . . 1.0 111.976 -177.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.495 ' H ' ' C ' ' A' ' 98' ' ' TYR . . . -148.97 -173.73 19.93 Favored Glycine 0 CA--C 1.524 0.603 0 N-CA-C 110.874 -0.891 . . . . 1.0 110.874 -179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.525 ' NE2' ' H ' ' A' ' 102' ' ' MET . 53.9 tp60 -56.34 156.43 5.88 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-O 121.231 0.538 . . . . 1.0 110.617 179.827 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.525 ' H ' ' NE2' ' A' ' 101' ' ' GLN . 0.4 OUTLIER -127.4 146.06 50.6 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 115.954 -0.566 . . . . 1.0 110.651 -179.752 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.6 tt -141.8 140.49 30.43 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.593 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -114.31 143.6 44.62 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.573 0.701 . . . . 1.0 110.949 -178.636 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.753 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 86.1 m-85 -130.37 154.38 47.75 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 114.781 -1.1 . . . . 1.0 110.739 -179.64 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.61 11.23 1.65 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.726 -0.67 . . . . 1.0 111.151 179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.964 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.5 pt-20 -160.79 79.11 0.62 Allowed 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 119.221 -0.419 . . . . 1.0 109.918 179.479 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.964 ' O ' ' O ' ' A' ' 107' ' ' GLU . 55.5 p30 18.77 167.96 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 122.434 1.112 . . . . 1.0 113.634 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 10.5 t -148.0 109.7 4.45 Favored 'General case' 0 C--N 1.316 -0.885 0 O-C-N 120.737 -1.227 . . . . 1.0 110.505 179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.437 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.53 -18.58 64.39 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 116.309 -0.405 . . . . 1.0 110.9 -179.899 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.423 ' SG ' ' O ' ' A' ' 110' ' ' SER . 85.1 m -151.84 88.7 1.42 Allowed 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.081 0.467 . . . . 1.0 109.819 179.737 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.753 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 11.9 tp -61.01 -41.49 96.64 Favored 'General case' 0 C--O 1.222 -0.36 0 CA-C-N 115.566 -0.743 . . . . 1.0 110.163 -178.612 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.571 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 24.3 mp0 -43.16 -10.29 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.285 -0.416 . . . . 1.0 112.113 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.564 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.7 t0 -95.13 -22.83 17.61 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 121.125 0.488 . . . . 1.0 110.434 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.511 ' N ' ' O ' ' A' ' 112' ' ' LEU . 34.5 mmt180 -107.06 -38.67 5.95 Favored 'General case' 0 N--CA 1.467 0.415 0 N-CA-C 113.136 0.791 . . . . 1.0 113.136 -178.657 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.66 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -119.11 138.58 52.8 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 122.035 0.922 . . . . 1.0 110.811 -179.828 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.44 ' O ' ' C ' ' A' ' 118' ' ' PHE . 32.1 mmt180 -72.21 -73.67 0.19 Allowed 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.11 -0.994 . . . . 1.0 110.447 -177.551 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.616 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 98.1 m-85 -33.23 143.22 0.03 OUTLIER 'General case' 0 C--O 1.22 -0.485 0 O-C-N 123.588 0.555 . . . . 1.0 110.515 179.591 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.6 t-20 -103.07 6.49 38.66 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-O 121.079 0.466 . . . . 1.0 110.853 -178.152 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 91.1 mt-10 -137.68 141.59 41.11 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.753 -0.658 . . . . 1.0 111.017 -179.504 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 41.8 mm -121.19 116.94 51.23 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.341 0 CA-C-N 115.258 -0.883 . . . . 1.0 109.582 178.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.438 ' O ' ' CB ' ' A' ' 123' ' ' SER . 37.7 m-70 -109.44 29.97 7.06 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.915 -0.584 . . . . 1.0 111.581 -179.156 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.8 p 163.33 149.69 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 121.095 0.474 . . . . 1.0 110.078 179.388 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 1.9 pp -163.3 157.52 20.29 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.564 -0.743 . . . . 1.0 110.338 -178.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.91 119.62 29.29 Favored 'General case' 0 C--N 1.323 -0.587 0 CA-C-O 120.792 0.33 . . . . 1.0 110.161 -179.797 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.522 HG22 HD12 ' A' ' 90' ' ' ILE . 44.3 t -103.17 104.01 15.97 Favored 'Isoleucine or valine' 0 C--O 1.235 0.316 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 179.063 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.918 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -77.91 -40.76 38.74 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.658 -0.701 . . . . 1.0 111.331 -179.726 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 38.9 tp10 -137.21 146.37 44.77 Favored 'General case' 0 C--O 1.232 0.151 0 CA-C-O 121.102 0.477 . . . . 1.0 111.26 -178.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 56.55 -171.39 2.36 Favored Glycine 0 CA--C 1.519 0.327 0 N-CA-C 111.177 -0.769 . . . . 1.0 111.177 179.523 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.3 m -119.37 157.12 28.81 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 121.318 0.58 . . . . 1.0 109.877 -179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 54.0 m95 -129.98 162.27 29.05 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.452 -0.795 . . . . 1.0 110.753 -178.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 47.0 t -132.32 138.34 52.51 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.453 0 N-CA-C 109.181 -0.674 . . . . 1.0 109.181 179.032 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.5 ' HG ' HD11 ' A' ' 146' ' ' LEU . 39.3 mt -110.75 143.18 41.66 Favored 'General case' 0 CA--C 1.513 -0.478 0 N-CA-C 109.793 -0.447 . . . . 1.0 109.793 179.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 22.4 m-85 -117.97 133.35 56.01 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 120.756 0.312 . . . . 1.0 110.904 179.393 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 77.4 tt0 -47.41 -30.38 3.28 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 116.152 -0.476 . . . . 1.0 110.943 179.832 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.5 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -140.27 177.13 8.21 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 121.085 0.469 . . . . 1.0 110.493 -179.677 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.464 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -83.37 172.29 12.65 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.637 179.577 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . 0.464 ' N ' ' OG ' ' A' ' 137' ' ' SER . 6.2 m120 64.24 19.21 11.69 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.17 -0.923 . . . . 1.0 110.078 -179.245 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 3.7 m-85 35.59 78.7 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.706 179.613 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.404 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 65.2 ttt180 -147.38 36.79 0.91 Allowed 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.185 0.516 . . . . 1.0 110.388 179.876 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.459 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -149.25 -141.77 3.49 Favored Glycine 0 C--N 1.335 0.487 0 N-CA-C 111.163 -0.775 . . . . 1.0 111.163 -178.594 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.7 mtt180 -75.25 164.89 25.98 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 110.058 -0.349 . . . . 1.0 110.058 179.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.495 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.99 137.59 29.44 Favored 'General case' 0 N--CA 1.464 0.268 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.791 -179.681 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.4 m-85 -127.56 124.2 37.61 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 109.558 -0.534 . . . . 1.0 109.558 178.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 40.7 tp -81.0 127.22 32.33 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-N 115.806 -0.634 . . . . 1.0 111.048 -179.506 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.5 HD11 ' HG ' ' A' ' 133' ' ' LEU . 23.1 mt -115.32 105.09 12.46 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 114.925 -1.034 . . . . 1.0 109.643 179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.599 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.8 mtm -80.76 159.84 68.07 Favored Pre-proline 0 C--N 1.327 -0.391 0 CA-C-N 116.383 -0.372 . . . . 1.0 110.105 -179.483 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -56.06 115.99 2.86 Favored 'Trans proline' 0 N--CA 1.493 1.487 0 C-N-CA 122.27 1.98 . . . . 1.0 110.966 179.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 174.75 -151.29 12.22 Favored Glycine 0 CA--C 1.531 1.043 0 N-CA-C 110.513 -1.035 . . . . 1.0 110.513 -179.112 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.44 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 42.2 p-10 -128.55 131.92 48.24 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-O 120.977 0.417 . . . . 1.0 110.954 -179.681 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 14.6 m-85 -122.14 127.97 50.72 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.019 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt-85 -115.52 -1.1 12.86 Favored 'General case' 0 N--CA 1.468 0.458 0 CA-C-O 120.719 0.295 . . . . 1.0 110.692 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.9 ptt-85 -156.96 163.1 39.5 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.305 179.116 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.564 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.96 -22.34 56.03 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.055 -0.975 . . . . 1.0 111.827 -178.26 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.539 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.42 -21.47 66.66 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.938 -0.574 . . . . 1.0 111.249 -178.997 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -49.75 -47.32 50.87 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 116.069 -0.514 . . . . 1.0 110.909 -178.447 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.664 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 30.5 p90 -102.48 17.57 23.3 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-O 121.175 0.512 . . . . 1.0 109.95 179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.57 74.17 0.32 Allowed Glycine 0 CA--C 1.521 0.443 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.467 179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.664 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.58 -171.24 2.7 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.35 0.595 . . . . 1.0 110.907 179.66 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -120.58 -35.58 3.36 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 114.985 -1.007 . . . . 1.0 112.277 -178.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.601 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.3 OUTLIER -145.67 -27.4 0.45 Allowed 'General case' 0 N--CA 1.466 0.347 0 N-CA-C 111.696 0.258 . . . . 1.0 111.696 -178.433 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.601 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 96.92 0.38 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 O-C-N 124.36 1.038 . . . . 1.0 110.736 -179.506 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 96.5 mtt180 -66.55 116.07 7.12 Favored 'General case' 0 CA--C 1.507 -0.695 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.139 -178.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 60.5 t -118.8 128.79 75.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 CA-C-N 115.198 -0.91 . . . . 1.0 110.415 179.139 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.503 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -104.65 -26.02 6.65 Favored Glycine 0 N--CA 1.464 0.53 0 N-CA-C 111.393 -0.683 . . . . 1.0 111.393 179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 110' ' ' SER . 4.6 m -159.44 -173.69 4.29 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 120.787 -0.365 . . . . 1.0 110.03 -179.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.521 HD21 HD13 ' A' ' 112' ' ' LEU . 2.5 pp -171.51 144.32 1.9 Allowed 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 120.373 -0.531 . . . . 1.0 111.521 -179.569 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.55 ' NH2' ' NH1' ' A' ' 59' ' ' ARG . 4.9 ptm180 -135.8 164.04 28.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.4 0.619 . . . . 1.0 109.908 179.446 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.878 ' H ' HH11 ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.48 150.02 21.08 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.008 -0.997 . . . . 1.0 109.171 178.329 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.811 ' C ' HD12 ' A' ' 171' ' ' ILE . 44.6 t -82.95 83.59 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 C-N-CA 120.785 -0.366 . . . . 1.0 111.189 -178.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.811 HD12 ' C ' ' A' ' 170' ' ' VAL . 2.0 mp -133.65 124.43 47.81 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.296 0 CA-C-N 116.104 -0.498 . . . . 1.0 109.978 179.263 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.534 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 44.4 p-10 -73.86 -36.22 64.83 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 115.719 -0.673 . . . . 1.0 110.368 179.205 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.534 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 94.2 m-85 -56.67 -77.7 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.623 -179.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 10.9 t . . . . . 0 C--O 1.22 -0.45 0 CA-C-O 118.044 -0.979 . . . . 1.0 110.616 179.856 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 98.8 mm-40 . . . . . 0 N--CA 1.489 1.513 0 N-CA-C 109.051 -0.722 . . . . 1.0 109.051 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.678 ' H ' HD11 ' A' ' 81' ' ' LEU . . . -93.73 172.82 33.05 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 110.599 -1.0 . . . . 1.0 110.599 179.814 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -172.02 112.7 0.31 Allowed 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 121.145 -0.222 . . . . 1.0 110.79 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.541 HG22 HG13 ' A' ' 38' ' ' VAL . 0.0 OUTLIER -120.07 173.91 5.61 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.31 0 O-C-N 123.174 0.296 . . . . 1.0 111.057 -179.015 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.509 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.4 m -131.36 120.62 23.37 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.299 -1.0 . . . . 1.0 108.299 177.164 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 46.9 mt -105.12 132.64 51.08 Favored 'General case' 0 C--N 1.332 -0.195 0 CA-C-N 114.898 -1.046 . . . . 1.0 110.027 -179.416 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.509 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.2 m-85 -114.89 129.4 56.7 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 115.241 -0.89 . . . . 1.0 111.354 -178.333 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.534 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 80.9 tt0 -55.45 -26.73 43.82 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 115.197 -0.911 . . . . 1.0 110.389 -179.264 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.6 m-20 -122.86 154.71 37.92 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.027 0.441 . . . . 1.0 110.209 179.381 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.403 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 6.5 ptp85 -58.32 -173.92 0.01 OUTLIER 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 115.541 -0.754 . . . . 1.0 110.257 -179.177 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.53 27.24 0.48 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 178.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.555 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.8 m-85 49.91 67.45 0.9 Allowed 'General case' 0 C--N 1.317 -0.811 0 CA-C-N 115.496 -0.352 . . . . 1.0 110.074 -179.763 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -127.19 -160.16 0.98 Allowed 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 120.991 0.424 . . . . 1.0 110.485 179.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.61 -149.08 0.75 Allowed Glycine 0 CA--C 1.526 0.72 0 N-CA-C 110.882 -0.887 . . . . 1.0 110.882 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.534 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 89.8 mtm-85 -72.49 149.8 43.82 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.682 0.277 . . . . 1.0 110.78 179.863 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.9 p-80 -137.48 148.8 46.34 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-O 121.279 0.562 . . . . 1.0 110.35 -179.692 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.525 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.9 t80 -141.86 142.18 33.1 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.259 -0.882 . . . . 1.0 109.924 179.898 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.525 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 77.0 tt0 -110.8 122.56 48.14 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.121 -179.806 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.33 126.59 54.38 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.707 -179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.6 p -118.85 11.47 12.62 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.501 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.2 p -156.1 168.8 26.12 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.055 -0.52 . . . . 1.0 110.536 -178.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -59.51 138.52 57.66 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 115.68 -0.691 . . . . 1.0 111.392 -179.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.08 143.64 48.15 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.224 179.577 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.438 HG22 ' CE2' ' A' ' 51' ' ' TYR . 27.6 p -111.35 -18.59 12.87 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.581 -0.736 . . . . 1.0 111.793 -179.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 36.7 t30 -148.14 110.07 4.52 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.071 0.462 . . . . 1.0 110.405 -179.349 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.2 mt -108.11 1.0 21.98 Favored 'General case' 0 N--CA 1.466 0.327 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.179 179.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.569 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 47.1 mt-30 -53.34 -48.21 93.38 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.632 178.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.569 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 21.0 Cg_endo -56.86 -35.24 98.19 Favored 'Trans proline' 0 N--CA 1.496 1.652 0 C-N-CA 121.255 1.303 . . . . 1.0 112.881 -179.927 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.0 m-85 -91.36 -46.9 7.77 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 121.244 0.545 . . . . 1.0 110.945 -178.561 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 16.6 mt -119.84 128.18 53.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.329 -0.851 . . . . 1.0 111.469 -178.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -91.0 -15.54 29.46 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.723 -0.671 . . . . 1.0 111.351 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.47 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 59.7 ttm-85 -176.13 120.08 0.16 Allowed 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.706 -0.85 . . . . 1.0 108.706 -179.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 49.7 t -99.53 109.91 22.4 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 110.348 -0.241 . . . . 1.0 110.348 179.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -103.37 -3.29 25.71 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 116.435 -0.348 . . . . 1.0 110.228 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.555 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.1 t -157.84 156.36 31.3 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 110.192 -0.299 . . . . 1.0 110.192 -179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.13 155.36 36.59 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.224 -0.444 . . . . 1.0 110.719 -179.211 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.3 mtp85 -133.89 122.02 22.56 Favored 'General case' 0 C--O 1.214 -0.792 0 N-CA-C 108.791 -0.818 . . . . 1.0 108.791 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.541 HG13 HG22 ' A' ' 4' ' ' ILE . 22.3 t -107.19 117.55 53.19 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.477 0 CA-C-O 121.27 0.557 . . . . 1.0 110.333 179.617 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -78.77 -43.45 25.49 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-N 115.064 -0.971 . . . . 1.0 110.874 179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 35.8 t -162.96 162.02 25.9 Favored 'General case' 0 N--CA 1.446 -0.67 0 N-CA-C 109.424 -0.584 . . . . 1.0 109.424 -179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.67 177.17 48.7 Favored Glycine 0 C--N 1.315 -0.637 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.7 m -114.24 132.58 56.08 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 109.645 -0.502 . . . . 1.0 109.645 178.493 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.648 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 53.4 m95 -120.27 146.49 46.03 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.898 -0.592 . . . . 1.0 110.661 -179.664 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.557 ' C ' HD12 ' A' ' 45' ' ' LEU . 22.0 tpp -120.49 131.18 54.6 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-N 115.549 -0.751 . . . . 1.0 109.212 178.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.557 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -109.58 131.27 55.22 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.664 -0.698 . . . . 1.0 109.838 -179.689 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.41 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 87.9 m-85 -111.69 133.09 54.16 Favored 'General case' 0 C--O 1.237 0.43 0 CA-C-O 121.579 0.704 . . . . 1.0 111.687 -179.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -57.65 -36.89 72.45 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.125 -0.943 . . . . 1.0 111.389 -179.362 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.428 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.7 mt-30 -108.11 153.25 41.91 Favored Pre-proline 0 C--N 1.331 -0.219 0 CA-C-N 116.039 -0.528 . . . . 1.0 110.635 -178.771 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_endo -63.6 159.43 40.88 Favored 'Trans proline' 0 C--N 1.312 -1.394 0 C-N-CA 122.458 2.106 . . . . 1.0 112.172 178.366 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.688 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.53 36.9 13.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.254 -0.884 . . . . 1.0 111.332 179.89 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.438 ' CE2' HG22 ' A' ' 24' ' ' THR . 3.2 m-85 50.77 75.96 0.17 Allowed 'General case' 0 C--N 1.318 -0.781 0 CA-C-N 115.057 -0.974 . . . . 1.0 111.071 -179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.3 m -144.07 152.97 41.7 Favored 'General case' 0 N--CA 1.454 -0.255 0 CA-C-O 121.105 0.479 . . . . 1.0 110.244 -178.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.84 -148.16 21.53 Favored Glycine 0 N--CA 1.449 -0.47 0 C-N-CA 121.038 -0.601 . . . . 1.0 111.801 -179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.629 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.1 tp -75.49 143.58 42.49 Favored 'General case' 0 N--CA 1.447 -0.611 0 CA-C-N 115.038 -0.581 . . . . 1.0 110.262 -179.405 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.7 pt20 -120.84 150.79 40.49 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 120.482 0.182 . . . . 1.0 110.591 179.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 26.1 m-85 -124.99 124.12 41.32 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-O 120.841 0.353 . . . . 1.0 110.585 179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 64.3 t80 -83.1 123.07 29.16 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.068 -179.213 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 8.0 mp -119.37 144.07 47.08 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-N 115.415 -0.812 . . . . 1.0 110.03 179.789 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.409 ' O ' ' C ' ' A' ' 60' ' ' ARG . 0.0 OUTLIER -132.4 158.91 40.76 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.121 -0.945 . . . . 1.0 110.141 -179.924 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.409 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.7 ttp85 -37.09 125.32 0.94 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 115.997 -0.547 . . . . 1.0 110.763 -178.75 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.58 -179.97 32.01 Favored Glycine 0 CA--C 1.525 0.69 0 N-CA-C 110.53 -1.028 . . . . 1.0 110.53 -179.67 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 33.0 m-20 -114.14 136.23 53.16 Favored 'General case' 0 N--CA 1.463 0.206 0 CA-C-O 120.897 0.379 . . . . 1.0 110.19 179.572 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -130.37 112.9 13.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.87 -0.605 . . . . 1.0 109.616 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.83 -3.85 55.59 Favored 'General case' 0 C--N 1.317 -0.824 0 CA-C-N 116.033 -0.531 . . . . 1.0 111.411 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.428 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 78.9 m-20 -147.6 135.7 21.36 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 109.13 -0.693 . . . . 1.0 109.13 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.666 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 5.1 p80 -56.34 -41.06 75.46 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.045 0.45 . . . . 1.0 111.057 -178.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.1 mm-40 -54.52 -6.96 0.13 Allowed 'General case' 0 C--N 1.318 -0.799 0 CA-C-N 115.785 -0.643 . . . . 1.0 110.617 178.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.471 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -82.89 -34.43 26.67 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 120.152 -0.619 . . . . 1.0 111.606 -178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.404 ' O ' ' HB2' ' A' ' 70' ' ' MET . 2.3 p90 -94.51 15.68 17.3 Favored 'General case' 0 C--N 1.315 -0.9 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.743 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.437 ' C ' ' H ' ' A' ' 72' ' ' LEU . 70.2 mtp 76.18 27.89 0.85 Allowed 'General case' 0 C--O 1.224 -0.252 0 O-C-N 124.341 1.025 . . . . 1.0 109.679 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.592 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.2 39.61 0.84 Allowed Glycine 0 C--N 1.341 0.851 0 C-N-CA 119.974 -1.108 . . . . 1.0 112.073 -179.125 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.483 ' C ' ' O ' ' A' ' 71' ' ' GLY . 11.0 mt -17.12 -47.56 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.573 0.749 . . . . 1.0 110.889 -178.548 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.592 ' N ' ' O ' ' A' ' 71' ' ' GLY . 6.7 t -104.33 116.86 32.9 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.342 -0.845 . . . . 1.0 109.003 177.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 54.4 t0 -67.49 37.51 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 116.228 -0.442 . . . . 1.0 110.876 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.519 ' H ' ' C ' ' A' ' 73' ' ' SER . 23.9 t -116.95 126.57 53.14 Favored 'General case' 0 CA--C 1.51 -0.584 0 N-CA-C 109.557 -0.534 . . . . 1.0 109.557 -179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p -164.7 113.61 0.07 OUTLIER 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 O-C-N 123.85 0.719 . . . . 1.0 109.212 -179.143 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -122.2 13.42 10.4 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.247 -0.433 . . . . 1.0 110.829 -178.668 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 24.4 p -163.63 162.8 24.43 Favored 'General case' 0 CA--C 1.516 -0.351 0 CA-C-O 121.171 0.51 . . . . 1.0 110.644 178.994 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -157.55 148.9 21.7 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.604 -0.726 . . . . 1.0 110.327 -178.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.611 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 2.1 ptm180 -128.23 150.38 50.06 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 109.761 -0.459 . . . . 1.0 109.761 179.609 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.724 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -101.43 124.14 46.63 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 108.088 -1.079 . . . . 1.0 108.088 178.191 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.724 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.0 mt -85.65 115.75 62.83 Favored Pre-proline 0 CA--C 1.544 0.725 0 N-CA-C 109.796 -0.446 . . . . 1.0 109.796 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 48.2 Cg_exo -53.31 152.61 19.33 Favored 'Trans proline' 0 N--CA 1.501 1.969 0 C-N-CA 122.34 2.027 . . . . 1.0 113.021 179.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -71.83 -179.44 2.68 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.479 -0.782 . . . . 1.0 110.464 179.415 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.2 t -165.09 140.6 5.36 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.342 -0.39 . . . . 1.0 110.972 -180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -85.66 -70.77 1.32 Allowed Glycine 0 CA--C 1.522 0.476 0 N-CA-C 110.146 -1.181 . . . . 1.0 110.146 179.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.7 m -89.3 153.45 20.88 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 109.583 -0.525 . . . . 1.0 109.583 178.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.611 ' NE2' HD11 ' A' ' 171' ' ' ILE . 15.5 m80 -132.3 120.12 21.68 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 116.486 -0.325 . . . . 1.0 110.914 -179.599 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.9 ttp180 -145.45 135.3 23.56 Favored 'General case' 0 C--N 1.33 -0.257 0 C-N-CA 120.838 -0.345 . . . . 1.0 110.178 178.184 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.492 HD12 HG22 ' A' ' 126' ' ' VAL . 18.0 tt -148.27 144.86 18.8 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 C-N-CA 121.047 -0.261 . . . . 1.0 110.582 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 86.5 mtm180 -124.42 99.92 6.43 Favored 'General case' 0 N--CA 1.47 0.532 0 O-C-N 123.563 0.54 . . . . 1.0 111.471 179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.1 mp -81.15 152.36 27.8 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.638 179.636 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 22.0 m-85 -129.57 137.84 50.96 Favored 'General case' 0 C--O 1.241 0.615 0 CA-C-N 115.448 -0.796 . . . . 1.0 111.79 -179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.596 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -54.8 -56.85 14.87 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.362 -0.835 . . . . 1.0 110.978 179.208 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.596 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 78.0 mtp180 -105.57 173.87 6.12 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 110.107 -0.331 . . . . 1.0 110.107 -178.35 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.617 ' O ' ' O ' ' A' ' 97' ' ' ASP . 96.1 mt-10 -58.27 159.14 6.34 Favored 'General case' 0 CA--C 1.511 -0.537 0 CA-C-N 115.829 -0.623 . . . . 1.0 110.163 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.788 ' O ' ' N ' ' A' ' 99' ' ' ARG . 6.6 m-20 53.05 127.18 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.722 0 O-C-N 124.512 1.133 . . . . 1.0 108.484 -178.944 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.49 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 1.6 p90 -43.22 70.14 0.0 OUTLIER 'General case' 0 C--N 1.324 -0.539 0 O-C-N 123.477 0.486 . . . . 1.0 111.473 -177.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.788 ' N ' ' O ' ' A' ' 97' ' ' ASP . 5.6 tpt180 -121.32 -156.14 0.67 Allowed 'General case' 0 CA--C 1.519 -0.245 0 N-CA-C 109.99 -0.374 . . . . 1.0 109.99 -178.277 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.424 ' C ' ' O ' ' A' ' 99' ' ' ARG . . . 33.27 -152.54 0.01 OUTLIER Glycine 0 CA--C 1.521 0.445 0 N-CA-C 111.018 -0.833 . . . . 1.0 111.018 -179.481 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.501 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 56.5 tp60 -68.62 145.48 53.89 Favored 'General case' 0 C--N 1.317 -0.806 0 CA-C-O 121.461 0.648 . . . . 1.0 111.26 -179.384 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.491 ' O ' ' SD ' ' A' ' 102' ' ' MET . 4.4 ppp? -130.95 151.0 51.84 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.92 -0.582 . . . . 1.0 111.187 179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.429 HG21 ' CD1' ' A' ' 116' ' ' PHE . 9.4 tt -145.15 139.16 22.26 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.532 0 N-CA-C 109.419 -0.586 . . . . 1.0 109.419 178.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -112.38 143.72 43.02 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.381 0.61 . . . . 1.0 110.578 -179.601 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.49 ' CD1' ' SG ' ' A' ' 109' ' ' CYS . 88.6 m-85 -129.18 154.81 46.39 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 114.514 -1.221 . . . . 1.0 110.522 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.0 p -143.79 9.61 1.55 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.329 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.934 ' O ' ' O ' ' A' ' 108' ' ' ASP . 8.1 pt-20 -160.25 78.33 0.65 Allowed 'General case' 0 C--O 1.217 -0.651 0 CA-C-O 118.851 -0.595 . . . . 1.0 109.424 179.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.934 ' O ' ' O ' ' A' ' 107' ' ' GLU . 12.9 p-10 22.44 167.7 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.744 0 CA-C-O 122.491 1.139 . . . . 1.0 113.278 178.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.49 ' SG ' ' CD1' ' A' ' 105' ' ' PHE . 9.8 m -146.95 106.42 3.92 Favored 'General case' 0 C--N 1.317 -0.842 0 O-C-N 120.342 -1.474 . . . . 1.0 109.548 179.955 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.422 ' O ' ' OG ' ' A' ' 166' ' ' SER . 80.9 p -67.46 -22.53 65.49 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 120.395 -0.522 . . . . 1.0 110.675 -178.926 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 72.0 m -143.96 95.57 2.75 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.246 0.546 . . . . 1.0 110.554 -179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.513 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.1 tp -63.62 -44.54 93.63 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.416 -0.811 . . . . 1.0 110.373 -179.58 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.434 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 98.0 mm-40 -47.2 -9.15 0.02 OUTLIER 'General case' 0 N--CA 1.463 0.192 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.245 -179.818 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.513 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.1 m-20 -96.8 -24.99 15.65 Favored 'General case' 0 N--CA 1.463 0.204 0 CA-C-O 120.988 0.423 . . . . 1.0 110.381 -179.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.433 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.0 mmt-85 -109.41 -36.69 5.93 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.849 -0.614 . . . . 1.0 111.682 -178.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.5 ' HB2' HD11 ' A' ' 112' ' ' LEU . 3.7 t80 -125.53 120.67 31.53 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-O 121.146 0.498 . . . . 1.0 109.902 178.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.3 mtt180 -60.36 -60.06 4.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.488 -0.778 . . . . 1.0 110.942 -178.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -40.39 137.84 1.01 Allowed 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.803 -0.443 . . . . 1.0 109.803 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.434 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 62.9 m-20 -101.94 2.38 37.87 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.097 -178.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -135.13 137.88 43.21 Favored 'General case' 0 C--N 1.333 -0.136 0 CA-C-O 121.227 0.537 . . . . 1.0 110.555 -178.538 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.555 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.0 mm -120.99 122.2 67.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.025 178.139 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -112.31 21.85 15.33 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 115.413 -0.812 . . . . 1.0 111.046 -178.997 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.499 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.8 p 169.29 153.51 0.04 OUTLIER 'General case' 0 N--CA 1.466 0.333 0 CA-C-O 121.064 0.459 . . . . 1.0 109.937 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.428 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.7 pp -165.33 158.31 16.08 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.523 -0.762 . . . . 1.0 110.079 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.09 119.08 27.62 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 116.397 -0.365 . . . . 1.0 110.361 -179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.492 HG22 HD12 ' A' ' 90' ' ' ILE . 29.6 t -102.95 104.92 17.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.317 0 CA-C-N 115.925 -0.58 . . . . 1.0 109.785 179.08 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.899 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.82 -41.14 30.96 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.516 -0.766 . . . . 1.0 111.315 -179.884 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 43.1 tp10 -140.59 147.11 38.91 Favored 'General case' 0 CA--C 1.517 -0.296 0 C-N-CA 120.511 -0.476 . . . . 1.0 110.745 -178.761 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 60.51 -175.46 4.56 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 111.079 -0.809 . . . . 1.0 111.079 179.746 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 2.1 m -117.91 153.15 34.06 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 109.406 -0.59 . . . . 1.0 109.406 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 52.5 m95 -126.42 159.39 33.43 Favored 'General case' 0 CA--C 1.514 -0.434 0 CA-C-N 115.562 -0.744 . . . . 1.0 110.73 -178.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.413 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 41.4 t -130.67 136.44 58.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.36 0 N-CA-C 109.28 -0.637 . . . . 1.0 109.28 178.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.543 ' HG ' HD11 ' A' ' 146' ' ' LEU . 37.3 mt -107.82 141.42 39.42 Favored 'General case' 0 CA--C 1.512 -0.509 0 N-CA-C 110.219 -0.289 . . . . 1.0 110.219 179.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.8 m-85 -117.58 134.35 54.97 Favored 'General case' 0 N--CA 1.465 0.317 0 O-C-N 123.268 0.355 . . . . 1.0 110.969 179.074 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 53.3 tp10 -45.74 -50.75 13.52 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.57 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -123.72 166.06 16.19 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.288 0.566 . . . . 1.0 110.279 -179.788 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 58.1 m -68.6 177.04 2.62 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-N 115.101 -0.954 . . . . 1.0 110.936 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 12.2 m120 58.76 22.16 9.75 Favored 'General case' 0 C--N 1.32 -0.679 0 CA-C-N 114.356 -1.293 . . . . 1.0 110.057 -178.465 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 12.8 m-85 36.36 76.94 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.442 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.435 179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 62.7 mtp180 -146.41 41.2 1.14 Allowed 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.252 0.548 . . . . 1.0 110.166 179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.52 -146.64 4.38 Favored Glycine 0 N--CA 1.462 0.386 0 N-CA-C 111.618 -0.593 . . . . 1.0 111.618 -179.546 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 85.1 mtt85 -69.94 168.39 15.42 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 179.612 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.86 135.16 21.76 Favored 'General case' 0 C--N 1.328 -0.333 0 O-C-N 123.851 0.719 . . . . 1.0 110.89 -179.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . 0.413 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 7.1 m-85 -127.25 137.92 52.98 Favored 'General case' 0 C--O 1.216 -0.664 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 178.398 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.604 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.7 OUTLIER -91.5 126.23 36.51 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.937 0.399 . . . . 1.0 110.565 -178.888 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.604 ' N ' HD23 ' A' ' 145' ' ' LEU . 24.0 mt -114.93 102.73 10.24 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.522 179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.611 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -81.62 161.92 59.88 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 116.374 -0.375 . . . . 1.0 110.708 -178.937 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -54.61 119.15 5.95 Favored 'Trans proline' 0 N--CA 1.494 1.53 0 C-N-CA 121.41 1.406 . . . . 1.0 111.522 178.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.73 -152.42 19.45 Favored Glycine 0 CA--C 1.528 0.845 0 N-CA-C 110.344 -1.102 . . . . 1.0 110.344 -179.842 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.0 m-20 -127.15 136.4 52.04 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-O 120.77 0.319 . . . . 1.0 110.352 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.513 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 27.6 m-85 -126.6 129.01 47.71 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-N 116.172 -0.467 . . . . 1.0 109.766 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 98.9 mtt180 -116.33 -3.1 11.97 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-O 120.882 0.373 . . . . 1.0 110.291 -179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.682 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -156.19 159.16 38.72 Favored 'General case' 0 C--N 1.327 -0.397 0 CA-C-O 121.518 0.675 . . . . 1.0 110.191 179.568 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.474 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.8 p90 -74.68 -20.87 59.69 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 114.562 -1.199 . . . . 1.0 112.286 -177.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.682 ' NE2' HH21 ' A' ' 153' ' ' ARG . 50.1 mt-30 -68.44 -19.48 64.58 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.252 -0.431 . . . . 1.0 111.09 -179.435 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . 0.513 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 54.4 t0 -51.5 -50.13 60.51 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.101 -0.5 . . . . 1.0 110.914 -178.854 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.71 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 14.4 p90 -94.43 21.5 7.08 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-O 121.041 0.448 . . . . 1.0 110.443 -179.913 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.68 75.18 0.23 Allowed Glycine 0 CA--C 1.519 0.343 0 N-CA-C 111.148 -0.781 . . . . 1.0 111.148 179.559 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.71 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.82 147.91 42.59 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 121.124 0.488 . . . . 1.0 110.03 179.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . 0.488 ' O ' ' ND2' ' A' ' 161' ' ' ASN . 15.1 t -76.49 -20.51 56.89 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 115.003 -0.998 . . . . 1.0 109.91 177.904 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.488 ' ND2' ' O ' ' A' ' 160' ' ' THR . 12.1 m120 -162.3 -171.04 2.66 Favored 'General case' 0 C--N 1.321 -0.669 0 C-N-CA 120.5 -0.48 . . . . 1.0 110.497 179.57 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.555 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.82 -10.81 15.1 Favored 'General case' 0 C--O 1.222 -0.355 0 CA-C-N 116.177 -0.465 . . . . 1.0 110.569 179.608 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -47.28 117.03 1.59 Allowed 'General case' 0 CA--C 1.51 -0.572 0 CA-C-O 120.614 0.245 . . . . 1.0 111.266 -178.216 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.522 HG23 ' O ' ' A' ' 162' ' ' ALA . 55.8 t -131.14 124.15 55.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.525 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.76 177.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -100.05 -24.62 9.58 Favored Glycine 0 N--CA 1.466 0.648 0 N-CA-C 111.464 -0.654 . . . . 1.0 111.464 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.422 ' OG ' ' O ' ' A' ' 110' ' ' SER . 6.0 m -159.82 -171.0 3.08 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 110.006 -0.368 . . . . 1.0 110.006 -179.629 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.6 pp -172.54 142.17 1.22 Allowed 'General case' 0 N--CA 1.447 -0.605 0 CA-C-N 116.137 -0.483 . . . . 1.0 110.945 -179.72 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -132.93 162.66 31.04 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.861 -0.422 . . . . 1.0 109.861 179.382 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.496 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -95.49 154.3 17.27 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.542 -0.754 . . . . 1.0 109.63 178.522 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.733 ' C ' HD12 ' A' ' 171' ' ' ILE . 49.4 t -88.25 88.62 2.95 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.255 0 O-C-N 122.105 -0.372 . . . . 1.0 111.944 -178.33 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.733 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.8 mp -137.04 123.15 27.72 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 CA-C-O 121.137 0.494 . . . . 1.0 109.88 179.389 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.524 ' OD1' ' CD2' ' A' ' 173' ' ' PHE . 43.7 p-10 -70.19 -35.04 73.66 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.685 -0.689 . . . . 1.0 110.167 179.039 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.524 ' CD2' ' OD1' ' A' ' 172' ' ' ASP . 96.7 m-85 -64.54 173.41 2.15 Favored 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.18 -0.464 . . . . 1.0 110.602 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 9.3 t . . . . . 0 C--O 1.219 -0.513 0 CA-C-O 118.046 -0.978 . . . . 1.0 110.512 -179.979 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.48 ' O ' ' O ' ' A' ' 2' ' ' GLY . 87.9 mt-30 . . . . . 0 N--CA 1.49 1.575 0 N-CA-C 109.514 -0.55 . . . . 1.0 109.514 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.48 ' O ' ' O ' ' A' ' 1' ' ' GLN . . . 51.59 167.71 0.01 OUTLIER Glycine 0 CA--C 1.522 0.512 0 N-CA-C 110.818 -0.913 . . . . 1.0 110.818 -179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -173.78 98.92 0.11 Allowed 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.829 -0.348 . . . . 1.0 110.571 178.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.02 164.48 16.39 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.356 0 CA-C-O 120.781 0.324 . . . . 1.0 110.487 -179.413 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.501 HG22 ' CE1' ' A' ' 7' ' ' TYR . 32.9 m -124.17 119.94 30.86 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 107.919 -1.141 . . . . 1.0 107.919 177.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.0 mt -104.17 133.88 48.35 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 114.799 -1.091 . . . . 1.0 109.776 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.501 ' CE1' HG22 ' A' ' 5' ' ' THR . 66.4 m-85 -116.12 126.5 53.8 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 115.383 -0.826 . . . . 1.0 111.067 -178.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.532 ' OE1' ' NH2' ' A' ' 15' ' ' ARG . 79.2 tt0 -52.74 -33.63 49.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 115.657 -0.701 . . . . 1.0 110.289 179.577 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 43.6 t0 -113.35 161.29 17.44 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 121.245 0.545 . . . . 1.0 110.655 179.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.415 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 14.6 ptt-85 -65.22 -175.94 0.26 Allowed 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.271 -0.877 . . . . 1.0 110.673 -179.083 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.61 26.29 1.04 Allowed Glycine 0 C--N 1.332 0.355 0 N-CA-C 110.662 -0.975 . . . . 1.0 110.662 178.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.6 m-85 50.53 70.05 0.56 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.346 -0.427 . . . . 1.0 110.102 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 -133.43 -159.78 0.99 Allowed 'General case' 0 N--CA 1.472 0.63 0 CA-C-O 120.914 0.388 . . . . 1.0 110.319 179.222 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.28 -152.1 0.82 Allowed Glycine 0 CA--C 1.526 0.737 0 N-CA-C 110.731 -0.947 . . . . 1.0 110.731 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.532 ' NH2' ' OE1' ' A' ' 8' ' ' GLU . 91.1 mtm-85 -68.83 146.01 53.23 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.673 0.273 . . . . 1.0 110.998 -179.605 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.8 p-80 -136.64 153.79 50.82 Favored 'General case' 0 CA--C 1.522 -0.118 0 CA-C-O 121.223 0.535 . . . . 1.0 110.688 -179.769 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.453 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 8.2 t80 -147.4 141.78 26.34 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.253 -0.885 . . . . 1.0 110.086 -179.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.453 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.2 tt0 -110.21 124.72 52.1 Favored 'General case' 0 N--CA 1.465 0.301 0 CA-C-N 116.112 -0.494 . . . . 1.0 110.571 -179.517 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -114.42 126.53 55.08 Favored 'General case' 0 N--CA 1.473 0.71 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.337 -179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.1 t -117.28 9.89 13.56 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-N 115.877 -0.601 . . . . 1.0 110.189 179.546 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.3 m -154.4 166.37 33.46 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 115.892 -0.594 . . . . 1.0 110.563 -179.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 38.2 m-20 -59.25 138.67 57.52 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 115.5 -0.773 . . . . 1.0 111.576 -179.312 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.28 142.21 48.38 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.412 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.515 ' O ' ' OG ' ' A' ' 78' ' ' SER . 21.0 p -109.82 -10.07 14.78 Favored 'General case' 0 CA--C 1.513 -0.479 0 CA-C-N 115.66 -0.7 . . . . 1.0 112.274 -178.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -156.88 114.4 3.16 Favored 'General case' 0 C--N 1.322 -0.592 0 CA-C-O 121.291 0.567 . . . . 1.0 110.09 -179.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 17.3 mt -116.93 1.26 12.63 Favored 'General case' 0 N--CA 1.467 0.376 0 CA-C-N 115.512 -0.767 . . . . 1.0 110.75 -179.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.6 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 4.4 mt-30 -52.93 -43.24 93.7 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.31 -179.092 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.6 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 37.6 Cg_exo -58.62 -33.51 98.23 Favored 'Trans proline' 0 C--N 1.306 -1.676 0 C-N-CA 122.063 1.842 . . . . 1.0 111.616 179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -95.5 -53.1 3.87 Favored 'General case' 0 N--CA 1.465 0.311 0 C-N-CA 120.734 -0.386 . . . . 1.0 110.754 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.8 mt -116.81 127.61 54.48 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 116.245 -0.434 . . . . 1.0 110.804 -179.22 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.8 t -94.74 -7.12 41.47 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.862 -0.608 . . . . 1.0 112.148 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.419 ' CD ' HD21 ' A' ' 34' ' ' ASN . 35.8 ttm180 -151.83 -55.29 0.14 Allowed 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 112.229 0.455 . . . . 1.0 112.229 -177.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.9 t 62.34 80.03 0.24 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-O 120.541 0.21 . . . . 1.0 110.975 -178.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.419 HD21 ' CD ' ' A' ' 32' ' ' ARG . 94.7 m-20 -94.64 3.44 55.07 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 116.733 -0.212 . . . . 1.0 111.551 -179.573 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 13.9 p -157.33 159.09 37.14 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.839 -0.345 . . . . 1.0 110.419 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -155.15 155.24 33.61 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.182 -0.463 . . . . 1.0 111.512 -178.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.452 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 26.4 mtp85 -134.89 124.48 25.08 Favored 'General case' 0 C--O 1.211 -0.96 0 N-CA-C 108.801 -0.815 . . . . 1.0 108.801 178.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 98.1 t -108.92 134.48 50.76 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.06 -0.719 . . . . 1.0 109.06 179.255 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -95.25 -43.39 8.09 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.99 -0.55 . . . . 1.0 110.241 179.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.7 p -159.58 156.52 28.16 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 108.735 -0.839 . . . . 1.0 108.735 179.554 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.46 174.18 50.21 Favored Glycine 0 C--N 1.316 -0.547 0 N-CA-C 110.959 -0.856 . . . . 1.0 110.959 179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 83.6 m -111.74 142.55 43.94 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 109.415 -0.587 . . . . 1.0 109.415 178.606 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.449 ' CE2' HD13 ' A' ' 81' ' ' LEU . 54.6 m95 -131.06 150.47 52.13 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 121.45 0.643 . . . . 1.0 111.254 -179.401 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.598 ' C ' HD23 ' A' ' 45' ' ' LEU . 37.6 ttm -128.47 133.26 48.45 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.964 -1.016 . . . . 1.0 108.908 178.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.598 HD23 ' C ' ' A' ' 44' ' ' MET . 0.4 OUTLIER -109.92 137.6 47.47 Favored 'General case' 0 N--CA 1.465 0.318 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 -179.405 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.418 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 40.9 m-85 -110.95 132.01 54.57 Favored 'General case' 0 C--O 1.24 0.577 0 CA-C-O 121.628 0.728 . . . . 1.0 110.277 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.609 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.0 pt-20 -59.36 -35.09 73.25 Favored 'General case' 0 N--CA 1.445 -0.715 0 CA-C-N 115.184 -0.916 . . . . 1.0 110.962 -178.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.422 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.7 mt-30 -110.44 152.43 43.31 Favored Pre-proline 0 CA--C 1.53 0.186 0 CA-C-N 116.157 -0.474 . . . . 1.0 110.602 -178.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.425 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 40.0 Cg_endo -63.05 157.09 50.91 Favored 'Trans proline' 0 N--CA 1.492 1.44 0 C-N-CA 122.592 2.195 . . . . 1.0 113.133 178.806 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.658 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.8 OUTLIER 64.33 35.95 9.48 Favored 'General case' 0 N--CA 1.463 0.181 0 CA-C-N 115.3 -0.864 . . . . 1.0 111.268 179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.418 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.5 m-85 51.89 76.28 0.18 Allowed 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.01 -0.996 . . . . 1.0 111.119 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.5 m -144.98 154.87 43.0 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 121.015 0.436 . . . . 1.0 109.976 -178.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.88 -149.79 22.56 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.97 -0.633 . . . . 1.0 112.143 179.59 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.609 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.3 tp -75.24 142.74 43.34 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.023 -0.589 . . . . 1.0 110.266 -179.629 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.498 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 2.9 pt20 -121.1 151.92 39.3 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.3 m-85 -128.77 125.89 38.79 Favored 'General case' 0 N--CA 1.468 0.449 0 CA-C-N 116.294 -0.412 . . . . 1.0 110.881 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.41 ' C ' HD12 ' A' ' 58' ' ' LEU . 58.2 t80 -84.52 122.69 29.37 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 120.986 0.422 . . . . 1.0 110.471 -179.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.41 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.6 mp -117.25 146.1 43.51 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-O 121.329 0.585 . . . . 1.0 110.06 179.402 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.403 ' O ' ' C ' ' A' ' 60' ' ' ARG . 40.1 mtp180 -131.76 160.82 34.43 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.374 -0.83 . . . . 1.0 109.896 178.993 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.403 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.5 ttt180 -37.25 125.51 0.99 Allowed 'General case' 0 C--N 1.333 -0.124 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.769 -179.211 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.7 -178.42 33.14 Favored Glycine 0 CA--C 1.526 0.729 0 N-CA-C 110.508 -1.037 . . . . 1.0 110.508 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.452 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 70.9 m-20 -117.77 124.63 48.9 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-O 120.902 0.382 . . . . 1.0 110.533 -179.686 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.1 m-85 -117.26 113.27 21.93 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 109.196 -0.668 . . . . 1.0 109.196 179.433 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.413 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.91 -2.89 55.43 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 116.174 -0.466 . . . . 1.0 111.707 -179.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.413 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.4 m-20 -147.98 139.23 23.48 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.576 -0.898 . . . . 1.0 108.576 179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.47 ' CD2' HE21 ' A' ' 67' ' ' GLN . 12.2 p-80 -59.24 -43.52 92.39 Favored 'General case' 0 C--N 1.329 -0.311 0 C-N-CA 120.599 -0.44 . . . . 1.0 111.029 -179.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.472 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 98.7 mm-40 -50.77 -9.46 0.05 Allowed 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 115.86 -0.609 . . . . 1.0 111.12 179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.453 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.1 mm-40 -82.36 -35.57 27.66 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.265 -0.574 . . . . 1.0 111.15 -178.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.455 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -90.53 17.79 7.02 Favored 'General case' 0 CA--C 1.507 -0.673 0 C-N-CA 120.477 -0.489 . . . . 1.0 110.715 179.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.534 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 37.6 mtt 80.37 16.47 0.69 Allowed 'General case' 0 CA--C 1.521 -0.152 0 O-C-N 124.013 0.82 . . . . 1.0 109.94 -178.568 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.472 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . -61.0 100.88 0.26 Allowed Glycine 0 C--N 1.337 0.624 0 N-CA-C 110.576 -1.009 . . . . 1.0 110.576 178.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 47.5 mt -78.7 -29.36 45.4 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 109.69 -0.485 . . . . 1.0 109.69 177.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 75' ' ' SER . 96.1 p -131.83 121.68 24.5 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 109.964 -0.384 . . . . 1.0 109.964 178.595 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 53.2 p-10 -72.04 35.84 0.06 Allowed 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.867 -179.245 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.495 ' H ' ' C ' ' A' ' 73' ' ' SER . 7.2 p -111.67 72.67 0.79 Allowed 'General case' 0 C--O 1.217 -0.649 0 CA-C-N 116.14 -0.482 . . . . 1.0 110.304 -179.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.0 t -99.77 117.93 45.65 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.79 0 N-CA-C 109.301 -0.629 . . . . 1.0 109.301 179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.425 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.7 mtm-85 -124.34 5.09 8.41 Favored 'General case' 0 CA--C 1.519 -0.234 0 CA-C-N 116.372 -0.376 . . . . 1.0 111.628 -178.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.515 ' OG ' ' O ' ' A' ' 24' ' ' THR . 30.7 m -165.06 162.23 20.21 Favored 'General case' 0 CA--C 1.512 -0.506 0 CA-C-O 121.238 0.542 . . . . 1.0 111.202 179.01 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.1 p -154.42 146.72 23.86 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 115.451 -0.795 . . . . 1.0 110.285 -178.105 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.439 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 4.5 ptm180 -128.42 150.58 50.06 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.415 -0.357 . . . . 1.0 110.192 -179.912 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.449 HD13 ' CE2' ' A' ' 43' ' ' TRP . 20.7 tp -99.58 134.57 42.28 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 108.046 -1.094 . . . . 1.0 108.046 177.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.445 ' H ' HD12 ' A' ' 81' ' ' LEU . 6.4 mt -94.82 131.33 30.7 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.737 -0.468 . . . . 1.0 109.737 -179.299 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 56.2 Cg_endo -68.63 146.74 68.22 Favored 'Trans proline' 0 N--CA 1.498 1.759 0 C-N-CA 122.159 1.906 . . . . 1.0 113.158 -178.715 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 19.7 p80 -74.61 -179.66 4.22 Favored 'General case' 0 C--N 1.332 -0.172 0 CA-C-N 115.37 -0.832 . . . . 1.0 110.487 179.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 40.5 t -172.11 152.63 2.91 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.299 -0.409 . . . . 1.0 111.489 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -90.46 -68.22 1.2 Allowed Glycine 0 CA--C 1.525 0.71 0 N-CA-C 110.512 -1.035 . . . . 1.0 110.512 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m -89.73 153.61 20.57 Favored 'General case' 0 C--N 1.332 -0.177 0 N-CA-C 109.869 -0.419 . . . . 1.0 109.869 179.087 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.591 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 8.2 m80 -134.09 119.79 19.36 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-N 116.52 -0.309 . . . . 1.0 111.013 -179.421 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 59.8 mtt180 -142.24 134.01 27.0 Favored 'General case' 0 N--CA 1.465 0.284 0 C-N-CA 120.617 -0.433 . . . . 1.0 110.398 178.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.482 HD12 HG22 ' A' ' 126' ' ' VAL . 18.5 tt -145.52 140.5 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.327 0 CA-C-O 120.83 0.347 . . . . 1.0 110.769 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.546 ' NH2' ' SD ' ' A' ' 102' ' ' MET . 77.0 mtp85 -120.14 98.03 5.88 Favored 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.164 -179.277 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -79.17 140.89 37.63 Favored 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.126 0.489 . . . . 1.0 110.998 179.346 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 78.8 m-85 -118.21 134.9 54.61 Favored 'General case' 0 C--O 1.24 0.572 0 CA-C-N 115.359 -0.837 . . . . 1.0 111.141 -179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.1 OUTLIER -55.18 -59.18 5.13 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.688 179.378 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.48 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.3 mtt85 -98.68 162.93 12.86 Favored 'General case' 0 N--CA 1.464 0.246 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.44 -178.835 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.8 mt-10 -44.4 156.07 0.08 Allowed 'General case' 0 CA--C 1.519 -0.24 0 CA-C-O 121.677 0.751 . . . . 1.0 111.017 178.075 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.577 ' O ' ' CD1' ' A' ' 98' ' ' TYR . 16.5 m-20 61.11 -108.24 0.33 Allowed 'General case' 0 C--N 1.326 -0.438 0 CA-C-N 114.525 -1.216 . . . . 1.0 110.371 -178.967 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.577 ' CD1' ' O ' ' A' ' 97' ' ' ASP . 1.2 m-85 -149.51 40.33 0.84 Allowed 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.599 -0.44 . . . . 1.0 110.392 -179.317 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.4 mpt_? -102.5 153.31 20.18 Favored 'General case' 0 N--CA 1.462 0.152 0 N-CA-C 109.309 -0.626 . . . . 1.0 109.309 179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 84.55 -168.53 44.06 Favored Glycine 0 CA--C 1.521 0.413 0 N-CA-C 110.835 -0.906 . . . . 1.0 110.835 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.417 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 9.4 tp-100 -65.7 143.85 57.29 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.856 0.36 . . . . 1.0 110.926 -179.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.546 ' SD ' ' NH2' ' A' ' 91' ' ' ARG . 2.1 ptm -129.82 152.06 49.72 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.683 -0.689 . . . . 1.0 110.673 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.9 tt -144.38 140.81 24.32 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.504 -0.554 . . . . 1.0 109.504 178.662 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . 0.503 ' OE1' ' NH1' ' A' ' 91' ' ' ARG . 80.6 tt0 -115.04 146.81 40.89 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 121.637 0.732 . . . . 1.0 111.398 -178.83 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.471 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 83.4 m-85 -132.17 155.58 47.94 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 114.647 -1.16 . . . . 1.0 110.737 -179.808 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 36.8 p -144.04 15.84 1.72 Allowed 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.526 -0.761 . . . . 1.0 110.314 179.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.488 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.2 pm0 -151.54 -172.97 4.37 Favored 'General case' 0 N--CA 1.464 0.274 0 C-N-CA 120.602 -0.439 . . . . 1.0 110.286 178.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 66.4 t0 -74.76 140.17 43.87 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-O 120.771 0.319 . . . . 1.0 110.865 179.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.518 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.9 m -133.71 91.38 2.83 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 116.217 -0.447 . . . . 1.0 110.56 179.305 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -64.68 -27.28 68.81 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.37 -0.377 . . . . 1.0 111.082 -179.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.4 t -137.79 95.66 3.09 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-O 121.285 0.564 . . . . 1.0 110.429 -179.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.476 ' O ' ' N ' ' A' ' 115' ' ' ARG . 0.4 OUTLIER -60.62 -41.24 94.44 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 115.156 -0.929 . . . . 1.0 110.423 -179.052 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.602 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 10.8 mp0 -47.83 -13.37 0.04 OUTLIER 'General case' 0 N--CA 1.469 0.478 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.895 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.4 ' N ' ' C ' ' A' ' 112' ' ' LEU . 82.3 m-20 -91.46 1.41 57.15 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 121.767 0.794 . . . . 1.0 109.714 -179.915 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.476 ' N ' ' O ' ' A' ' 112' ' ' LEU . 85.1 mmt-85 -131.02 -40.11 1.18 Allowed 'General case' 0 C--N 1.321 -0.663 0 CA-C-N 114.09 -1.413 . . . . 1.0 113.613 -177.757 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.654 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.61 137.29 54.39 Favored 'General case' 0 N--CA 1.474 0.76 0 CA-C-O 122.29 1.043 . . . . 1.0 111.471 -179.088 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.405 ' O ' ' C ' ' A' ' 118' ' ' PHE . 29.4 mmt180 -69.83 -69.19 0.36 Allowed 'General case' 0 C--N 1.32 -0.687 0 O-C-N 121.47 -0.768 . . . . 1.0 111.137 -177.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.601 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 81.3 m-85 -37.86 145.73 0.07 Allowed 'General case' 0 C--O 1.221 -0.407 0 CA-C-N 116.281 -0.418 . . . . 1.0 110.313 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.426 ' ND2' ' H ' ' A' ' 119' ' ' ASN . 2.6 p30 -104.21 9.18 36.22 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.77 0.319 . . . . 1.0 111.028 -178.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.3 mt-10 -138.49 140.22 39.11 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-O 121.147 0.498 . . . . 1.0 111.204 -179.081 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.734 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.8 mm -120.96 124.04 71.43 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.539 0 CA-C-N 115.33 -0.85 . . . . 1.0 109.25 178.067 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 25.0 m-70 -112.8 21.26 15.7 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-N 116.191 -0.459 . . . . 1.0 111.733 -178.556 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.48 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.5 p 169.77 153.7 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.067 0.461 . . . . 1.0 109.959 179.771 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.45 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.5 pp -164.2 158.21 18.8 Favored 'General case' 0 C--N 1.321 -0.643 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.568 -178.29 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.25 115.11 19.22 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.659 -179.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.482 HG22 HD12 ' A' ' 90' ' ' ILE . 21.5 t -98.72 104.84 16.48 Favored 'Isoleucine or valine' 0 C--O 1.232 0.162 0 N-CA-C 109.458 -0.571 . . . . 1.0 109.458 178.809 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.865 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -77.86 -39.59 42.88 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 1.0 111.262 179.879 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 40.8 tp10 -146.65 148.83 32.46 Favored 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.848 -178.036 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 66.47 175.13 6.35 Favored Glycine 0 N--CA 1.45 -0.414 0 N-CA-C 110.772 -0.931 . . . . 1.0 110.772 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 3.4 m -116.83 150.54 38.21 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.058 -0.719 . . . . 1.0 109.058 179.428 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.416 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 43.8 m95 -124.09 167.38 14.3 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.638 -178.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 39.9 t -138.42 105.63 3.1 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 CA-C-N 116.558 -0.292 . . . . 1.0 110.331 178.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 13.3 mt -78.62 142.78 36.97 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 116.143 -0.48 . . . . 1.0 111.068 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -121.55 136.69 54.93 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 116.286 -0.415 . . . . 1.0 110.711 179.12 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -47.88 -46.8 31.89 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 116.519 -0.309 . . . . 1.0 110.412 179.861 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -127.8 165.27 20.45 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 121.421 0.629 . . . . 1.0 110.343 -179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 55.6 m -69.92 -179.11 1.74 Allowed 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.96 -1.018 . . . . 1.0 111.283 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . 0.45 ' CB ' HH21 ' A' ' 140' ' ' ARG . 15.4 m120 55.92 19.6 3.69 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 114.555 -1.202 . . . . 1.0 109.466 -178.86 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.569 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 17.4 m-85 37.67 77.22 0.05 OUTLIER 'General case' 0 N--CA 1.464 0.262 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.593 -179.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.45 HH21 ' CB ' ' A' ' 138' ' ' ASN . 76.9 mtm180 -145.22 41.98 1.28 Allowed 'General case' 0 N--CA 1.472 0.628 0 CA-C-O 121.029 0.442 . . . . 1.0 110.637 179.198 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -154.5 -145.78 4.25 Favored Glycine 0 CA--C 1.523 0.538 0 N-CA-C 111.397 -0.681 . . . . 1.0 111.397 -179.736 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 91.4 mtt-85 -71.28 164.31 25.95 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 109.835 -0.432 . . . . 1.0 109.835 179.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.534 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -142.43 137.47 30.38 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.003 -0.544 . . . . 1.0 110.395 -179.873 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 18.5 m-85 -129.9 139.74 51.08 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 109.086 -0.709 . . . . 1.0 109.086 178.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.53 ' C ' HD22 ' A' ' 146' ' ' LEU . 43.1 tp -93.18 125.76 37.94 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-O 121.494 0.664 . . . . 1.0 111.959 -179.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.814 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.4 mm? -112.42 98.39 7.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.751 -1.113 . . . . 1.0 108.758 178.9 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.516 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -75.8 164.18 62.19 Favored Pre-proline 0 C--N 1.332 -0.177 0 N-CA-C 109.9 -0.407 . . . . 1.0 109.9 -179.203 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_exo -58.68 118.62 5.53 Favored 'Trans proline' 0 C--N 1.316 -1.176 0 C-N-CA 120.665 0.91 . . . . 1.0 110.445 178.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 171.7 -155.58 24.28 Favored Glycine 0 CA--C 1.527 0.83 0 N-CA-C 110.59 -1.004 . . . . 1.0 110.59 -179.435 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -125.56 135.07 51.84 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.805 0.336 . . . . 1.0 110.766 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.487 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.8 m-85 -125.26 130.56 52.3 Favored 'General case' 0 N--CA 1.466 0.329 0 CA-C-N 116.161 -0.472 . . . . 1.0 109.849 179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 91.0 mtt180 -115.81 -2.74 12.31 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-O 120.828 0.347 . . . . 1.0 110.087 -179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -156.78 159.91 38.73 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.579 0.704 . . . . 1.0 110.088 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.407 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 7.7 p90 -73.68 -19.85 60.71 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 114.639 -1.164 . . . . 1.0 112.201 -178.12 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 40.5 mt-30 -70.32 -19.6 63.06 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.368 -0.378 . . . . 1.0 111.402 -179.611 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -51.33 -47.82 62.59 Favored 'General case' 0 C--N 1.319 -0.748 0 CA-C-N 116.2 -0.455 . . . . 1.0 110.944 -179.156 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.644 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 27.2 p90 -95.82 22.67 7.05 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 120.954 0.406 . . . . 1.0 110.654 179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.56 74.4 0.29 Allowed Glycine 0 CA--C 1.52 0.384 0 N-CA-C 111.248 -0.741 . . . . 1.0 111.248 179.42 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.644 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.06 148.31 43.17 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-O 121.525 0.678 . . . . 1.0 111.018 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . 0.496 ' O ' ' ND2' ' A' ' 161' ' ' ASN . 0.0 OUTLIER -75.77 -25.67 56.66 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 114.277 -1.329 . . . . 1.0 109.874 177.7 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.496 ' ND2' ' O ' ' A' ' 160' ' ' THR . 13.8 m120 -158.15 -171.19 3.4 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 121.042 0.449 . . . . 1.0 110.508 179.703 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.734 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -107.59 -18.17 13.91 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 115.991 -0.549 . . . . 1.0 110.693 -179.896 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 84.8 mtt85 -37.71 118.88 0.7 Allowed 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 120.85 0.357 . . . . 1.0 111.866 -178.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.683 HG23 ' O ' ' A' ' 162' ' ' ALA . 18.9 t -122.36 159.38 25.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 CA-C-N 115.858 -0.61 . . . . 1.0 109.65 178.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.484 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -136.72 -34.88 0.21 Allowed Glycine 0 N--CA 1.462 0.4 0 N-CA-C 111.207 -0.757 . . . . 1.0 111.207 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.4 p -158.11 -174.06 4.64 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.847 0.356 . . . . 1.0 110.109 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -169.53 137.56 1.81 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.143 -179.518 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.569 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 12.4 ptp180 -133.17 154.45 50.61 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 109.987 -0.375 . . . . 1.0 109.987 179.638 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.605 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -84.84 152.35 23.67 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.962 -0.563 . . . . 1.0 109.653 178.428 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.829 ' C ' HD12 ' A' ' 171' ' ' ILE . 47.3 t -88.01 83.13 2.16 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 CA-C-N 116.262 -0.426 . . . . 1.0 111.559 -179.238 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.829 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.0 mp -138.62 120.79 17.74 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.303 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.336 179.014 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -67.35 -39.58 85.74 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.684 -0.689 . . . . 1.0 110.48 179.344 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 94.0 m-85 -70.05 -91.24 0.01 OUTLIER 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.106 -0.497 . . . . 1.0 110.655 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 C--O 1.22 -0.476 0 CA-C-O 118.067 -0.968 . . . . 1.0 110.465 -179.974 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 58.4 tt0 . . . . . 0 N--CA 1.49 1.53 0 N-CA-C 109.37 -0.604 . . . . 1.0 109.37 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.525 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -173.64 179.2 45.17 Favored Glycine 0 CA--C 1.525 0.692 0 N-CA-C 110.602 -0.999 . . . . 1.0 110.602 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -169.67 138.63 1.89 Allowed 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 110.29 -0.263 . . . . 1.0 110.29 179.766 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.433 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -147.03 168.77 4.96 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.185 0 CA-C-N 116.337 -0.392 . . . . 1.0 110.786 179.474 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.1 m -128.39 120.67 27.41 Favored 'General case' 0 C--N 1.331 -0.213 0 N-CA-C 108.325 -0.991 . . . . 1.0 108.325 175.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 36.1 mt -104.25 132.77 50.15 Favored 'General case' 0 N--CA 1.463 0.222 0 CA-C-N 115.09 -0.959 . . . . 1.0 110.318 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.49 ' CE1' HG22 ' A' ' 5' ' ' THR . 60.7 m-85 -115.35 125.9 53.77 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.331 -0.849 . . . . 1.0 110.883 -178.669 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.4 tt0 -53.96 -27.37 30.84 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 115.613 -0.721 . . . . 1.0 110.633 179.906 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 90.2 m-20 -119.48 154.57 33.58 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-O 121.119 0.485 . . . . 1.0 110.142 179.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.424 ' O ' ' N ' ' A' ' 12' ' ' PHE . 32.4 ptt85 -59.39 -172.34 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.515 -0.766 . . . . 1.0 110.266 -179.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.65 25.49 0.2 Allowed Glycine 0 N--CA 1.461 0.304 0 N-CA-C 111.008 -0.837 . . . . 1.0 111.008 178.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.553 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 7.8 m-85 51.69 69.01 0.71 Allowed 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 110.062 -0.348 . . . . 1.0 110.062 -179.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -131.17 -158.83 0.92 Allowed 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 121.008 0.432 . . . . 1.0 110.635 179.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.57 -151.96 0.43 Allowed Glycine 0 CA--C 1.525 0.689 0 N-CA-C 110.875 -0.89 . . . . 1.0 110.875 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 85.0 mtp180 -68.97 146.81 52.43 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 120.961 -0.296 . . . . 1.0 110.621 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.6 p-80 -136.48 150.29 48.62 Favored 'General case' 0 C--N 1.332 -0.171 0 CA-C-O 121.221 0.534 . . . . 1.0 110.196 -179.79 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -143.78 142.09 30.72 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.396 -0.82 . . . . 1.0 110.089 179.865 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.7 tt0 -110.48 122.18 47.11 Favored 'General case' 0 C--N 1.332 -0.178 0 CA-C-N 115.958 -0.564 . . . . 1.0 110.313 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.22 127.91 55.22 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.456 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 79.4 p -118.66 12.99 13.25 Favored 'General case' 0 N--CA 1.466 0.359 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.407 179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 54.9 m -158.63 172.71 17.78 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.543 -178.825 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 46.8 p-10 -62.3 137.49 58.27 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.572 -0.74 . . . . 1.0 111.279 -179.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.82 149.17 52.29 Favored 'General case' 0 N--CA 1.464 0.236 0 CA-C-N 115.783 -0.644 . . . . 1.0 110.093 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.1 p -119.46 -18.4 8.51 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-N 115.26 -0.882 . . . . 1.0 112.196 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 13.3 t30 -143.54 109.52 5.27 Favored 'General case' 0 C--N 1.321 -0.668 0 CA-C-O 120.994 0.426 . . . . 1.0 110.074 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.406 ' O ' ' N ' ' A' ' 30' ' ' LEU . 19.8 mt -116.17 -5.57 11.88 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.735 -0.666 . . . . 1.0 110.421 -179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.623 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -45.33 -52.45 21.69 Favored Pre-proline 0 C--N 1.331 -0.226 0 CA-C-N 115.889 -0.596 . . . . 1.0 109.92 178.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.623 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.3 Cg_endo -54.19 -30.29 60.54 Favored 'Trans proline' 0 N--CA 1.488 1.151 0 C-N-CA 121.97 1.78 . . . . 1.0 111.767 -179.861 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.529 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 0.6 OUTLIER -96.27 -55.14 3.04 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 120.843 0.354 . . . . 1.0 110.273 -178.832 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.406 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.4 mt -117.4 125.28 50.72 Favored 'General case' 0 CA--C 1.518 -0.283 0 CA-C-N 115.867 -0.606 . . . . 1.0 110.274 -179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.4 t -93.59 -9.77 36.97 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.825 -0.625 . . . . 1.0 111.752 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.476 ' CD ' HD21 ' A' ' 34' ' ' ASN . 43.5 ttm180 -147.32 -63.71 0.28 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 116.349 -0.387 . . . . 1.0 111.737 -178.228 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 51.8 t 71.01 83.61 0.14 Allowed 'General case' 0 C--N 1.329 -0.314 0 O-C-N 123.31 0.381 . . . . 1.0 110.06 -178.659 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.476 HD21 ' CD ' ' A' ' 32' ' ' ARG . 92.1 m-20 -97.29 5.74 49.47 Favored 'General case' 0 C--O 1.22 -0.451 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.945 -179.33 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.553 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 2.0 t -160.32 158.05 29.07 Favored 'General case' 0 C--N 1.322 -0.605 0 C-N-CA 120.67 -0.412 . . . . 1.0 109.978 -179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.99 155.37 34.08 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.144 -0.48 . . . . 1.0 111.048 -179.12 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.433 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.6 mtp85 -133.54 121.66 22.44 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 108.506 -0.924 . . . . 1.0 108.506 179.007 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.1 t -107.51 117.78 53.9 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-O 121.397 0.618 . . . . 1.0 110.362 179.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -77.24 -43.64 32.77 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 114.91 -1.041 . . . . 1.0 110.508 179.164 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 48.4 t -163.38 162.89 25.16 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 -179.53 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.31 176.33 48.58 Favored Glycine 0 C--N 1.317 -0.508 0 N-CA-C 110.982 -0.847 . . . . 1.0 110.982 179.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 62.4 m -112.09 126.29 55.02 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.571 -0.529 . . . . 1.0 109.571 178.379 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.667 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 50.8 m95 -115.31 149.28 38.1 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 115.856 -0.611 . . . . 1.0 111.091 -179.491 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.695 ' C ' HD23 ' A' ' 45' ' ' LEU . 2.1 ttt -128.46 133.27 48.47 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 115.408 -0.814 . . . . 1.0 109.592 178.236 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.695 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -110.84 140.33 45.38 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.761 -178.804 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.401 ' CD1' ' N ' ' A' ' 46' ' ' TYR . 27.5 m-85 -113.48 132.38 55.68 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.269 0.556 . . . . 1.0 110.898 -179.837 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.572 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.2 pt-20 -60.34 -36.19 77.41 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.539 -0.755 . . . . 1.0 110.263 -178.46 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 5.7 mt-30 -100.87 151.53 37.63 Favored Pre-proline 0 N--CA 1.45 -0.449 0 CA-C-N 115.286 -0.87 . . . . 1.0 110.038 -179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.52 ' C ' HD22 ' A' ' 50' ' ' ASN . 18.6 Cg_endo -55.32 149.77 44.44 Favored 'Trans proline' 0 C--N 1.308 -1.595 0 C-N-CA 121.792 1.662 . . . . 1.0 110.689 179.633 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.764 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER 71.24 -116.88 0.08 Allowed 'General case' 0 N--CA 1.446 -0.63 0 N-CA-C 108.572 -0.899 . . . . 1.0 108.572 -177.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.602 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -151.74 70.92 0.96 Allowed 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 115.778 -0.646 . . . . 1.0 109.884 178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -138.08 15.4 2.84 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 120.82 0.343 . . . . 1.0 110.903 -178.271 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -132.8 -176.66 14.5 Favored Glycine 0 C--N 1.321 -0.285 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -179.348 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.572 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.5 tp -51.75 150.0 4.3 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 -179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.8 pt20 -123.87 153.39 41.16 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 120.911 0.386 . . . . 1.0 110.877 -179.494 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -132.46 125.9 31.77 Favored 'General case' 0 C--N 1.332 -0.165 0 CA-C-N 116.071 -0.513 . . . . 1.0 110.159 178.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.403 ' C ' HD12 ' A' ' 58' ' ' LEU . 52.8 t80 -83.9 124.02 30.55 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-N 116.255 -0.429 . . . . 1.0 110.414 -179.293 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.403 HD12 ' C ' ' A' ' 57' ' ' PHE . 7.3 mp -121.15 146.86 46.32 Favored 'General case' 0 N--CA 1.464 0.247 0 CA-C-O 121.351 0.596 . . . . 1.0 110.383 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.402 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtp180 -132.67 160.41 36.8 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.108 -0.951 . . . . 1.0 110.562 179.678 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 59' ' ' ARG . 79.6 ttt-85 -38.47 125.04 1.34 Allowed 'General case' 0 C--N 1.331 -0.197 0 CA-C-N 115.617 -0.719 . . . . 1.0 110.441 -179.011 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.59 -179.73 32.2 Favored Glycine 0 CA--C 1.524 0.605 0 N-CA-C 110.382 -1.087 . . . . 1.0 110.382 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.2 m-20 -114.63 131.8 56.59 Favored 'General case' 0 N--CA 1.463 0.223 0 CA-C-O 120.866 0.365 . . . . 1.0 110.297 179.792 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 -125.11 113.34 17.6 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.049 -0.523 . . . . 1.0 109.851 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.32 -4.18 56.09 Favored 'General case' 0 C--N 1.318 -0.803 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.135 -179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.416 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 72.1 m-20 -147.43 141.99 26.53 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.85 -0.426 . . . . 1.0 109.85 179.398 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.534 ' CD2' ' OD1' ' A' ' 74' ' ' ASP . 15.5 p-80 -62.12 -41.75 98.55 Favored 'General case' 0 C--N 1.327 -0.389 0 CA-C-O 121.08 0.466 . . . . 1.0 111.215 -179.321 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 24.6 mm100 -53.73 -6.51 0.08 Allowed 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.702 -0.681 . . . . 1.0 110.363 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.502 ' H ' ' C ' ' A' ' 66' ' ' HIS . 19.4 mm-40 -83.66 -34.86 24.92 Favored 'General case' 0 N--CA 1.465 0.323 0 C-N-CA 120.613 -0.435 . . . . 1.0 111.354 -178.088 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.489 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -94.13 18.21 11.19 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 120.668 -0.413 . . . . 1.0 110.901 179.336 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.626 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 4.2 mtt 80.03 17.23 0.72 Allowed 'General case' 0 C--N 1.338 0.096 0 O-C-N 123.593 0.558 . . . . 1.0 110.774 -178.2 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.48 99.17 0.14 Allowed Glycine 0 C--N 1.341 0.855 0 N-CA-C 110.097 -1.201 . . . . 1.0 110.097 178.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.481 HD12 HD21 ' A' ' 54' ' ' LEU . 27.4 mt -67.41 -34.27 76.9 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.764 -0.458 . . . . 1.0 109.764 177.599 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.538 ' C ' ' H ' ' A' ' 75' ' ' SER . 30.9 t -130.86 129.34 42.18 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 109.927 -0.398 . . . . 1.0 109.927 178.859 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.534 ' OD1' ' CD2' ' A' ' 66' ' ' HIS . 1.8 m-20 -66.84 39.13 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 116.363 -0.381 . . . . 1.0 110.817 -179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.538 ' H ' ' C ' ' A' ' 73' ' ' SER . 40.9 t -115.22 123.8 49.78 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 109.499 -0.556 . . . . 1.0 109.499 179.736 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -149.83 103.12 0.34 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.577 0 N-CA-C 109.004 -0.739 . . . . 1.0 109.004 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.9 mtm180 -115.65 4.2 14.06 Favored 'General case' 0 C--N 1.343 0.307 0 CA-C-O 120.667 0.27 . . . . 1.0 111.514 -178.89 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 12.7 p -162.84 160.93 25.72 Favored 'General case' 0 CA--C 1.516 -0.338 0 CA-C-O 121.058 0.456 . . . . 1.0 110.584 179.371 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 15.0 p -156.77 148.29 22.43 Favored 'General case' 0 CA--C 1.512 -0.505 0 CA-C-N 115.577 -0.738 . . . . 1.0 110.605 -178.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.592 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.5 ptm180 -128.18 150.03 50.18 Favored 'General case' 0 CA--C 1.516 -0.335 0 N-CA-C 110.027 -0.361 . . . . 1.0 110.027 179.662 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.77 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.6 tt -101.8 124.27 47.15 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.887 -0.783 . . . . 1.0 108.887 178.51 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.77 ' N ' HD23 ' A' ' 81' ' ' LEU . 6.4 mt -85.34 116.09 64.07 Favored Pre-proline 0 CA--C 1.538 0.505 0 CA-C-N 115.99 -0.55 . . . . 1.0 109.974 -179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 47.5 Cg_exo -52.59 148.52 27.09 Favored 'Trans proline' 0 N--CA 1.498 1.761 0 C-N-CA 122.364 2.043 . . . . 1.0 113.107 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 56.4 p-80 -71.64 -179.46 2.6 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.402 -0.817 . . . . 1.0 110.471 179.314 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 1.9 t -167.06 143.0 4.29 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.469 -0.332 . . . . 1.0 110.797 179.92 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -83.92 -69.41 1.38 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 110.086 -1.206 . . . . 1.0 110.086 179.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 6.3 m -89.61 157.13 18.16 Favored 'General case' 0 CA--C 1.52 -0.199 0 N-CA-C 109.712 -0.477 . . . . 1.0 109.712 179.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.0 m80 -134.91 120.01 18.74 Favored 'General case' 0 N--CA 1.464 0.251 0 C-N-CA 121.116 -0.233 . . . . 1.0 110.932 -179.426 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 15.5 ptt180 -146.55 133.57 20.32 Favored 'General case' 0 C--N 1.326 -0.421 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 178.204 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 18.3 tt -147.2 150.53 14.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.559 0 CA-C-N 116.605 -0.271 . . . . 1.0 110.494 179.794 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 90.1 mtm180 -126.5 98.11 5.29 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-N 115.947 -0.57 . . . . 1.0 111.697 -179.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 22.7 mt -75.11 129.81 38.18 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.02 -0.537 . . . . 1.0 110.136 179.258 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.571 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 46.1 m-85 -107.68 136.53 47.28 Favored 'General case' 0 N--CA 1.47 0.544 0 CA-C-N 115.363 -0.835 . . . . 1.0 110.944 -179.943 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.528 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.91 -69.45 0.16 Allowed 'General case' 0 N--CA 1.445 -0.685 0 CA-C-N 115.832 -0.622 . . . . 1.0 111.761 -179.549 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 33.2 mtt-85 -96.85 176.44 5.98 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 115.744 -0.662 . . . . 1.0 110.892 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.673 ' O ' ' O ' ' A' ' 97' ' ' ASP . 59.1 mp0 -61.73 158.52 15.42 Favored 'General case' 0 CA--C 1.509 -0.598 0 CA-C-N 115.391 -0.822 . . . . 1.0 109.445 179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.78 ' O ' ' N ' ' A' ' 99' ' ' ARG . 77.8 m-20 49.15 124.35 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.705 0 O-C-N 124.269 0.981 . . . . 1.0 108.382 -178.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.506 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.4 OUTLIER -44.53 72.8 0.0 OUTLIER 'General case' 0 C--N 1.32 -0.689 0 CA-C-N 115.781 -0.645 . . . . 1.0 110.954 -177.056 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.78 ' N ' ' O ' ' A' ' 97' ' ' ASP . 7.4 tpt85 -121.62 -64.59 1.2 Allowed 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 121.171 0.51 . . . . 1.0 110.838 -178.157 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.443 ' O ' ' O ' ' A' ' 99' ' ' ARG . . . -51.96 -171.08 0.02 OUTLIER Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 -179.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.4 tp60 -58.42 148.58 27.54 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 110.037 -0.357 . . . . 1.0 110.037 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.571 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 7.9 ttp -131.63 152.42 50.84 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 116.208 -0.451 . . . . 1.0 110.995 -179.969 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.475 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.1 tt -146.92 141.67 20.32 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.56 0 N-CA-C 109.171 -0.678 . . . . 1.0 109.171 177.661 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.4 tt0 -111.29 141.55 44.67 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 121.406 0.622 . . . . 1.0 110.466 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.86 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 79.7 m-85 -129.42 153.53 47.84 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 114.714 -1.13 . . . . 1.0 110.42 -179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -141.66 29.9 1.71 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.641 -0.708 . . . . 1.0 110.738 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.5 pt-20 -170.94 -167.81 0.6 Allowed 'General case' 0 C--N 1.328 -0.328 0 C-N-CA 120.461 -0.495 . . . . 1.0 110.327 178.401 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.438 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 55.3 p-10 -76.83 144.83 38.82 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 116.242 -0.435 . . . . 1.0 110.69 179.504 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 6.2 m -135.02 89.43 2.52 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.997 -0.547 . . . . 1.0 109.779 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 16.1 m -64.46 -36.35 83.9 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-O 120.834 0.349 . . . . 1.0 111.454 -179.476 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 5.0 m -131.65 84.96 2.21 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-O 121.426 0.631 . . . . 1.0 110.323 -179.473 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.86 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.4 tp -59.27 -38.95 81.38 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.097 -0.956 . . . . 1.0 110.019 -178.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.648 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 22.1 mp0 -43.45 -9.64 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 116.281 -0.418 . . . . 1.0 111.511 178.652 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.587 ' N ' ' O ' ' A' ' 112' ' ' LEU . 87.2 m-20 -93.89 -21.94 18.93 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.982 0.42 . . . . 1.0 110.86 179.287 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.422 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.4 mmt180 -110.11 -38.65 5.24 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 115.974 -0.557 . . . . 1.0 112.383 -178.376 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.729 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -118.95 137.28 53.6 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-O 122.756 1.265 . . . . 1.0 111.142 -179.982 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.442 ' O ' ' C ' ' A' ' 118' ' ' PHE . 84.5 mmt-85 -73.78 -74.32 0.19 Allowed 'General case' 0 C--N 1.307 -1.26 0 O-C-N 120.275 -1.516 . . . . 1.0 110.364 -178.531 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.686 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 91.5 m-85 -31.53 143.65 0.02 OUTLIER 'General case' 0 C--O 1.217 -0.611 0 O-C-N 123.499 0.499 . . . . 1.0 110.598 -179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 15.1 t-20 -104.73 11.69 33.66 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 120.996 0.427 . . . . 1.0 110.726 -178.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.9 mt-10 -140.0 139.38 36.0 Favored 'General case' 0 C--N 1.333 -0.128 0 CA-C-O 121.237 0.541 . . . . 1.0 110.902 -178.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.675 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 44.4 mm -120.41 123.46 70.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.45 0 CA-C-N 115.369 -0.832 . . . . 1.0 109.51 178.191 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.447 ' O ' ' CB ' ' A' ' 123' ' ' SER . 20.4 m-70 -110.8 22.25 15.58 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.599 -0.728 . . . . 1.0 111.516 -178.898 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.591 ' C ' HD13 ' A' ' 124' ' ' LEU . 0.5 OUTLIER 165.2 157.85 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 120.921 -0.312 . . . . 1.0 110.479 179.713 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.699 HD13 ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -158.91 164.01 36.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.184 179.745 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -130.46 103.4 6.64 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 109.284 -0.636 . . . . 1.0 109.284 179.392 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.519 HG13 ' H ' ' A' ' 149' ' ' GLY . 0.6 OUTLIER -101.4 110.42 28.21 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.487 0 N-CA-C 108.7 -0.852 . . . . 1.0 108.7 179.234 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.955 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.3 OUTLIER -81.66 -39.22 24.7 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 115.419 -0.809 . . . . 1.0 111.249 -179.176 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.484 ' O ' ' O ' ' A' ' 129' ' ' GLY . 43.6 mm-40 -121.53 160.34 24.46 Favored 'General case' 0 CA--C 1.504 -0.801 0 CA-C-O 121.372 0.606 . . . . 1.0 111.039 -179.073 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.484 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 34.62 -159.4 0.01 OUTLIER Glycine 0 CA--C 1.53 1.016 0 CA-C-N 114.191 -1.368 . . . . 1.0 110.993 -179.671 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.508 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 1.7 t -120.26 -175.93 3.1 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.994 0.426 . . . . 1.0 109.891 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 130' ' ' SER . 75.0 m95 -150.71 168.97 22.75 Favored 'General case' 0 C--N 1.317 -0.812 0 CA-C-N 116.206 -0.452 . . . . 1.0 110.269 -178.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 57.5 t -137.42 131.44 44.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.507 0 N-CA-C 109.534 -0.543 . . . . 1.0 109.534 178.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.6 mt -105.07 143.0 33.86 Favored 'General case' 0 N--CA 1.47 0.525 0 N-CA-C 110.205 -0.295 . . . . 1.0 110.205 178.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . 0.526 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 14.2 m-85 -119.17 133.22 55.9 Favored 'General case' 0 CA--C 1.52 -0.205 0 CA-C-N 116.445 -0.343 . . . . 1.0 110.088 -179.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.421 ' OE2' ' O ' ' A' ' 135' ' ' GLU . 4.3 tm-20 -50.89 -29.86 13.1 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.088 -179.584 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -139.79 176.7 8.52 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.119 0.485 . . . . 1.0 110.107 -179.523 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.2 m -82.8 171.76 13.59 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.765 -0.652 . . . . 1.0 110.329 179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 10.1 m120 64.78 18.33 11.39 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.114 -0.948 . . . . 1.0 110.247 -179.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.455 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 3.2 m-85 37.39 79.26 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.002 -0.545 . . . . 1.0 111.663 179.298 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 50.4 ttm-85 -148.55 37.51 0.83 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-O 120.968 0.414 . . . . 1.0 110.422 179.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.449 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -149.36 -144.33 3.93 Favored Glycine 0 CA--C 1.521 0.442 0 N-CA-C 111.333 -0.707 . . . . 1.0 111.333 -178.032 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.0 mtt180 -73.01 159.06 34.25 Favored 'General case' 0 CA--C 1.518 -0.287 0 N-CA-C 110.077 -0.342 . . . . 1.0 110.077 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.626 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 88.6 mt-30 -138.81 134.6 33.61 Favored 'General case' 0 CA--C 1.517 -0.291 0 CA-C-N 116.007 -0.542 . . . . 1.0 111.047 -179.224 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -129.65 140.72 51.08 Favored 'General case' 0 C--O 1.22 -0.47 0 N-CA-C 109.291 -0.633 . . . . 1.0 109.291 178.55 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.53 ' C ' HD22 ' A' ' 146' ' ' LEU . 43.1 tp -95.95 128.37 42.78 Favored 'General case' 0 N--CA 1.467 0.406 0 O-C-N 123.725 0.641 . . . . 1.0 110.588 179.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.862 HD22 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -113.45 96.92 6.14 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 114.971 -1.013 . . . . 1.0 109.764 179.73 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.592 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.6 OUTLIER -68.89 154.57 94.77 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 114.89 -1.05 . . . . 1.0 110.235 -179.308 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . 0.452 ' HA ' HG13 ' A' ' 126' ' ' VAL . 18.5 Cg_endo -56.55 112.97 1.25 Allowed 'Trans proline' 0 C--N 1.309 -1.518 0 C-N-CA 122.233 1.955 . . . . 1.0 111.372 179.576 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.519 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 176.06 -150.83 10.98 Favored Glycine 0 CA--C 1.53 1.025 0 N-CA-C 110.421 -1.072 . . . . 1.0 110.421 -179.695 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.8 t0 -128.66 125.76 38.74 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 115.298 -0.451 . . . . 1.0 111.175 -179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.551 ' CD1' ' CD2' ' A' ' 124' ' ' LEU . 3.8 m-85 -117.66 128.38 54.86 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 109.315 -0.624 . . . . 1.0 109.315 179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 77.1 mtm-85 -107.47 -5.22 17.76 Favored 'General case' 0 CA--C 1.518 -0.25 0 O-C-N 123.685 0.616 . . . . 1.0 110.797 -179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.0 ptt-85 -154.13 172.22 17.9 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.688 -0.687 . . . . 1.0 110.545 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.443 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 26.6 p90 -85.21 -21.82 28.97 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.097 -0.956 . . . . 1.0 112.495 -178.521 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -64.53 -23.29 67.22 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 116.23 -0.441 . . . . 1.0 111.006 -179.398 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . 0.505 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.3 t0 -44.2 -54.33 5.74 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 120.946 0.403 . . . . 1.0 111.068 -179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.671 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 28.7 p90 -92.67 24.13 3.72 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.098 -0.501 . . . . 1.0 110.753 179.754 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 50.39 75.23 0.22 Allowed Glycine 0 CA--C 1.52 0.383 0 N-CA-C 111.217 -0.753 . . . . 1.0 111.217 179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.671 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.65 145.67 46.26 Favored 'General case' 0 C--O 1.224 -0.242 0 N-CA-C 109.884 -0.413 . . . . 1.0 109.884 179.618 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.7 t -76.23 -10.73 59.63 Favored 'General case' 0 C--N 1.323 -0.566 0 CA-C-N 115.557 -0.747 . . . . 1.0 109.92 178.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.503 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 30.2 t-20 -171.95 -164.53 0.31 Allowed 'General case' 0 C--N 1.321 -0.663 0 C-N-CA 120.449 -0.5 . . . . 1.0 110.156 178.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.871 ' O ' HG23 ' A' ' 164' ' ' VAL . . . -112.13 -16.42 13.03 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 116.37 -0.377 . . . . 1.0 110.328 179.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.437 ' C ' ' O ' ' A' ' 162' ' ' ALA . 99.7 mtt180 -30.12 116.59 0.13 Allowed 'General case' 0 N--CA 1.466 0.338 0 O-C-N 123.285 0.365 . . . . 1.0 111.751 -178.407 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.871 HG23 ' O ' ' A' ' 162' ' ' ALA . 57.6 t -126.43 162.9 29.59 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.135 179.395 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.609 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -146.07 -34.85 0.06 OUTLIER Glycine 0 CA--C 1.516 0.133 0 N-CA-C 111.604 -0.598 . . . . 1.0 111.604 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 11.6 p -160.19 173.0 16.4 Favored 'General case' 0 CA--C 1.512 -0.503 0 CA-C-O 120.932 0.396 . . . . 1.0 110.753 -179.197 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.614 HD21 HD13 ' A' ' 112' ' ' LEU . 1.1 pt? -158.59 154.19 26.17 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.91 -0.586 . . . . 1.0 112.186 -179.457 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.526 ' NE ' ' OH ' ' A' ' 134' ' ' TYR . 17.0 ptp180 -145.35 153.49 41.29 Favored 'General case' 0 C--N 1.323 -0.557 0 C-N-CA 120.409 -0.517 . . . . 1.0 110.441 178.766 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.441 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -82.04 149.14 28.25 Favored 'General case' 0 C--N 1.321 -0.67 0 N-CA-C 109.43 -0.581 . . . . 1.0 109.43 177.805 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.795 ' C ' HD12 ' A' ' 171' ' ' ILE . 25.9 m -81.73 78.12 1.13 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 121.373 0.606 . . . . 1.0 112.416 -178.412 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.795 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.9 mp -128.42 125.92 64.74 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 O-C-N 121.834 -0.541 . . . . 1.0 110.181 179.175 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.46 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 40.0 p-10 -70.69 -34.04 71.55 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.522 -0.763 . . . . 1.0 110.241 179.164 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.46 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 92.2 m-85 -68.13 -91.7 0.01 OUTLIER 'General case' 0 C--N 1.333 -0.143 0 CA-C-N 116.308 -0.406 . . . . 1.0 110.736 -179.907 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 23.4 p . . . . . 0 C--O 1.22 -0.488 0 CA-C-O 118.029 -0.986 . . . . 1.0 110.582 -179.99 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 99.4 mm-40 . . . . . 0 N--CA 1.489 1.507 0 N-CA-C 109.331 -0.618 . . . . 1.0 109.331 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.97 171.91 37.13 Favored Glycine 0 CA--C 1.523 0.541 0 N-CA-C 110.456 -1.057 . . . . 1.0 110.456 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.553 ' NZ ' ' OE2' ' A' ' 18' ' ' GLU . 59.5 tttm -173.18 102.16 0.13 Allowed 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.534 0.206 . . . . 1.0 110.66 179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.409 HD13 ' O ' ' A' ' 4' ' ' ILE . 0.0 OUTLIER -119.6 169.87 10.01 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.524 0 CA-C-N 116.393 -0.367 . . . . 1.0 110.853 -178.385 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.489 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.6 m -129.37 123.27 31.3 Favored 'General case' 0 CA--C 1.517 -0.316 0 N-CA-C 108.41 -0.959 . . . . 1.0 108.41 177.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.6 mt -107.83 133.09 52.71 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.941 -1.027 . . . . 1.0 110.184 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.489 ' CE1' HG22 ' A' ' 5' ' ' THR . 47.9 m-85 -115.36 126.22 54.15 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.346 -0.843 . . . . 1.0 111.111 -178.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 82.5 tt0 -52.9 -32.96 48.06 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.626 -0.715 . . . . 1.0 110.664 179.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.3 m-20 -115.42 150.0 37.11 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-O 121.304 0.574 . . . . 1.0 110.481 179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.427 ' C ' ' N ' ' A' ' 12' ' ' PHE . 20.1 ptt-85 -54.93 -173.32 0.0 OUTLIER 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.613 -179.665 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.32 23.22 0.26 Allowed Glycine 0 C--N 1.33 0.245 0 N-CA-C 110.955 -0.858 . . . . 1.0 110.955 178.694 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.427 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.3 m-85 52.78 68.24 0.86 Allowed 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.482 -0.359 . . . . 1.0 110.287 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 76.1 mm-40 -130.41 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 121.0 0.429 . . . . 1.0 110.516 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.82 -150.76 0.25 Allowed Glycine 0 CA--C 1.527 0.789 0 N-CA-C 110.943 -0.863 . . . . 1.0 110.943 179.58 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -69.71 146.9 51.19 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.804 0.335 . . . . 1.0 110.622 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.2 p-80 -136.26 144.14 44.64 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-O 121.279 0.561 . . . . 1.0 110.433 -179.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.556 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.2 t80 -137.81 141.52 40.83 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.309 -0.86 . . . . 1.0 109.893 -179.988 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.556 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 17.2 tt0 -111.22 122.17 47.17 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.368 -179.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.8 126.3 53.64 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.627 -179.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.3 t -117.99 13.33 13.92 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.745 -0.662 . . . . 1.0 110.377 -179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 45.0 m -158.21 168.18 27.76 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.647 -178.693 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.7 m-20 -58.34 140.64 53.16 Favored 'General case' 0 C--N 1.325 -0.462 0 CA-C-N 115.534 -0.757 . . . . 1.0 111.211 -179.297 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.88 153.1 49.59 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.534 -0.757 . . . . 1.0 110.601 179.635 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 70.7 p -120.88 -11.46 8.95 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 115.437 -0.801 . . . . 1.0 112.4 -179.012 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -150.15 116.44 5.72 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-O 121.42 0.629 . . . . 1.0 110.897 -179.206 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.426 ' O ' ' N ' ' A' ' 30' ' ' LEU . 6.5 mp -110.4 -3.11 16.29 Favored 'General case' 0 C--N 1.348 0.51 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.483 179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.589 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 35.8 mt-30 -52.95 -51.23 76.52 Favored Pre-proline 0 C--N 1.326 -0.434 0 C-N-CA 120.948 -0.301 . . . . 1.0 110.597 179.304 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.589 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 17.1 Cg_endo -54.76 -35.93 89.23 Favored 'Trans proline' 0 N--CA 1.489 1.212 0 C-N-CA 121.274 1.316 . . . . 1.0 112.292 -179.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 11.0 m-85 -94.81 -51.31 4.75 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 120.177 -0.609 . . . . 1.0 111.001 -179.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.426 ' N ' ' O ' ' A' ' 26' ' ' LEU . 7.2 mt -118.19 127.61 53.91 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.618 -0.719 . . . . 1.0 110.824 -178.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.3 t -94.24 -10.41 33.03 Favored 'General case' 0 C--N 1.319 -0.751 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.76 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 93.9 mtt180 -145.7 -58.79 0.32 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.504 -0.316 . . . . 1.0 111.749 -178.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 41.0 t 62.58 80.73 0.22 Allowed 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -178.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 35.6 m120 -96.57 4.78 51.78 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 116.573 -0.285 . . . . 1.0 111.245 -178.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.6 p -155.88 157.6 36.61 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 120.864 0.364 . . . . 1.0 110.368 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.71 154.71 34.59 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.992 -0.549 . . . . 1.0 110.967 -178.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 26.8 mtp180 -134.79 123.32 23.4 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.732 -0.84 . . . . 1.0 108.732 179.025 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 99.4 t -108.75 133.5 53.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.238 -0.653 . . . . 1.0 109.238 179.332 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -96.74 -41.48 8.46 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.367 179.683 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.8 p -160.85 157.28 26.4 Favored 'General case' 0 N--CA 1.445 -0.679 0 N-CA-C 109.448 -0.575 . . . . 1.0 109.448 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.99 176.28 49.38 Favored Glycine 0 C--N 1.315 -0.583 0 N-CA-C 110.924 -0.87 . . . . 1.0 110.924 179.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 72.9 m -112.55 147.19 37.15 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.459 -0.571 . . . . 1.0 109.459 178.319 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.403 ' CE2' HD13 ' A' ' 81' ' ' LEU . 51.8 m95 -132.46 151.28 51.95 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 115.907 -0.588 . . . . 1.0 110.776 -179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.563 ' C ' HD12 ' A' ' 45' ' ' LEU . 13.9 tpp -124.19 129.01 50.07 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 108.133 -1.062 . . . . 1.0 108.133 178.233 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.564 HD23 HG21 ' A' ' 76' ' ' VAL . 10.4 mp -109.81 131.46 55.04 Favored 'General case' 0 N--CA 1.465 0.282 0 CA-C-N 116.101 -0.499 . . . . 1.0 109.858 -179.051 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 67.3 m-85 -109.19 129.52 55.49 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-O 120.899 0.38 . . . . 1.0 111.927 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.497 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 19.7 pt-20 -53.61 -32.32 50.68 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 115.418 -0.81 . . . . 1.0 111.097 -179.28 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.758 ' CG ' ' H ' ' A' ' 53' ' ' GLY . 9.7 pt20 -113.83 156.72 43.4 Favored Pre-proline 0 CA--C 1.514 -0.404 0 N-CA-C 109.442 -0.577 . . . . 1.0 109.442 179.761 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -56.39 147.39 68.28 Favored 'Trans proline' 0 C--N 1.304 -1.772 0 C-N-CA 121.127 1.218 . . . . 1.0 111.968 179.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.846 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.3 OUTLIER 82.88 -124.36 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 114.279 -1.328 . . . . 1.0 109.588 -179.538 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.527 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.3 m-85 -150.12 75.05 1.23 Allowed 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.156 -0.475 . . . . 1.0 111.052 179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -134.78 -56.52 0.83 Allowed 'General case' 0 N--CA 1.466 0.348 0 N-CA-C 112.455 0.539 . . . . 1.0 112.455 -178.01 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.758 ' H ' ' CG ' ' A' ' 48' ' ' GLN . . . -61.97 -163.05 0.26 Allowed Glycine 0 C--N 1.314 -0.677 0 C-N-CA 120.07 -1.062 . . . . 1.0 111.305 -178.42 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.497 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.7 tp -59.02 147.61 33.94 Favored 'General case' 0 N--CA 1.435 -1.192 0 CA-C-N 114.908 -0.646 . . . . 1.0 110.143 -179.743 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.7 pt20 -121.34 149.8 42.4 Favored 'General case' 0 C--N 1.323 -0.547 0 O-C-N 122.994 0.184 . . . . 1.0 110.864 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.45 ' O ' ' SD ' ' A' ' 44' ' ' MET . 22.0 m-85 -126.51 127.1 44.81 Favored 'General case' 0 C--O 1.223 -0.299 0 CA-C-N 116.344 -0.389 . . . . 1.0 111.151 179.638 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.467 ' C ' HD22 ' A' ' 58' ' ' LEU . 55.9 t80 -81.71 121.63 26.62 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.558 0.694 . . . . 1.0 109.692 -179.426 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.467 HD22 ' C ' ' A' ' 57' ' ' PHE . 4.0 mm? -111.87 132.57 54.63 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-N 114.769 -1.105 . . . . 1.0 109.77 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.7 ttp180 -127.96 156.03 43.32 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 115.287 -0.869 . . . . 1.0 109.746 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.529 ' NH1' ' O ' ' A' ' 172' ' ' ASP . 36.9 ptt180 -37.35 126.87 1.05 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.763 -0.653 . . . . 1.0 111.454 -178.376 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.9 -178.3 30.09 Favored Glycine 0 CA--C 1.521 0.459 0 N-CA-C 111.166 -0.773 . . . . 1.0 111.166 -179.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 45.0 p-10 -116.43 127.48 54.64 Favored 'General case' 0 C--N 1.332 -0.192 0 CA-C-O 121.094 0.474 . . . . 1.0 110.335 -179.996 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 62.2 m-85 -121.47 113.27 19.59 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 109.272 -0.64 . . . . 1.0 109.272 179.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.432 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.49 -4.6 53.36 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.381 -179.492 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 81.9 m-20 -147.89 133.53 18.84 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.137 -0.69 . . . . 1.0 109.137 179.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.5 ' C ' ' H ' ' A' ' 68' ' ' GLN . 4.5 p80 -56.17 -40.97 74.72 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 120.958 0.409 . . . . 1.0 111.127 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 93.5 mt-30 -51.93 -8.36 0.07 Allowed 'General case' 0 C--N 1.32 -0.698 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.537 179.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.5 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.2 mm-40 -84.39 -32.93 23.91 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.838 -178.163 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -96.57 17.94 15.22 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 121.021 -0.272 . . . . 1.0 111.43 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.436 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 41.1 mtt 82.9 9.86 0.62 Allowed 'General case' 0 N--CA 1.462 0.134 0 O-C-N 123.941 0.775 . . . . 1.0 109.815 -178.627 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.406 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -57.85 101.43 0.18 Allowed Glycine 0 C--N 1.343 0.964 0 C-N-CA 120.306 -0.949 . . . . 1.0 111.218 179.631 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 45.4 mt -77.83 -40.78 39.24 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 109.429 -0.582 . . . . 1.0 109.429 176.637 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 80.4 p -114.25 113.32 24.45 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-O 120.902 0.382 . . . . 1.0 110.019 178.861 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 55.1 p-10 -71.64 50.65 0.18 Allowed 'General case' 0 CA--C 1.521 -0.167 0 CA-C-N 115.971 -0.559 . . . . 1.0 110.362 -179.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.512 ' O ' ' C ' ' A' ' 76' ' ' VAL . 4.1 m -111.61 -44.65 3.47 Favored 'General case' 0 N--CA 1.466 0.363 0 CA-C-N 116.511 -0.313 . . . . 1.0 111.195 -179.782 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.564 HG21 HD23 ' A' ' 45' ' ' LEU . 1.4 p 14.92 95.76 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.479 1.005 0 O-C-N 124.129 0.893 . . . . 1.0 111.044 -179.485 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.414 ' O ' ' N ' ' A' ' 26' ' ' LEU . 89.8 mtm180 -110.68 9.43 22.84 Favored 'General case' 0 N--CA 1.453 -0.321 0 CA-C-N 116.271 -0.422 . . . . 1.0 110.692 -177.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 4.4 p -160.46 159.27 30.67 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 121.497 0.665 . . . . 1.0 110.968 178.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.9 p -154.66 146.49 23.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 115.081 -0.963 . . . . 1.0 110.356 -178.212 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -127.67 146.4 50.57 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 120.795 0.331 . . . . 1.0 110.108 179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.403 HD13 ' CE2' ' A' ' 43' ' ' TRP . 21.9 tp -94.44 126.76 39.91 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.451 -0.944 . . . . 1.0 108.451 178.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 2.6 mt -91.32 114.94 63.35 Favored Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 109.222 -0.658 . . . . 1.0 109.222 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -51.23 149.4 16.43 Favored 'Trans proline' 0 N--CA 1.499 1.824 0 C-N-CA 122.087 1.858 . . . . 1.0 113.479 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 51.9 p-80 -73.61 179.22 4.23 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.164 -0.926 . . . . 1.0 110.554 179.122 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 41.6 t -173.75 149.8 1.62 Allowed 'General case' 0 C--N 1.326 -0.413 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.983 179.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -98.6 -50.55 1.52 Allowed Glycine 0 CA--C 1.525 0.665 0 N-CA-C 110.49 -1.044 . . . . 1.0 110.49 179.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.8 m -93.01 146.22 23.78 Favored 'General case' 0 C--N 1.331 -0.2 0 CA-C-O 120.903 0.382 . . . . 1.0 110.157 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.3 m80 -137.26 112.2 8.96 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.803 -178.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.466 ' HE ' HD23 ' A' ' 127' ' ' LEU . 61.4 ttp180 -140.18 135.02 31.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.699 0.285 . . . . 1.0 110.27 178.667 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.9 tt -148.93 145.76 17.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 C-N-CA 120.929 -0.309 . . . . 1.0 110.813 179.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 81.2 mtp180 -126.14 97.37 5.06 Favored 'General case' 0 N--CA 1.466 0.344 0 CA-C-N 115.73 -0.668 . . . . 1.0 111.352 -179.451 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -76.95 142.57 39.98 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-O 121.166 0.508 . . . . 1.0 111.187 179.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 70.4 m-85 -117.59 134.8 54.48 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-N 115.367 -0.833 . . . . 1.0 110.86 -179.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.437 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.2 tm-20 -53.45 -61.79 2.07 Favored 'General case' 0 N--CA 1.445 -0.717 0 CA-C-N 116.098 -0.501 . . . . 1.0 111.568 179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.442 ' O ' ' OG ' ' A' ' 123' ' ' SER . 76.4 mtp85 -100.33 170.48 8.4 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.975 -0.557 . . . . 1.0 110.364 -179.125 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -47.46 155.89 0.32 Allowed 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.713 -0.676 . . . . 1.0 110.43 179.067 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.408 ' C ' ' CD2' ' A' ' 98' ' ' TYR . 1.2 m-20 56.43 -96.12 0.06 Allowed 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 115.424 -0.807 . . . . 1.0 110.031 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.408 ' CD2' ' C ' ' A' ' 97' ' ' ASP . 2.2 p90 -170.53 33.66 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 120.365 -0.534 . . . . 1.0 109.668 179.924 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 61.9 mtt85 -90.46 44.57 1.21 Allowed 'General case' 0 N--CA 1.464 0.234 0 CA-C-N 115.677 -0.692 . . . . 1.0 111.183 -178.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -168.48 -169.89 32.48 Favored Glycine 0 C--N 1.313 -0.729 0 CA-C-N 115.258 -0.883 . . . . 1.0 111.083 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 3.3 tp-100 -61.78 145.11 53.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.815 0.34 . . . . 1.0 110.283 -179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 4.2 ptm -131.41 157.24 43.96 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-N 116.048 -0.524 . . . . 1.0 111.262 -179.697 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.7 tt -148.98 142.85 18.51 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.53 0 N-CA-C 109.989 -0.374 . . . . 1.0 109.989 178.199 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -113.62 142.41 46.02 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.447 0.642 . . . . 1.0 110.84 -179.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -129.5 156.66 43.78 Favored 'General case' 0 CA--C 1.519 -0.223 0 CA-C-N 114.556 -1.202 . . . . 1.0 110.331 -179.973 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 14.6 p -143.61 26.06 1.61 Allowed 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.586 -0.734 . . . . 1.0 110.636 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -167.74 -166.82 0.78 Allowed 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 120.627 -0.429 . . . . 1.0 110.37 178.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.445 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 54.2 p-10 -77.11 143.92 38.83 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.792 179.822 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.2 m -133.16 92.85 3.08 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-N 115.949 -0.569 . . . . 1.0 109.793 179.426 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.421 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.0 OUTLIER -67.2 -27.69 67.47 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 116.469 -0.332 . . . . 1.0 111.323 -179.365 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 13.6 m -136.84 96.45 3.32 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 121.25 0.548 . . . . 1.0 110.863 -179.423 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.519 ' C ' ' H ' ' A' ' 114' ' ' ASP . 54.4 tp -64.58 -44.25 91.28 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.346 -0.843 . . . . 1.0 110.44 -179.688 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 99.5 mm-40 -47.87 -7.75 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.348 -179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.519 ' H ' ' C ' ' A' ' 112' ' ' LEU . 90.7 m-20 -96.21 -25.45 15.81 Favored 'General case' 0 N--CA 1.462 0.168 0 CA-C-O 121.061 0.458 . . . . 1.0 110.318 -179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 25.7 mmt85 -108.78 -35.41 6.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.648 -0.705 . . . . 1.0 111.463 -179.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.466 ' HB2' HD11 ' A' ' 112' ' ' LEU . 4.2 t80 -126.12 121.09 31.86 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.001 0.429 . . . . 1.0 109.898 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 77.3 mtt-85 -60.11 -65.92 0.6 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.225 -178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.437 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 94.0 m-85 -39.5 142.35 0.29 Allowed 'General case' 0 N--CA 1.464 0.229 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.28 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 40.0 p-10 -104.18 2.85 32.27 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-O 120.715 0.293 . . . . 1.0 111.345 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -131.72 137.4 48.23 Favored 'General case' 0 N--CA 1.463 0.184 0 CA-C-O 121.241 0.543 . . . . 1.0 111.221 -178.073 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.68 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.5 mm -122.75 126.08 73.38 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-N 115.101 -0.954 . . . . 1.0 109.502 178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.405 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 23.3 m-70 -113.64 18.13 17.74 Favored 'General case' 0 C--O 1.223 -0.341 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.105 -179.095 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 4.0 p 173.84 153.52 0.1 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.987 0.422 . . . . 1.0 110.288 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.471 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.1 pp -162.75 156.71 20.68 Favored 'General case' 0 N--CA 1.45 -0.462 0 CA-C-N 115.695 -0.684 . . . . 1.0 110.443 -178.349 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -127.96 108.74 10.94 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.88 -0.6 . . . . 1.0 109.846 -179.655 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.478 HG13 ' H ' ' A' ' 149' ' ' GLY . 0.7 OUTLIER -102.84 110.9 30.75 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 N-CA-C 108.773 -0.825 . . . . 1.0 108.773 178.92 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.918 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -80.09 -39.25 30.0 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.033 -0.985 . . . . 1.0 111.158 -179.436 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.512 ' O ' ' O ' ' A' ' 129' ' ' GLY . 66.3 mm-40 -137.6 169.15 18.27 Favored 'General case' 0 CA--C 1.5 -0.966 0 CA-C-O 121.853 0.835 . . . . 1.0 110.74 -179.011 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.83 177.58 0.01 OUTLIER Glycine 0 C--N 1.311 -0.853 0 CA-C-N 113.622 -1.626 . . . . 1.0 110.828 179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 1.2 p -118.64 148.05 43.13 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 109.261 -0.644 . . . . 1.0 109.261 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.473 ' N ' ' CD1' ' A' ' 131' ' ' TRP . 27.5 m95 -120.17 166.48 13.39 Favored 'General case' 0 CA--C 1.513 -0.443 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.479 -178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.555 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.0 p -141.46 98.0 0.8 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.276 0 CA-C-N 116.396 -0.365 . . . . 1.0 110.889 179.34 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.419 HD23 ' HB3' ' A' ' 167' ' ' LEU . 10.7 mt -66.78 141.1 57.84 Favored 'General case' 0 CA--C 1.513 -0.452 0 C-N-CA 120.418 -0.513 . . . . 1.0 111.299 -178.16 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -117.75 131.65 56.57 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 115.802 -0.636 . . . . 1.0 109.741 178.574 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -45.3 -49.76 12.47 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.432 -179.398 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.784 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -123.82 170.48 10.51 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.206 0.527 . . . . 1.0 110.179 -178.45 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.5 p -75.43 174.79 9.14 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.236 -0.893 . . . . 1.0 110.898 179.489 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 60.4 m-20 60.01 16.63 6.0 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.467 -1.242 . . . . 1.0 110.037 -179.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 40.06 78.01 0.05 OUTLIER 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.14 -0.482 . . . . 1.0 111.718 179.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.784 ' C ' HD11 ' A' ' 136' ' ' LEU . 96.4 mtt180 -146.58 44.85 1.21 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-O 120.73 0.3 . . . . 1.0 110.551 179.169 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.521 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -158.39 -139.42 2.69 Favored Glycine 0 CA--C 1.521 0.468 0 N-CA-C 111.187 -0.765 . . . . 1.0 111.187 -178.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 2.1 mpt_? -78.19 169.04 18.92 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.024 0.44 . . . . 1.0 109.942 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.432 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 0.0 OUTLIER -147.83 139.21 23.65 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.757 -178.996 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.7 m-85 -129.07 139.71 51.89 Favored 'General case' 0 C--O 1.218 -0.583 0 N-CA-C 108.363 -0.977 . . . . 1.0 108.363 177.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.635 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -94.35 126.17 39.44 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-O 121.056 0.455 . . . . 1.0 110.743 -178.498 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.842 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.4 mm? -112.26 101.82 10.02 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.635 -0.711 . . . . 1.0 109.237 179.061 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.584 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -80.98 159.37 68.59 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 115.645 -0.707 . . . . 1.0 109.729 -179.441 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -54.29 120.76 8.52 Favored 'Trans proline' 0 C--N 1.307 -1.654 0 C-N-CA 122.276 1.984 . . . . 1.0 111.844 179.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.478 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 166.3 -159.09 32.3 Favored Glycine 0 CA--C 1.529 0.91 0 N-CA-C 110.734 -0.947 . . . . 1.0 110.734 -179.325 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.487 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 67.8 t0 -119.47 135.21 54.86 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.192 -0.504 . . . . 1.0 110.645 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.487 ' N ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 m-85 -126.55 128.45 46.88 Favored 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 115.889 -0.596 . . . . 1.0 110.017 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 82.0 mtt85 -115.4 -5.53 12.3 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.991 0.424 . . . . 1.0 110.332 179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.683 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.4 ptm180 -154.25 161.13 42.0 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 115.843 -0.617 . . . . 1.0 110.436 179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.419 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -76.18 -20.32 57.62 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 114.898 -1.047 . . . . 1.0 112.443 -177.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.683 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.3 mt-30 -68.97 -18.69 64.11 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-O 120.981 0.419 . . . . 1.0 111.021 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -51.06 -49.04 61.36 Favored 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.973 -179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.716 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 16.0 p90 -97.29 21.86 9.46 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 116.244 -0.434 . . . . 1.0 110.568 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.05 74.83 0.26 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.009 -0.836 . . . . 1.0 111.009 179.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.716 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.94 149.24 41.23 Favored 'General case' 0 C--O 1.223 -0.314 0 CA-C-O 121.034 0.445 . . . . 1.0 110.211 179.776 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -80.39 -10.5 59.75 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.014 178.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.736 HD22 ' HE ' ' A' ' 163' ' ' ARG . 58.3 t30 -172.22 -170.52 0.74 Allowed 'General case' 0 C--N 1.321 -0.653 0 C-N-CA 120.456 -0.498 . . . . 1.0 110.406 179.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.68 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.72 -13.31 14.81 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 116.255 -0.43 . . . . 1.0 110.493 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.736 ' HE ' HD22 ' A' ' 161' ' ' ASN . 19.1 ptp180 -43.35 121.31 2.18 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 121.51 0.671 . . . . 1.0 111.504 -178.194 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.464 HG23 ' O ' ' A' ' 162' ' ' ALA . 38.5 t -133.08 131.85 58.72 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.422 -0.808 . . . . 1.0 109.876 178.358 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.65 -29.29 3.93 Favored Glycine 0 N--CA 1.464 0.529 0 N-CA-C 111.477 -0.649 . . . . 1.0 111.477 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.421 ' OG ' ' O ' ' A' ' 110' ' ' SER . 21.0 m -162.98 174.42 12.35 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 120.905 0.383 . . . . 1.0 110.988 -179.39 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.419 ' HB3' HD23 ' A' ' 133' ' ' LEU . 0.4 OUTLIER -154.79 139.72 17.27 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 115.896 -0.593 . . . . 1.0 111.015 -179.56 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.555 ' O ' HG12 ' A' ' 132' ' ' VAL . 2.0 ttm180 -129.28 144.81 51.36 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.59 0.71 . . . . 1.0 109.485 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.811 ' H ' ' CD ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -79.27 150.43 31.54 Favored 'General case' 0 C--N 1.318 -0.766 0 CA-C-N 114.314 -1.312 . . . . 1.0 109.083 178.803 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.468 ' C ' HD12 ' A' ' 171' ' ' ILE . 58.3 t -90.21 81.23 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-O 120.927 0.394 . . . . 1.0 111.375 -178.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.468 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.1 mp -135.95 120.15 25.5 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.253 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.529 ' O ' ' NH1' ' A' ' 60' ' ' ARG . 42.7 p-10 -71.52 -35.2 70.64 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.599 -0.728 . . . . 1.0 110.403 179.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.525 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 93.3 m-85 -58.49 -78.46 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 116.11 -0.496 . . . . 1.0 110.633 -179.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . 0.424 ' O ' ' NH2' ' A' ' 169' ' ' ARG . 38.8 m . . . . . 0 C--O 1.22 -0.486 0 CA-C-O 117.977 -1.011 . . . . 1.0 110.557 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 98.5 mm-40 . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 109.169 -0.678 . . . . 1.0 109.169 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.516 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -174.09 172.97 45.73 Favored Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.534 -1.027 . . . . 1.0 110.534 -179.697 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -171.11 111.32 0.35 Allowed 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 121.107 -0.237 . . . . 1.0 110.734 179.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.441 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 171.18 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.398 0 CA-C-O 121.173 0.511 . . . . 1.0 111.493 -178.854 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.46 HG22 ' CE1' ' A' ' 7' ' ' TYR . 31.0 m -128.16 120.34 27.11 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 108.446 -0.946 . . . . 1.0 108.446 177.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.5 mt -105.25 133.33 50.2 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 115.085 -0.961 . . . . 1.0 110.305 -179.506 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.46 ' CE1' HG22 ' A' ' 5' ' ' THR . 73.5 m-85 -115.29 130.44 56.9 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.304 -178.429 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.453 ' O ' ' O ' ' A' ' 32' ' ' ARG . 84.0 tt0 -55.18 -24.22 25.82 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.643 -0.708 . . . . 1.0 110.244 -179.734 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -124.94 161.81 25.83 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 121.302 0.572 . . . . 1.0 110.379 179.071 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 19.4 ptt180 -65.62 -173.81 0.17 Allowed 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 115.47 -0.786 . . . . 1.0 111.048 -178.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.8 25.25 0.57 Allowed Glycine 0 C--N 1.332 0.356 0 N-CA-C 110.815 -0.914 . . . . 1.0 110.815 178.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 51.6 67.85 0.89 Allowed 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 115.648 -0.276 . . . . 1.0 110.312 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.6 mt-30 -129.64 -156.8 0.78 Allowed 'General case' 0 N--CA 1.469 0.489 0 CA-C-O 120.961 0.41 . . . . 1.0 110.523 179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.43 -149.73 0.41 Allowed Glycine 0 CA--C 1.526 0.765 0 N-CA-C 110.843 -0.903 . . . . 1.0 110.843 -179.715 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.2 mtt-85 -71.71 148.26 46.59 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 120.717 0.294 . . . . 1.0 110.577 -179.847 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.98 149.72 48.97 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-O 121.391 0.615 . . . . 1.0 110.299 -179.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.557 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.3 t80 -144.13 141.86 30.24 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.196 -0.911 . . . . 1.0 109.989 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.557 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 74.1 tt0 -110.57 121.38 45.16 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-N 116.171 -0.468 . . . . 1.0 110.467 -179.668 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 t -108.85 126.01 52.6 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 120.943 0.401 . . . . 1.0 110.734 -179.824 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 84.4 p -117.75 12.58 13.95 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 115.723 -0.672 . . . . 1.0 110.529 -179.86 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 28.7 t -156.46 172.49 18.44 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.654 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 89.3 m-20 -62.18 138.85 58.47 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 115.721 -0.672 . . . . 1.0 111.574 -179.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.59 143.23 47.23 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.328 179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.423 HG22 ' CE2' ' A' ' 51' ' ' TYR . 19.0 p -111.21 -17.41 13.2 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 115.774 -0.648 . . . . 1.0 112.067 -179.011 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.3 t30 -150.53 112.16 4.48 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.145 0.498 . . . . 1.0 110.208 -179.319 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.0 mt -108.84 2.39 21.55 Favored 'General case' 0 C--N 1.333 -0.129 0 CA-C-N 115.521 -0.763 . . . . 1.0 110.199 -179.939 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 43.7 mt-30 -52.05 -51.57 70.06 Favored Pre-proline 0 C--N 1.327 -0.4 0 CA-C-N 116.251 -0.431 . . . . 1.0 111.214 179.304 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.614 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.3 Cg_endo -55.96 -34.97 93.62 Favored 'Trans proline' 0 C--N 1.309 -1.522 0 C-N-CA 121.509 1.473 . . . . 1.0 112.789 -178.722 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.5 m-85 -91.27 -45.91 8.35 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 121.183 0.516 . . . . 1.0 110.807 -178.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.7 mt -122.66 129.06 51.42 Favored 'General case' 0 C--N 1.332 -0.19 0 CA-C-N 115.509 -0.768 . . . . 1.0 111.305 -179.218 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.5 t -92.4 -14.67 28.28 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 116.0 -0.546 . . . . 1.0 110.918 179.628 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 8' ' ' GLU . 62.2 ttp180 -176.47 119.69 0.14 Allowed 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 108.745 -0.835 . . . . 1.0 108.745 -179.362 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 44.5 t -99.2 112.97 25.0 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.677 0.275 . . . . 1.0 110.598 179.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.0 m-20 -105.0 -4.44 22.04 Favored 'General case' 0 C--O 1.224 -0.269 0 CA-C-O 120.598 0.237 . . . . 1.0 110.473 179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.6 p -157.1 157.78 35.16 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.91 0.386 . . . . 1.0 110.552 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.68 154.79 34.79 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.881 -0.6 . . . . 1.0 111.069 -179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.1 mtp180 -132.81 122.06 23.9 Favored 'General case' 0 C--O 1.218 -0.571 0 N-CA-C 108.783 -0.821 . . . . 1.0 108.783 178.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.18 115.89 49.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-O 121.276 0.56 . . . . 1.0 110.028 179.43 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.9 t0 -77.58 -42.18 36.14 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.429 -0.805 . . . . 1.0 110.936 -179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.5 t -163.6 159.86 22.29 Favored 'General case' 0 N--CA 1.443 -0.792 0 N-CA-C 109.223 -0.658 . . . . 1.0 109.223 -179.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.17 177.5 50.91 Favored Glycine 0 C--N 1.315 -0.623 0 N-CA-C 111.057 -0.817 . . . . 1.0 111.057 179.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.5 m -112.62 141.27 46.59 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 109.344 -0.613 . . . . 1.0 109.344 178.322 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.613 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 55.0 m95 -130.37 141.01 50.58 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.145 0.497 . . . . 1.0 110.903 -179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.549 ' C ' HD12 ' A' ' 45' ' ' LEU . 12.6 tpp -114.86 130.81 56.95 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.55 -0.75 . . . . 1.0 109.457 178.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.549 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -109.34 130.25 55.5 Favored 'General case' 0 C--O 1.222 -0.345 0 CA-C-N 115.796 -0.638 . . . . 1.0 109.448 -179.866 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.426 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 90.2 m-85 -109.71 133.42 53.15 Favored 'General case' 0 N--CA 1.468 0.467 0 CA-C-O 121.429 0.633 . . . . 1.0 111.671 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.625 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.55 -35.57 72.54 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 115.259 -0.882 . . . . 1.0 111.402 -179.2 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.408 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.8 mt-30 -109.42 152.83 42.92 Favored Pre-proline 0 CA--C 1.531 0.24 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.562 -179.009 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.439 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 35.0 Cg_endo -63.59 158.68 44.58 Favored 'Trans proline' 0 N--CA 1.497 1.677 0 C-N-CA 122.446 2.097 . . . . 1.0 112.493 178.393 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.631 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.8 OUTLIER 63.84 37.03 9.97 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.937 -179.89 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.426 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.2 m-85 50.06 76.12 0.15 Allowed 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.306 -0.861 . . . . 1.0 111.108 -179.78 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.6 m -144.04 153.12 41.87 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.009 0.433 . . . . 1.0 110.313 -179.036 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.87 -148.63 21.77 Favored Glycine 0 N--CA 1.452 -0.267 0 C-N-CA 121.053 -0.594 . . . . 1.0 111.88 179.68 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.625 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 44.8 tp -75.58 143.74 42.2 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.368 -0.416 . . . . 1.0 110.59 -179.428 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.573 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.6 OUTLIER -120.18 153.25 36.52 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 120.581 0.229 . . . . 1.0 110.486 179.543 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.425 ' O ' ' SD ' ' A' ' 44' ' ' MET . 29.6 m-85 -126.45 124.63 40.58 Favored 'General case' 0 C--N 1.348 0.517 0 CA-C-N 116.425 -0.352 . . . . 1.0 110.932 179.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -83.8 122.51 28.77 Favored 'General case' 0 CA--C 1.519 -0.23 0 CA-C-O 121.178 0.513 . . . . 1.0 110.146 -179.523 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.4 mp -119.85 145.36 46.73 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-N 115.636 -0.711 . . . . 1.0 109.973 179.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.642 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 68.4 mtm180 -132.26 158.57 41.47 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 115.541 -0.754 . . . . 1.0 109.949 179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.413 ' C ' ' O ' ' A' ' 59' ' ' ARG . 61.6 ttp180 -36.1 126.48 0.75 Allowed 'General case' 0 N--CA 1.462 0.173 0 CA-C-N 116.361 -0.381 . . . . 1.0 111.032 -179.526 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.61 -178.89 32.83 Favored Glycine 0 CA--C 1.523 0.547 0 N-CA-C 110.501 -1.039 . . . . 1.0 110.501 -179.638 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -115.31 129.46 56.61 Favored 'General case' 0 C--N 1.331 -0.21 0 CA-C-O 121.008 0.432 . . . . 1.0 110.154 -179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -123.53 113.04 18.2 Favored 'General case' 0 C--O 1.225 -0.228 0 CA-C-N 115.996 -0.547 . . . . 1.0 109.538 179.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.89 -3.75 54.05 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 116.249 -0.432 . . . . 1.0 111.654 -179.429 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -146.6 137.22 23.94 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 108.971 -0.751 . . . . 1.0 108.971 179.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.67 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 4.7 p80 -57.98 -41.64 83.41 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.054 0.454 . . . . 1.0 110.694 -179.361 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.63 -8.01 0.13 Allowed 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 115.792 -0.64 . . . . 1.0 110.807 179.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 66' ' ' HIS . 22.8 mm-40 -81.57 -34.09 31.25 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 120.647 -0.421 . . . . 1.0 111.317 -178.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.41 ' O ' ' HB2' ' A' ' 70' ' ' MET . 2.5 p90 -94.75 17.41 13.58 Favored 'General case' 0 CA--C 1.507 -0.674 0 C-N-CA 120.871 -0.331 . . . . 1.0 110.86 179.377 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.45 ' C ' ' H ' ' A' ' 72' ' ' LEU . 58.2 mtt 72.71 28.99 2.04 Favored 'General case' 0 CA--C 1.515 -0.377 0 O-C-N 124.209 0.943 . . . . 1.0 110.128 -178.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.599 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -72.54 39.51 0.75 Allowed Glycine 0 N--CA 1.444 -0.822 0 C-N-CA 120.667 -0.777 . . . . 1.0 111.599 -179.188 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.487 ' C ' ' O ' ' A' ' 71' ' ' GLY . 12.1 mt -17.87 -46.21 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 O-C-N 124.27 0.63 . . . . 1.0 111.116 -178.566 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.599 ' N ' ' O ' ' A' ' 71' ' ' GLY . 55.8 m -106.53 116.54 32.11 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 108.857 -0.794 . . . . 1.0 108.857 177.675 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 55.1 p-10 -67.44 38.14 0.03 OUTLIER 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.398 -0.365 . . . . 1.0 110.984 -178.883 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.533 ' H ' ' C ' ' A' ' 73' ' ' SER . 49.9 m -116.09 125.73 52.79 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 109.714 -0.476 . . . . 1.0 109.714 -179.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.3 p -163.24 115.11 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.324 -0.528 0 N-CA-C 108.981 -0.748 . . . . 1.0 108.981 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.439 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.3 mtm-85 -123.23 12.29 9.51 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-N 116.003 -0.544 . . . . 1.0 111.468 -178.606 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 27.1 p -163.38 163.13 25.18 Favored 'General case' 0 C--N 1.325 -0.458 0 CA-C-O 121.182 0.515 . . . . 1.0 110.592 178.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 11.4 p -157.58 148.37 21.19 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-N 115.489 -0.778 . . . . 1.0 110.546 -178.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -128.08 150.18 50.07 Favored 'General case' 0 CA--C 1.513 -0.442 0 N-CA-C 109.844 -0.428 . . . . 1.0 109.844 179.162 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.713 HD23 ' N ' ' A' ' 82' ' ' ILE . 3.7 tt -101.69 121.71 42.56 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 107.825 -1.176 . . . . 1.0 107.825 178.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.713 ' N ' HD23 ' A' ' 81' ' ' LEU . 7.2 mt -86.08 120.41 72.45 Favored Pre-proline 0 CA--C 1.542 0.659 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.011 -178.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -50.41 146.08 19.95 Favored 'Trans proline' 0 N--CA 1.496 1.655 0 C-N-CA 121.598 1.532 . . . . 1.0 113.077 -179.844 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.449 ' O ' ' O ' ' A' ' 85' ' ' SER . 27.1 p80 -64.19 -24.39 67.66 Favored 'General case' 0 CA--C 1.515 -0.402 0 CA-C-N 114.903 -1.044 . . . . 1.0 111.26 179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.449 ' O ' ' O ' ' A' ' 84' ' ' HIS . 14.4 t 53.35 165.65 0.01 OUTLIER 'General case' 0 C--N 1.315 -0.904 0 CA-C-N 115.374 -0.83 . . . . 1.0 111.059 179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.451 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . -106.35 -89.22 2.09 Favored Glycine 0 CA--C 1.526 0.747 0 N-CA-C 110.529 -1.028 . . . . 1.0 110.529 179.686 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 17.7 p -77.92 158.53 29.34 Favored 'General case' 0 CA--C 1.515 -0.378 0 N-CA-C 109.881 -0.414 . . . . 1.0 109.881 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.451 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 1.6 m170 -127.58 102.48 6.86 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 111.895 0.332 . . . . 1.0 111.895 -179.336 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 57.1 mtt180 -136.06 138.21 41.9 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 120.669 -0.413 . . . . 1.0 110.598 178.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.429 HD12 HG22 ' A' ' 126' ' ' VAL . 19.3 tt -148.44 144.74 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.128 0 CA-C-N 116.483 -0.326 . . . . 1.0 110.847 -179.755 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -122.87 97.91 5.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.018 -0.537 . . . . 1.0 111.367 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 21.3 mt -77.47 139.8 39.7 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.449 179.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -120.17 135.76 54.86 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-N 115.696 -0.684 . . . . 1.0 110.892 -179.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.51 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 0.9 OUTLIER -56.42 -62.36 1.77 Allowed 'General case' 0 N--CA 1.45 -0.463 0 CA-C-N 115.817 -0.629 . . . . 1.0 111.239 -179.951 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 34.7 mtt-85 -99.18 165.25 11.8 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.278 -178.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.634 ' O ' ' O ' ' A' ' 97' ' ' ASP . 97.8 mt-10 -52.65 159.13 1.13 Allowed 'General case' 0 CA--C 1.511 -0.551 0 CA-C-N 115.648 -0.705 . . . . 1.0 110.06 178.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.818 ' O ' ' N ' ' A' ' 99' ' ' ARG . 76.0 m-20 52.06 125.66 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.69 0 N-CA-C 108.209 -1.034 . . . . 1.0 108.209 -178.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.478 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.2 OUTLIER -36.58 70.71 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 116.163 -0.472 . . . . 1.0 111.58 -178.13 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.818 ' N ' ' O ' ' A' ' 97' ' ' ASP . 3.5 tpt180 -134.91 178.96 6.61 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.015 0.436 . . . . 1.0 109.928 -178.472 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 61.88 -160.65 29.67 Favored Glycine 0 CA--C 1.519 0.321 0 N-CA-C 110.393 -1.083 . . . . 1.0 110.393 179.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 -66.2 140.23 58.16 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.535 -0.466 . . . . 1.0 110.235 -179.884 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 3.8 ptm -132.26 154.19 49.89 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.122 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 11.2 tt -148.16 140.6 18.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.491 0 N-CA-C 109.436 -0.579 . . . . 1.0 109.436 178.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.53 143.04 44.37 Favored 'General case' 0 N--CA 1.469 0.486 0 CA-C-O 121.717 0.77 . . . . 1.0 110.68 -179.095 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.832 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 88.0 m-85 -129.38 154.25 47.09 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 114.764 -1.107 . . . . 1.0 110.472 -179.674 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.0 p -143.24 22.67 1.87 Allowed 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 116.005 -0.543 . . . . 1.0 110.541 179.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.6 pt-20 -159.61 -170.66 3.0 Favored 'General case' 0 N--CA 1.466 0.342 0 C-N-CA 120.625 -0.43 . . . . 1.0 110.552 178.476 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 54.5 p-10 -77.91 144.15 37.12 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.741 179.656 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 2.8 m -137.0 93.1 2.8 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.033 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.09 -31.21 72.32 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-O 121.034 0.445 . . . . 1.0 111.086 -179.478 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.7 m -136.82 90.3 2.53 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.408 -179.465 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.832 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.9 tp -60.48 -39.84 89.13 Favored 'General case' 0 C--O 1.223 -0.324 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.19 -178.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.627 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 18.4 mp0 -43.69 -9.19 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.471 0 CA-C-N 116.147 -0.479 . . . . 1.0 112.268 179.328 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 112' ' ' LEU . 65.8 t0 -94.69 -22.07 18.37 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 121.163 0.506 . . . . 1.0 110.215 179.584 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.42 ' N ' ' O ' ' A' ' 112' ' ' LEU . 82.5 mmt-85 -107.93 -37.14 6.17 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.446 -0.797 . . . . 1.0 112.821 -178.702 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.664 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -120.67 136.84 54.73 Favored 'General case' 0 CA--C 1.545 0.778 0 CA-C-O 122.51 1.148 . . . . 1.0 110.752 179.841 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.444 ' O ' ' C ' ' A' ' 118' ' ' PHE . 71.1 mtp180 -72.55 -71.46 0.29 Allowed 'General case' 0 C--N 1.315 -0.933 0 O-C-N 120.718 -1.239 . . . . 1.0 110.684 -177.705 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.608 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.1 m-85 -34.61 146.4 0.02 OUTLIER 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 115.811 -0.631 . . . . 1.0 110.31 179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 10.8 m120 -105.14 8.02 33.97 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.796 0.332 . . . . 1.0 110.713 -178.534 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 94.0 mt-10 -139.02 142.27 38.28 Favored 'General case' 0 CA--C 1.529 0.138 0 CA-C-O 121.238 0.542 . . . . 1.0 110.816 -178.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.71 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 36.5 mm -121.3 123.2 69.29 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.387 0 CA-C-N 115.566 -0.743 . . . . 1.0 109.267 178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.404 ' CD2' ' CB ' ' A' ' 162' ' ' ALA . 19.6 m-70 -112.14 24.54 12.49 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 116.501 -0.318 . . . . 1.0 111.634 -178.381 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 1.6 p 166.28 150.54 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 CA-C-O 121.074 0.464 . . . . 1.0 109.94 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.477 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 0.9 OUTLIER -161.29 156.94 24.72 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.286 -178.78 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.76 115.7 22.47 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.429 HG22 HD12 ' A' ' 90' ' ' ILE . 24.4 t -100.56 105.18 17.25 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.199 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.111 179.894 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.885 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.21 -44.39 25.84 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.045 -0.525 . . . . 1.0 110.774 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 26.3 tp10 -159.1 158.56 33.18 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 120.747 0.308 . . . . 1.0 110.861 -178.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.54 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 69.16 73.84 0.68 Allowed Glycine 0 CA--C 1.508 -0.348 0 C-N-CA 121.45 -0.405 . . . . 1.0 112.38 178.492 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.46 ' C ' ' O ' ' A' ' 129' ' ' GLY . 8.1 t -31.87 146.78 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.3 0 CA-C-O 120.899 0.381 . . . . 1.0 110.596 179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.54 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 30.8 m95 -122.1 169.23 11.07 Favored 'General case' 0 CA--C 1.506 -0.717 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.075 -178.105 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.498 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.3 p -141.47 96.86 0.74 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.371 0 CA-C-O 121.017 0.437 . . . . 1.0 110.756 178.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 11.4 mt -68.04 142.01 56.01 Favored 'General case' 0 CA--C 1.512 -0.488 0 C-N-CA 120.671 -0.411 . . . . 1.0 111.04 -178.035 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -118.15 130.75 56.29 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.785 -0.643 . . . . 1.0 109.98 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 81.4 tt0 -44.25 -48.61 9.43 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.999 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.516 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.68 175.28 6.94 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.442 0.639 . . . . 1.0 110.57 -179.113 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 28.8 m -81.45 172.35 13.63 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 115.522 -0.763 . . . . 1.0 110.817 179.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 63.0 t30 64.04 17.24 10.49 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.38 -0.827 . . . . 1.0 110.247 -179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.8 m-85 37.01 78.88 0.03 OUTLIER 'General case' 0 CA--C 1.532 0.278 0 CA-C-N 115.952 -0.567 . . . . 1.0 111.665 179.492 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.43 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 49.6 ttp180 -148.52 39.7 0.9 Allowed 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.12 0.486 . . . . 1.0 110.302 179.54 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.448 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -152.83 -137.67 2.57 Favored Glycine 0 N--CA 1.465 0.571 0 N-CA-C 111.157 -0.777 . . . . 1.0 111.157 -178.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.2 mtt-85 -80.27 167.81 19.83 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-O 121.102 0.477 . . . . 1.0 110.308 -179.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.573 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 0.0 OUTLIER -146.58 141.97 27.49 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.544 -0.753 . . . . 1.0 111.11 -179.08 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . 0.476 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 9.0 m-85 -130.76 142.27 50.4 Favored 'General case' 0 N--CA 1.473 0.696 0 N-CA-C 108.341 -0.985 . . . . 1.0 108.341 178.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.57 ' C ' HD22 ' A' ' 146' ' ' LEU . 46.2 tp -94.84 124.2 38.74 Favored 'General case' 0 N--CA 1.466 0.356 0 CA-C-O 121.169 0.509 . . . . 1.0 111.329 -179.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.846 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.7 88.94 2.96 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.529 -0.76 . . . . 1.0 108.951 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 4.5 mtm -70.82 162.66 70.39 Favored Pre-proline 0 CA--C 1.531 0.246 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.22 -179.137 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -54.23 116.69 3.22 Favored 'Trans proline' 0 N--CA 1.492 1.4 0 C-N-CA 121.621 1.547 . . . . 1.0 111.221 178.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 176.88 -157.46 22.61 Favored Glycine 0 CA--C 1.529 0.928 0 N-CA-C 110.698 -0.961 . . . . 1.0 110.698 -179.686 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -128.04 114.52 17.18 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 121.04 0.447 . . . . 1.0 110.519 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.473 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 31.2 m-85 -106.01 130.69 53.88 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.787 -0.642 . . . . 1.0 109.954 -179.657 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -116.12 -0.69 12.63 Favored 'General case' 0 N--CA 1.466 0.328 0 CA-C-O 120.792 0.329 . . . . 1.0 110.491 -179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.686 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.2 ptm180 -158.97 165.7 33.49 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.362 0.601 . . . . 1.0 110.484 179.347 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.413 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 18.1 p90 -77.19 -23.14 51.51 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 115.295 -0.866 . . . . 1.0 112.615 -178.384 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.686 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.9 mt-30 -67.53 -20.36 65.42 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.463 -0.335 . . . . 1.0 111.447 -179.604 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -49.97 -48.72 52.06 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 116.381 -0.372 . . . . 1.0 110.808 -178.724 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.679 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 23.1 p90 -96.6 20.96 9.94 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.09 -0.504 . . . . 1.0 110.573 179.733 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.59 74.78 0.27 Allowed Glycine 0 CA--C 1.521 0.446 0 N-CA-C 111.204 -0.758 . . . . 1.0 111.204 179.231 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.679 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.1 148.53 42.94 Favored 'General case' 0 C--O 1.225 -0.209 0 CA-C-O 121.257 0.551 . . . . 1.0 110.377 179.879 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.6 t -77.76 -10.86 59.77 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 114.969 -1.014 . . . . 1.0 110.356 178.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.518 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 32.6 t-20 -171.76 -169.02 0.64 Allowed 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.45 -0.5 . . . . 1.0 110.366 179.314 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.71 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -109.12 -8.69 15.11 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.625 -179.837 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 95.3 mtt180 -44.3 116.25 0.99 Allowed 'General case' 0 CA--C 1.514 -0.42 0 CA-C-O 120.891 0.377 . . . . 1.0 111.772 -178.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 162' ' ' ALA . 36.8 t -128.31 131.25 69.26 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.526 0 CA-C-N 115.814 -0.63 . . . . 1.0 109.677 177.701 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.438 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -108.65 -28.42 4.55 Favored Glycine 0 N--CA 1.463 0.443 0 N-CA-C 111.694 -0.562 . . . . 1.0 111.694 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 13.8 p -160.74 -168.58 2.15 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.704 0.288 . . . . 1.0 110.514 -179.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.604 HD21 HD13 ' A' ' 112' ' ' LEU . 1.8 pp -173.06 137.1 0.69 Allowed 'General case' 0 CA--C 1.512 -0.482 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.532 -179.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.642 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 1.3 ttm180 -131.04 149.77 52.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-O 121.559 0.695 . . . . 1.0 109.706 179.753 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.598 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -81.87 155.97 25.07 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-N 114.951 -1.022 . . . . 1.0 109.953 178.67 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.685 ' C ' HD12 ' A' ' 171' ' ' ILE . 45.9 t -93.29 79.39 1.35 Allowed 'Isoleucine or valine' 0 C--N 1.323 -0.552 0 C-N-CA 120.679 -0.408 . . . . 1.0 111.879 -179.239 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.951 HG22 ' H ' ' A' ' 173' ' ' PHE . 3.5 mp -137.39 128.15 39.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-N 116.105 -0.498 . . . . 1.0 110.654 179.229 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.582 ' O ' ' N ' ' A' ' 174' ' ' SER . 33.5 t70 -82.2 15.6 2.33 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.869 -0.605 . . . . 1.0 110.025 179.8 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.951 ' H ' HG22 ' A' ' 171' ' ' ILE . 4.3 m-85 57.56 -72.36 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.511 0 CA-C-N 115.602 -0.727 . . . . 1.0 110.34 179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . 0.582 ' N ' ' O ' ' A' ' 172' ' ' ASP . 0.9 OUTLIER . . . . . 0 C--N 1.322 -0.594 0 CA-C-O 118.014 -0.993 . . . . 1.0 110.78 179.72 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.6 pt20 . . . . . 0 N--CA 1.491 1.58 0 N-CA-C 109.276 -0.639 . . . . 1.0 109.276 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.535 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -82.4 173.96 53.16 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -174.1 101.75 0.1 Allowed 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 120.925 -0.31 . . . . 1.0 110.56 179.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.404 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -120.2 168.78 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.235 0 CA-C-N 116.47 -0.332 . . . . 1.0 110.533 -178.52 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.486 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.6 m -127.44 122.17 32.81 Favored 'General case' 0 C--N 1.332 -0.191 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 176.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.7 mt -104.79 132.7 50.72 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.328 -0.851 . . . . 1.0 110.438 -179.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.486 ' CE1' HG22 ' A' ' 5' ' ' THR . 49.8 m-85 -114.82 126.87 55.31 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 115.373 -0.83 . . . . 1.0 110.863 -178.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.512 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 79.2 tt0 -54.49 -32.23 57.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.597 -0.728 . . . . 1.0 110.72 -179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -115.22 152.16 33.17 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.217 0.532 . . . . 1.0 110.262 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.488 ' O ' ' N ' ' A' ' 12' ' ' PHE . 19.3 ptt-85 -56.83 -171.48 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.495 -0.775 . . . . 1.0 110.393 -179.535 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.63 23.97 0.07 OUTLIER Glycine 0 N--CA 1.46 0.292 0 N-CA-C 111.135 -0.786 . . . . 1.0 111.135 178.674 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.488 ' N ' ' O ' ' A' ' 10' ' ' ARG . 11.8 m-85 52.64 69.02 0.74 Allowed 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.47 -0.365 . . . . 1.0 110.213 -179.809 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 60.2 mt-30 -129.76 -156.41 0.76 Allowed 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 120.917 0.389 . . . . 1.0 110.473 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.33 -151.22 0.11 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.03 -0.828 . . . . 1.0 111.03 179.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.512 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 88.6 mtm180 -68.73 146.61 52.79 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.771 0.32 . . . . 1.0 110.755 179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 23.3 p-80 -136.49 143.88 44.04 Favored 'General case' 0 CA--C 1.521 -0.17 0 CA-C-O 121.155 0.502 . . . . 1.0 110.261 -179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.445 ' CE1' ' O ' ' A' ' 18' ' ' GLU . 11.3 t80 -137.39 141.52 41.72 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.293 179.866 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.445 ' O ' ' CE1' ' A' ' 17' ' ' TYR . 19.5 tt0 -110.33 127.84 55.25 Favored 'General case' 0 C--O 1.233 0.195 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.403 -179.903 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -115.45 127.11 55.1 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.607 -179.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 49.1 m -118.41 10.31 12.67 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.894 -0.594 . . . . 1.0 110.398 179.747 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.0 m -156.45 169.97 23.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.074 -0.512 . . . . 1.0 110.745 -178.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -59.42 137.49 57.98 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.752 -0.658 . . . . 1.0 110.947 -178.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.58 150.1 51.64 Favored 'General case' 0 N--CA 1.464 0.238 0 CA-C-N 115.774 -0.648 . . . . 1.0 109.924 179.455 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 79.5 p -119.65 -16.8 8.77 Favored 'General case' 0 CA--C 1.515 -0.378 0 CA-C-N 115.524 -0.762 . . . . 1.0 112.131 -178.746 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.491 ' OD1' ' NE2' ' A' ' 27' ' ' GLN . 15.2 t30 -144.75 111.04 5.56 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-O 120.912 0.387 . . . . 1.0 110.188 -178.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 21.1 mt -117.73 -5.72 11.1 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.866 -0.606 . . . . 1.0 110.58 -179.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.64 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -45.1 -53.13 17.59 Favored Pre-proline 0 C--N 1.33 -0.244 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.263 179.202 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.64 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 12.8 Cg_endo -54.17 -29.99 58.94 Favored 'Trans proline' 0 C--N 1.314 -1.28 0 C-N-CA 122.078 1.852 . . . . 1.0 111.96 -179.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.49 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -95.17 -51.44 4.62 Favored 'General case' 0 CA--C 1.521 -0.156 0 C-N-CA 120.751 -0.38 . . . . 1.0 110.43 -178.738 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -119.6 126.8 52.07 Favored 'General case' 0 CA--C 1.518 -0.253 0 CA-C-N 115.95 -0.568 . . . . 1.0 110.501 -179.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 8.5 t -95.89 -11.61 26.44 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.909 -0.587 . . . . 1.0 111.491 -179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.549 ' O ' ' O ' ' A' ' 75' ' ' SER . 26.2 mmt180 -142.22 -53.12 0.42 Allowed 'General case' 0 C--O 1.222 -0.369 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.612 -178.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . 0.464 ' O ' ' SG ' ' A' ' 33' ' ' CYS . 20.3 t 55.97 67.84 0.95 Allowed 'General case' 0 C--N 1.314 -0.937 0 N-CA-C 109.885 -0.413 . . . . 1.0 109.885 -178.431 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -89.05 4.54 47.99 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 116.353 -0.385 . . . . 1.0 111.161 -178.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 10.2 p -154.85 157.63 38.15 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 110.088 -0.338 . . . . 1.0 110.088 179.306 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -153.56 155.51 36.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.076 -0.511 . . . . 1.0 110.858 -178.895 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.4 mtp85 -135.21 122.77 22.06 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.802 -0.814 . . . . 1.0 108.802 179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.5 t -108.26 133.11 54.2 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 CA-C-O 121.153 0.501 . . . . 1.0 110.133 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 19.2 t0 -96.64 -39.5 9.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.419 179.281 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 96.3 p -162.96 155.72 19.03 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 109.883 -0.414 . . . . 1.0 109.883 179.779 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 176.06 49.7 Favored Glycine 0 CA--C 1.522 0.474 0 N-CA-C 111.113 -0.795 . . . . 1.0 111.113 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.0 m -111.26 147.53 34.86 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.706 -0.479 . . . . 1.0 109.706 178.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.47 ' CE2' HD13 ' A' ' 81' ' ' LEU . 56.5 m95 -132.1 150.86 52.05 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 115.81 -0.632 . . . . 1.0 111.246 -179.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.627 ' C ' HD23 ' A' ' 45' ' ' LEU . 21.4 tpp -127.38 129.58 47.84 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.881 -0.785 . . . . 1.0 108.881 178.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.627 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -110.15 137.82 47.37 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-N 116.105 -0.498 . . . . 1.0 109.757 -178.924 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 53.0 m-85 -112.73 129.95 56.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.955 0.407 . . . . 1.0 110.554 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 3.2 pt-20 -54.55 -33.93 60.99 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.791 -0.64 . . . . 1.0 110.295 -179.74 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -105.7 154.32 39.35 Favored Pre-proline 0 C--O 1.233 0.234 0 CA-C-N 116.172 -0.467 . . . . 1.0 110.174 179.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_endo -55.43 150.37 42.47 Favored 'Trans proline' 0 C--N 1.308 -1.574 0 C-N-CA 122.23 1.954 . . . . 1.0 111.212 179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.848 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER 78.61 -120.2 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.472 0 O-C-N 124.035 0.834 . . . . 1.0 109.103 -178.97 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.57 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 13.1 m-85 -141.98 79.06 1.65 Allowed 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.665 179.117 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.9 t -152.73 166.22 32.87 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 109.825 -0.435 . . . . 1.0 109.825 -179.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 80.15 -150.07 31.66 Favored Glycine 0 N--CA 1.451 -0.362 0 N-CA-C 111.289 -0.725 . . . . 1.0 111.289 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.631 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 49.5 tp -78.73 142.78 36.77 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 110.255 -0.276 . . . . 1.0 110.255 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.5 pt20 -121.15 150.41 41.32 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 110.297 -0.26 . . . . 1.0 110.297 179.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.503 ' O ' ' SD ' ' A' ' 44' ' ' MET . 6.1 m-85 -127.5 127.04 43.34 Favored 'General case' 0 CA--C 1.519 -0.222 0 CA-C-N 116.389 -0.369 . . . . 1.0 110.732 179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.488 ' C ' HD22 ' A' ' 58' ' ' LEU . 41.8 t80 -82.83 122.96 28.89 Favored 'General case' 0 C--N 1.33 -0.242 0 CA-C-O 121.392 0.615 . . . . 1.0 109.719 -179.407 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.488 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.2 mm? -109.71 136.09 49.6 Favored 'General case' 0 CA--C 1.514 -0.417 0 CA-C-N 115.136 -0.938 . . . . 1.0 110.343 -179.806 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.422 ' O ' ' C ' ' A' ' 60' ' ' ARG . 38.5 mtm-85 -127.0 149.14 50.03 Favored 'General case' 0 CA--C 1.521 -0.145 0 CA-C-N 115.15 -0.932 . . . . 1.0 109.856 -179.827 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.459 ' CZ ' ' O ' ' A' ' 172' ' ' ASP . 27.4 ptt180 -34.44 126.93 0.47 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.985 -0.552 . . . . 1.0 111.389 -179.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 153.36 -177.38 30.97 Favored Glycine 0 CA--C 1.523 0.559 0 N-CA-C 110.637 -0.985 . . . . 1.0 110.637 -179.452 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 78.1 m-20 -115.31 130.81 57.01 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.869 0.366 . . . . 1.0 110.195 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 63.1 m-85 -124.89 112.11 16.25 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.944 -0.571 . . . . 1.0 109.536 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.437 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -89.59 -4.45 57.84 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.827 -0.624 . . . . 1.0 110.991 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 83.2 m-20 -147.3 148.44 31.41 Favored 'General case' 0 C--N 1.328 -0.328 0 N-CA-C 109.723 -0.473 . . . . 1.0 109.723 179.299 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.536 ' C ' ' H ' ' A' ' 68' ' ' GLN . 17.2 p-80 -67.66 -42.53 82.05 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 121.019 0.437 . . . . 1.0 111.338 -179.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.523 ' N ' ' CD2' ' A' ' 66' ' ' HIS . 4.6 pt20 -50.79 -8.58 0.04 OUTLIER 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 115.734 -0.666 . . . . 1.0 110.519 179.374 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.536 ' H ' ' C ' ' A' ' 66' ' ' HIS . 24.9 mm-40 -82.42 -33.35 28.64 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.355 -0.384 . . . . 1.0 111.256 -177.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.518 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -98.1 21.72 10.41 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-O 119.27 -0.395 . . . . 1.0 110.907 179.215 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.455 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 57.6 mtp 80.46 10.48 1.12 Allowed 'General case' 0 N--CA 1.463 0.19 0 O-C-N 123.58 0.55 . . . . 1.0 110.256 -178.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.42 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -56.88 99.19 0.08 OUTLIER Glycine 0 C--N 1.339 0.704 0 N-CA-C 111.096 -0.801 . . . . 1.0 111.096 179.602 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 31.8 mt -73.0 -39.15 66.3 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 110.023 -0.362 . . . . 1.0 110.023 176.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.402 ' O ' ' N ' ' A' ' 75' ' ' SER . 31.5 t -115.44 116.28 27.95 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 109.612 -0.514 . . . . 1.0 109.612 178.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 50.8 p-10 -67.73 53.18 0.06 Allowed 'General case' 0 C--N 1.331 -0.236 0 CA-C-N 116.012 -0.54 . . . . 1.0 111.019 -179.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.612 ' C ' HG23 ' A' ' 76' ' ' VAL . 55.7 m -114.57 -114.73 0.33 Allowed 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 109.295 -0.632 . . . . 1.0 109.295 179.156 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.612 HG23 ' C ' ' A' ' 75' ' ' SER . 11.3 t 91.2 108.17 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 123.66 0.6 . . . . 1.0 109.884 -179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 80.9 mtm180 -122.68 7.62 9.44 Favored 'General case' 0 N--CA 1.462 0.166 0 CA-C-N 116.553 -0.294 . . . . 1.0 111.092 -178.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.434 ' HB3' ' H ' ' A' ' 50' ' ' ASN . 9.7 p -163.76 161.78 23.56 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.998 0.428 . . . . 1.0 110.653 179.399 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.7 p -154.81 146.05 22.87 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.026 -178.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.409 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.2 ptm180 -127.61 146.66 50.46 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 110.102 -0.333 . . . . 1.0 110.102 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.535 HD21 ' H ' ' A' ' 2' ' ' GLY . 29.8 tp -96.19 130.0 43.37 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 109.494 -0.558 . . . . 1.0 109.494 178.166 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.403 ' H ' HD12 ' A' ' 81' ' ' LEU . 3.2 mt -92.05 114.56 62.5 Favored Pre-proline 0 CA--C 1.54 0.582 0 CA-C-N 116.274 -0.421 . . . . 1.0 110.017 -179.895 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -51.32 148.64 18.59 Favored 'Trans proline' 0 N--CA 1.497 1.678 0 C-N-CA 122.439 2.093 . . . . 1.0 112.776 179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 75.8 m80 -72.01 -179.35 2.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 115.641 -0.709 . . . . 1.0 110.361 179.547 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 4.9 t -166.4 145.09 5.6 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.292 -0.413 . . . . 1.0 110.843 -179.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -88.44 -70.97 1.27 Allowed Glycine 0 CA--C 1.523 0.59 0 N-CA-C 110.322 -1.111 . . . . 1.0 110.322 179.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.4 m -88.55 153.67 20.95 Favored 'General case' 0 C--N 1.333 -0.124 0 N-CA-C 109.787 -0.449 . . . . 1.0 109.787 179.182 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.474 ' CD2' HD11 ' A' ' 171' ' ' ILE . 9.6 m80 -132.43 121.78 23.94 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.548 -0.296 . . . . 1.0 111.032 -179.645 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 61.7 ttp180 -147.92 136.59 21.77 Favored 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 120.955 -0.298 . . . . 1.0 110.288 178.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.411 HD12 HG22 ' A' ' 126' ' ' VAL . 20.6 tt -150.94 149.92 13.82 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 CA-C-N 116.517 -0.311 . . . . 1.0 110.535 -179.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -130.09 100.55 5.47 Favored 'General case' 0 N--CA 1.468 0.45 0 CA-C-O 121.389 0.614 . . . . 1.0 111.445 179.768 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 14.2 mt -77.44 139.43 39.66 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-N 115.645 -0.707 . . . . 1.0 110.301 179.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.603 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 54.6 m-85 -115.27 139.28 50.1 Favored 'General case' 0 C--O 1.243 0.753 0 CA-C-O 121.603 0.716 . . . . 1.0 111.138 -179.856 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.509 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.6 OUTLIER -59.27 -63.54 1.27 Allowed 'General case' 0 N--CA 1.449 -0.505 0 CA-C-N 115.395 -0.821 . . . . 1.0 111.512 -179.713 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 31.5 mmm-85 -96.07 174.09 7.09 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 121.113 0.482 . . . . 1.0 110.955 -178.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.2 mt-10 -66.32 169.25 7.53 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 115.547 -0.751 . . . . 1.0 110.988 -179.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.501 ' C ' ' CG ' ' A' ' 98' ' ' TYR . 66.0 t0 48.1 40.03 12.79 Favored 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 115.066 -0.97 . . . . 1.0 111.307 -179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.581 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER 54.01 35.99 23.41 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.688 -0.687 . . . . 1.0 111.225 178.221 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 80.9 mtp180 -101.16 150.36 23.02 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 121.164 0.507 . . . . 1.0 110.508 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.74 -166.79 31.66 Favored Glycine 0 CA--C 1.519 0.323 0 CA-C-N 115.803 -0.635 . . . . 1.0 111.527 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 65.1 tp60 -61.4 146.6 47.76 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.451 -0.374 . . . . 1.0 110.398 -179.303 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.603 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 5.9 ttp -133.36 149.1 51.87 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.82 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.458 HG21 ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -141.19 142.46 29.48 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.494 0 N-CA-C 109.8 -0.444 . . . . 1.0 109.8 178.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -112.38 136.71 51.53 Favored 'General case' 0 C--N 1.325 -0.489 0 CA-C-O 121.417 0.627 . . . . 1.0 110.647 -179.483 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.55 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 82.3 m-85 -122.41 156.13 34.65 Favored 'General case' 0 C--O 1.232 0.161 0 CA-C-N 114.844 -1.071 . . . . 1.0 110.256 -179.756 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 8.8 p -142.82 13.03 1.88 Allowed 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.673 -0.694 . . . . 1.0 110.396 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 20.0 pt-20 -156.33 -168.69 2.8 Favored 'General case' 0 N--CA 1.462 0.135 0 C-N-CA 120.616 -0.434 . . . . 1.0 110.322 178.702 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.453 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -76.63 145.16 39.04 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.275 -0.42 . . . . 1.0 110.801 -179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.453 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 13.5 m -133.47 93.2 3.11 Favored 'General case' 0 N--CA 1.466 0.352 0 CA-C-N 116.014 -0.539 . . . . 1.0 110.04 179.414 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 78.2 p -67.75 -28.29 67.5 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.319 -0.401 . . . . 1.0 111.247 -179.426 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 7.2 t -138.26 97.05 3.29 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-O 121.328 0.585 . . . . 1.0 111.174 -179.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.55 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 3.5 mt -63.82 -40.49 96.74 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.172 -0.922 . . . . 1.0 110.505 -179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.452 ' OE1' ' OD1' ' A' ' 119' ' ' ASN . 25.9 mm-40 -46.21 -11.31 0.02 OUTLIER 'General case' 0 C--N 1.323 -0.545 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.896 -179.593 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.535 ' N ' ' O ' ' A' ' 112' ' ' LEU . 38.5 t70 -96.21 -25.83 15.67 Favored 'General case' 0 C--N 1.332 -0.186 0 CA-C-O 120.804 0.335 . . . . 1.0 110.547 -179.787 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.478 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.3 mmt180 -110.31 -41.05 4.49 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.194 -0.457 . . . . 1.0 111.546 -179.143 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.489 ' CB ' HD22 ' A' ' 112' ' ' LEU . 5.1 t80 -122.41 116.68 24.42 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.15 0.5 . . . . 1.0 110.408 179.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 118' ' ' PHE . 23.5 mmm180 -56.67 -67.81 0.27 Allowed 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.444 -0.798 . . . . 1.0 111.16 -179.327 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.509 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 80.0 m-85 -38.08 139.98 0.31 Allowed 'General case' 0 N--CA 1.462 0.161 0 CA-C-N 116.51 -0.313 . . . . 1.0 110.304 -179.562 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.452 ' OD1' ' OE1' ' A' ' 113' ' ' GLN . 81.2 m-20 -100.43 2.84 42.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.566 -0.288 . . . . 1.0 110.914 -178.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 90.7 mt-10 -132.76 142.27 48.93 Favored 'General case' 0 CA--C 1.521 -0.154 0 CA-C-O 121.191 0.52 . . . . 1.0 111.151 -178.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.8 mm -122.92 120.64 61.19 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.376 0 CA-C-N 115.518 -0.765 . . . . 1.0 109.52 178.499 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.456 ' O ' ' CB ' ' A' ' 123' ' ' SER . 30.7 m-70 -110.94 28.48 8.67 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.891 -0.595 . . . . 1.0 111.514 -178.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.456 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.7 t 162.27 151.06 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 120.986 0.422 . . . . 1.0 110.695 179.465 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.439 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.3 pp -163.73 158.79 20.68 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.573 -0.74 . . . . 1.0 110.371 -178.346 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.518 HD22 HD11 ' A' ' 127' ' ' LEU . 3.2 t30 -126.33 119.1 26.49 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 109.848 -0.427 . . . . 1.0 109.848 179.821 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.411 HG22 HD12 ' A' ' 90' ' ' ILE . 26.5 t -100.9 105.42 17.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 109.722 -0.473 . . . . 1.0 109.722 179.093 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.931 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.69 -41.67 30.53 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.634 -0.712 . . . . 1.0 111.263 -179.893 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.7 tp10 -140.34 146.29 38.26 Favored 'General case' 0 N--CA 1.454 -0.243 0 CA-C-O 120.976 0.417 . . . . 1.0 110.87 -178.794 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 61.21 -175.39 5.46 Favored Glycine 0 CA--C 1.518 0.242 0 N-CA-C 111.183 -0.767 . . . . 1.0 111.183 179.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 8.4 t -117.65 154.38 31.7 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 109.655 -0.498 . . . . 1.0 109.655 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.3 m95 -127.64 160.21 32.31 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.808 -178.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 65.7 t -132.26 135.38 58.17 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.226 0 N-CA-C 109.659 -0.497 . . . . 1.0 109.659 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.517 ' HG ' HD11 ' A' ' 146' ' ' LEU . 23.5 mt -107.77 143.29 36.52 Favored 'General case' 0 C--N 1.325 -0.461 0 N-CA-C 110.238 -0.282 . . . . 1.0 110.238 179.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 40.4 m-85 -118.79 133.07 56.1 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-O 120.755 0.312 . . . . 1.0 110.629 179.454 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 33.2 tp10 -43.27 -52.23 5.82 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.147 -0.479 . . . . 1.0 110.958 179.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.592 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -121.99 172.3 8.32 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-O 121.176 0.513 . . . . 1.0 110.181 -179.048 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 14.7 m -75.56 170.05 16.9 Favored 'General case' 0 C--O 1.22 -0.453 0 CA-C-N 115.529 -0.76 . . . . 1.0 110.918 179.573 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 62.0 t30 66.37 16.94 10.58 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 115.279 -0.873 . . . . 1.0 109.982 -179.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.478 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 1.4 m-85 38.55 80.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.053 -0.521 . . . . 1.0 111.679 179.237 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.53 ' C ' HD11 ' A' ' 136' ' ' LEU . 51.3 ttp180 -149.48 42.11 0.89 Allowed 'General case' 0 N--CA 1.469 0.502 0 CA-C-O 120.983 0.421 . . . . 1.0 109.904 179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -152.44 -135.11 2.17 Favored Glycine 0 CA--C 1.522 0.512 0 N-CA-C 111.309 -0.716 . . . . 1.0 111.309 -178.12 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 95.5 mtt180 -82.98 168.54 16.9 Favored 'General case' 0 C--N 1.329 -0.301 0 N-CA-C 109.962 -0.384 . . . . 1.0 109.962 -179.884 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -146.38 137.82 24.58 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 116.116 -0.493 . . . . 1.0 110.919 -179.464 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 10.7 m-85 -128.22 132.11 48.8 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 109.162 -0.681 . . . . 1.0 109.162 178.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.623 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.8 OUTLIER -87.53 126.65 35.04 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.978 -0.556 . . . . 1.0 111.083 -179.046 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.623 ' N ' HD23 ' A' ' 145' ' ' LEU . 21.8 mt -115.43 99.9 7.71 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.993 -0.549 . . . . 1.0 109.599 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.451 ' HE2' HD22 ' A' ' 145' ' ' LEU . 5.2 mtm -81.94 156.77 69.66 Favored Pre-proline 0 C--N 1.327 -0.373 0 C-N-CA 120.704 -0.398 . . . . 1.0 110.604 -179.175 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -45.39 120.33 3.13 Favored 'Trans proline' 0 C--N 1.314 -1.287 0 C-N-CA 122.081 1.854 . . . . 1.0 111.569 178.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.54 -154.81 24.9 Favored Glycine 0 CA--C 1.525 0.701 0 N-CA-C 110.431 -1.068 . . . . 1.0 110.431 -179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.1 m-20 -127.02 135.98 51.59 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-O 120.835 0.35 . . . . 1.0 110.458 -179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.518 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 11.9 m-85 -126.87 130.97 51.21 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.754 -0.461 . . . . 1.0 109.754 -179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 27.1 ptt180 -119.39 -0.37 10.94 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 120.747 0.308 . . . . 1.0 110.589 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -158.15 163.11 37.9 Favored 'General case' 0 N--CA 1.454 -0.236 0 CA-C-O 121.173 0.511 . . . . 1.0 109.947 178.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.627 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -76.19 -18.48 59.06 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-N 115.354 -0.839 . . . . 1.0 111.918 -178.436 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.572 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -67.62 -21.68 65.38 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.001 -0.545 . . . . 1.0 110.712 -179.028 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.9 m-20 -50.27 -48.42 54.86 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 116.048 -0.524 . . . . 1.0 110.614 -178.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.731 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 21.7 p90 -102.27 19.41 18.77 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-O 120.927 0.394 . . . . 1.0 110.562 179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 76.67 0.16 Allowed Glycine 0 CA--C 1.52 0.354 0 N-CA-C 111.272 -0.731 . . . . 1.0 111.272 179.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.731 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -94.12 -169.75 2.14 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.037 0.446 . . . . 1.0 110.115 179.325 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 1.2 t -123.49 -36.31 2.8 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-N 115.542 -0.754 . . . . 1.0 111.776 -179.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.659 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.2 OUTLIER -145.64 -24.1 0.47 Allowed 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.468 -0.333 . . . . 1.0 111.61 -178.648 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.659 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 93.23 0.8 0.09 Allowed 'General case' 0 N--CA 1.465 0.305 0 O-C-N 124.031 0.832 . . . . 1.0 110.68 -179.845 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -67.98 116.07 8.22 Favored 'General case' 0 CA--C 1.507 -0.708 0 CA-C-N 116.16 -0.473 . . . . 1.0 110.849 -178.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.1 t -121.2 125.28 73.64 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.441 0 CA-C-N 115.535 -0.757 . . . . 1.0 110.115 179.198 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -102.07 -24.59 8.41 Favored Glycine 0 N--CA 1.464 0.503 0 N-CA-C 111.507 -0.637 . . . . 1.0 111.507 -179.659 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.9 p -161.51 171.21 18.5 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 120.88 0.371 . . . . 1.0 110.68 -179.543 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -155.73 148.5 24.16 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.98 -0.555 . . . . 1.0 111.617 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.478 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 15.4 ptp180 -138.17 154.2 49.16 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-O 120.861 0.363 . . . . 1.0 110.094 179.212 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -86.66 155.94 20.2 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.043 -0.526 . . . . 1.0 110.053 178.035 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 57.8 t -88.07 85.62 2.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.045 -0.525 . . . . 1.0 111.191 -179.318 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.492 HG23 ' CE2' ' A' ' 173' ' ' PHE . 3.5 mp -137.25 133.68 46.99 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.034 -0.53 . . . . 1.0 110.436 179.341 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.459 ' O ' ' CZ ' ' A' ' 60' ' ' ARG . 19.2 p-10 -104.01 -7.37 20.37 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.846 -0.616 . . . . 1.0 110.805 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.492 ' CE2' HG23 ' A' ' 171' ' ' ILE . 33.0 p90 -107.38 -172.06 2.0 Favored 'General case' 0 N--CA 1.466 0.325 0 CA-C-O 121.015 0.436 . . . . 1.0 110.629 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 10.3 t . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 117.947 -1.025 . . . . 1.0 110.526 179.915 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 . . . . . 0 N--CA 1.49 1.536 0 N-CA-C 109.21 -0.663 . . . . 1.0 109.21 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.545 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -87.32 173.33 44.19 Favored Glycine 0 CA--C 1.523 0.532 0 N-CA-C 110.694 -0.963 . . . . 1.0 110.694 179.964 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.9 tttt -172.91 106.24 0.15 Allowed 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.891 -0.324 . . . . 1.0 110.321 179.134 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.26 168.48 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.213 0 CA-C-N 116.468 -0.333 . . . . 1.0 110.595 -178.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.491 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.0 m -127.63 121.72 31.23 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 177.191 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 32.8 mt -105.67 132.97 51.16 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 115.047 -0.979 . . . . 1.0 110.262 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.491 ' CE1' HG22 ' A' ' 5' ' ' THR . 49.9 m-85 -115.06 127.26 55.51 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.307 -0.86 . . . . 1.0 110.909 -178.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.426 ' OE1' ' OD1' ' A' ' 9' ' ' ASP . 6.9 tm-20 -53.94 -32.86 55.04 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 115.557 -0.747 . . . . 1.0 110.588 -179.961 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . 0.426 ' OD1' ' OE1' ' A' ' 8' ' ' GLU . 90.4 m-20 -115.74 152.14 33.81 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-O 121.292 0.568 . . . . 1.0 110.292 179.762 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.44 ' C ' ' N ' ' A' ' 12' ' ' PHE . 32.5 ptt85 -57.04 -172.93 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 115.324 -0.853 . . . . 1.0 110.494 -179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.81 22.65 0.3 Allowed Glycine 0 CA--C 1.517 0.207 0 N-CA-C 110.918 -0.873 . . . . 1.0 110.918 178.858 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.44 ' N ' ' C ' ' A' ' 10' ' ' ARG . 10.3 m-85 53.23 67.37 1.01 Allowed 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 110.26 -0.274 . . . . 1.0 110.26 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . 0.43 ' OE1' ' O ' ' A' ' 12' ' ' PHE . 10.9 mm100 -129.8 -158.65 0.9 Allowed 'General case' 0 N--CA 1.468 0.445 0 CA-C-O 121.138 0.494 . . . . 1.0 110.594 179.929 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.67 -149.97 0.67 Allowed Glycine 0 CA--C 1.526 0.763 0 N-CA-C 110.816 -0.914 . . . . 1.0 110.816 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -70.83 147.13 49.2 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.681 0.277 . . . . 1.0 110.701 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 20.0 p-80 -136.49 146.6 46.45 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-O 121.187 0.518 . . . . 1.0 110.299 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.541 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.6 t80 -139.63 141.43 37.09 Favored 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.383 -0.826 . . . . 1.0 109.978 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.541 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 62.1 tt0 -111.07 122.92 49.12 Favored 'General case' 0 N--CA 1.463 0.176 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.336 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 t -110.6 126.83 54.87 Favored 'General case' 0 N--CA 1.469 0.484 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.464 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 60.3 p -117.43 10.29 13.55 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-N 115.955 -0.566 . . . . 1.0 110.345 179.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 24.8 m -156.88 169.02 25.73 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.732 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 47.7 m-20 -58.8 139.68 56.03 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-N 115.639 -0.709 . . . . 1.0 111.244 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -137.61 155.33 49.3 Favored 'General case' 0 C--O 1.233 0.236 0 CA-C-N 115.64 -0.709 . . . . 1.0 110.409 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 66.7 p -123.66 -15.03 7.14 Favored 'General case' 0 CA--C 1.518 -0.273 0 CA-C-N 115.382 -0.826 . . . . 1.0 112.326 -179.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 16.3 t30 -138.08 112.97 9.06 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 120.954 0.406 . . . . 1.0 110.408 -178.285 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 mp -115.95 -9.74 11.73 Favored 'General case' 0 C--N 1.35 0.614 0 CA-C-N 115.653 -0.703 . . . . 1.0 110.063 179.469 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.613 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -48.61 -52.53 43.84 Favored Pre-proline 0 C--N 1.326 -0.437 0 CA-C-N 115.923 -0.581 . . . . 1.0 110.46 179.535 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.613 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 16.8 Cg_endo -55.39 -33.69 86.46 Favored 'Trans proline' 0 C--N 1.316 -1.181 0 C-N-CA 121.848 1.699 . . . . 1.0 112.103 -178.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 5.3 m-85 -95.0 -49.43 5.55 Favored 'General case' 0 N--CA 1.462 0.159 0 C-N-CA 120.388 -0.525 . . . . 1.0 110.68 -178.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.0 mt -121.66 126.32 48.73 Favored 'General case' 0 N--CA 1.463 0.183 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.668 -178.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.5 t -95.01 -12.85 25.92 Favored 'General case' 0 C--N 1.317 -0.807 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.909 -179.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.559 ' O ' ' O ' ' A' ' 75' ' ' SER . 99.7 mtt180 -143.39 -51.17 0.34 Allowed 'General case' 0 C--O 1.221 -0.417 0 CA-C-N 116.167 -0.469 . . . . 1.0 111.737 -178.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 34.5 t 56.88 78.5 0.22 Allowed 'General case' 0 C--N 1.314 -0.955 0 O-C-N 122.134 -0.354 . . . . 1.0 110.099 -178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.442 ' OD1' ' OD1' ' A' ' 74' ' ' ASP . 34.2 m-20 -95.19 5.69 51.1 Favored 'General case' 0 C--O 1.223 -0.325 0 CA-C-N 116.5 -0.318 . . . . 1.0 111.294 -178.703 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 5.6 p -158.13 158.32 34.44 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 120.868 0.366 . . . . 1.0 110.254 179.692 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.79 154.3 32.56 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.942 -178.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.9 mtp85 -133.05 121.95 23.45 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 108.598 -0.89 . . . . 1.0 108.598 178.847 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 59.8 t -107.8 133.19 53.37 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 N-CA-C 109.627 -0.509 . . . . 1.0 109.627 179.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -95.59 -43.94 7.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.744 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 47.2 t -160.82 154.09 21.71 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 109.782 -0.451 . . . . 1.0 109.782 -179.829 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 84.95 177.59 50.99 Favored Glycine 0 C--N 1.317 -0.5 0 N-CA-C 111.194 -0.762 . . . . 1.0 111.194 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 63.1 m -112.16 134.05 53.93 Favored 'General case' 0 C--N 1.331 -0.228 0 N-CA-C 109.589 -0.522 . . . . 1.0 109.589 178.565 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.45 ' CE2' HD13 ' A' ' 81' ' ' LEU . 58.4 m95 -121.96 142.41 50.33 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-N 116.017 -0.538 . . . . 1.0 111.179 -179.329 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.69 ' C ' HD23 ' A' ' 45' ' ' LEU . 10.4 tpp -120.15 130.29 54.53 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.546 -0.752 . . . . 1.0 109.172 178.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.69 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -111.49 138.96 47.33 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-N 116.084 -0.507 . . . . 1.0 109.808 -178.823 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 50.1 m-85 -111.58 130.99 55.57 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-O 121.322 0.582 . . . . 1.0 110.979 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.401 ' HG2' ' N ' ' A' ' 54' ' ' LEU . 16.0 pt-20 -55.39 -30.7 60.88 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.12 -0.945 . . . . 1.0 110.532 -178.812 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.613 HE21 ' CA ' ' A' ' 53' ' ' GLY . 15.0 pt20 -114.87 156.29 45.25 Favored Pre-proline 0 N--CA 1.465 0.297 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.65 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.492 ' C ' HD22 ' A' ' 50' ' ' ASN . 14.4 Cg_endo -52.94 152.38 17.96 Favored 'Trans proline' 0 C--N 1.306 -1.694 0 C-N-CA 121.753 1.635 . . . . 1.0 111.911 -179.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.766 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER 70.32 -120.48 0.11 Allowed 'General case' 0 N--CA 1.446 -0.674 0 CA-C-N 114.747 -1.115 . . . . 1.0 109.313 -178.448 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.548 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER -153.64 76.28 1.08 Allowed 'General case' 0 C--N 1.317 -0.831 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.648 179.131 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.545 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 30.7 t -143.29 16.51 1.87 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.366 -0.379 . . . . 1.0 111.541 -178.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.613 ' CA ' HE21 ' A' ' 48' ' ' GLN . . . -133.11 -168.93 12.05 Favored Glycine 0 N--CA 1.464 0.549 0 N-CA-C 111.33 -0.708 . . . . 1.0 111.33 179.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.407 ' HA ' HD12 ' A' ' 54' ' ' LEU . 48.4 tp -55.34 145.54 21.82 Favored 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 109.522 -0.547 . . . . 1.0 109.522 179.867 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -122.33 152.49 40.07 Favored 'General case' 0 N--CA 1.465 0.309 0 CA-C-O 120.903 0.383 . . . . 1.0 110.624 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.48 ' C ' ' SD ' ' A' ' 44' ' ' MET . 6.0 m-85 -130.52 125.92 35.52 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 115.945 -0.57 . . . . 1.0 110.731 179.34 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -84.15 123.93 30.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.885 -0.598 . . . . 1.0 110.26 -178.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.0 mp -121.26 145.91 47.37 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-N 115.582 -0.735 . . . . 1.0 110.686 -179.729 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.406 ' O ' ' C ' ' A' ' 60' ' ' ARG . 43.8 mtp180 -132.51 158.66 41.55 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.01 -0.995 . . . . 1.0 110.293 179.616 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 59' ' ' ARG . 40.5 ptt180 -35.14 127.56 0.54 Allowed 'General case' 0 CA--C 1.528 0.13 0 CA-C-N 115.701 -0.681 . . . . 1.0 111.116 -179.369 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 152.79 -178.3 30.0 Favored Glycine 0 CA--C 1.52 0.362 0 N-CA-C 110.873 -0.891 . . . . 1.0 110.873 -179.136 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.442 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.5 p-10 -116.92 128.01 54.8 Favored 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.08 0.467 . . . . 1.0 110.435 -179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -120.46 112.72 19.32 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.03 -0.532 . . . . 1.0 109.6 179.728 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -90.86 -3.71 57.15 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.283 -179.76 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -148.28 141.34 24.93 Favored 'General case' 0 C--N 1.327 -0.386 0 N-CA-C 109.49 -0.559 . . . . 1.0 109.49 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.494 ' C ' ' H ' ' A' ' 68' ' ' GLN . 25.6 p-80 -62.57 -40.1 95.78 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.096 0.474 . . . . 1.0 111.166 -179.099 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 88.2 mt-30 -54.56 -6.78 0.12 Allowed 'General case' 0 C--N 1.321 -0.671 0 CA-C-N 115.718 -0.674 . . . . 1.0 110.355 179.345 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.494 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -84.5 -34.65 23.31 Favored 'General case' 0 N--CA 1.467 0.386 0 C-N-CA 120.779 -0.368 . . . . 1.0 111.363 -177.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -95.1 18.42 12.21 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-O 119.225 -0.417 . . . . 1.0 111.063 179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.473 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 39.9 mtt 82.37 12.92 0.54 Allowed 'General case' 0 N--CA 1.463 0.225 0 O-C-N 123.884 0.74 . . . . 1.0 110.128 -178.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.416 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -59.97 100.87 0.22 Allowed Glycine 0 C--N 1.343 0.926 0 C-N-CA 120.526 -0.845 . . . . 1.0 111.311 179.323 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 32.9 mt -71.56 -40.57 69.91 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 109.814 -0.439 . . . . 1.0 109.814 177.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 66.8 m -115.78 116.96 28.94 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 109.486 -0.561 . . . . 1.0 109.486 178.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.442 ' OD1' ' OD1' ' A' ' 34' ' ' ASN . 54.1 t0 -68.09 53.6 0.07 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-N 115.978 -0.555 . . . . 1.0 111.271 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.619 ' C ' HG23 ' A' ' 76' ' ' VAL . 8.5 t -113.75 -113.37 0.34 Allowed 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 108.798 -0.816 . . . . 1.0 108.798 179.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.619 HG23 ' C ' ' A' ' 75' ' ' SER . 7.5 t 90.69 109.52 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.471 0.575 0 O-C-N 123.646 0.592 . . . . 1.0 110.362 -179.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.4 mtm180 -126.09 8.51 7.33 Favored 'General case' 0 C--N 1.342 0.272 0 CA-C-O 120.742 0.306 . . . . 1.0 110.928 -179.215 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 10.7 p -163.45 161.21 24.14 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-O 121.144 0.497 . . . . 1.0 110.789 178.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 27.4 p -154.75 146.98 23.79 Favored 'General case' 0 CA--C 1.511 -0.533 0 CA-C-N 115.632 -0.713 . . . . 1.0 110.456 -178.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.7 ptm180 -127.84 148.01 50.45 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 110.224 -0.288 . . . . 1.0 110.224 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.545 HD21 ' H ' ' A' ' 2' ' ' GLY . 19.9 tp -98.64 127.3 44.52 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.858 -0.793 . . . . 1.0 108.858 178.549 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.436 ' N ' HD12 ' A' ' 81' ' ' LEU . 2.8 mt -93.16 120.49 66.8 Favored Pre-proline 0 CA--C 1.54 0.575 0 CA-C-N 116.189 -0.459 . . . . 1.0 109.827 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -48.34 140.47 20.57 Favored 'Trans proline' 0 N--CA 1.495 1.591 0 C-N-CA 122.145 1.897 . . . . 1.0 112.884 179.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.497 ' O ' ' O ' ' A' ' 85' ' ' SER . 90.5 m-70 -61.89 -30.87 71.16 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.955 -1.021 . . . . 1.0 110.993 -179.615 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.497 ' O ' ' O ' ' A' ' 84' ' ' HIS . 1.3 m 53.59 154.73 0.0 OUTLIER 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 115.75 -0.659 . . . . 1.0 111.302 179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -97.28 -79.02 1.44 Allowed Glycine 0 CA--C 1.522 0.486 0 N-CA-C 109.941 -1.264 . . . . 1.0 109.941 179.247 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 7.3 m -87.27 158.93 18.97 Favored 'General case' 0 C--N 1.332 -0.167 0 N-CA-C 109.752 -0.462 . . . . 1.0 109.752 179.314 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.773 ' CD2' HD11 ' A' ' 171' ' ' ILE . 5.8 m-70 -132.52 128.43 37.3 Favored 'General case' 0 N--CA 1.466 0.334 0 CA-C-O 120.887 0.375 . . . . 1.0 110.926 -179.566 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 4.4 ptp180 -155.1 133.91 12.11 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.679 178.529 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.567 HD12 HG22 ' A' ' 126' ' ' VAL . 16.6 tt -146.21 150.12 15.56 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.555 0 CA-C-N 116.442 -0.344 . . . . 1.0 110.754 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -128.4 98.28 5.0 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.087 -0.506 . . . . 1.0 111.25 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -78.24 137.63 38.22 Favored 'General case' 0 CA--C 1.512 -0.501 0 CA-C-O 121.326 0.584 . . . . 1.0 111.43 179.746 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.45 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 56.9 m-85 -111.93 134.42 53.49 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 115.11 -0.95 . . . . 1.0 110.841 180.0 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.466 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.9 tm-20 -52.98 -56.93 12.35 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.809 -0.632 . . . . 1.0 111.511 -179.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 83.0 mtp180 -104.1 171.5 7.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.072 -0.513 . . . . 1.0 110.564 -178.979 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.6 mt-10 -47.78 156.96 0.29 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.63 -0.714 . . . . 1.0 110.311 179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.436 ' C ' ' CD2' ' A' ' 98' ' ' TYR . 13.5 m-20 55.36 -97.92 0.08 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 115.878 -0.601 . . . . 1.0 109.92 -179.074 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.436 ' CD2' ' C ' ' A' ' 97' ' ' ASP . 0.8 OUTLIER -167.83 30.19 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 120.305 -0.558 . . . . 1.0 109.697 -179.709 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -88.63 50.51 1.98 Allowed 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 115.789 -0.641 . . . . 1.0 111.219 -178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -173.03 -172.52 38.7 Favored Glycine 0 CA--C 1.526 0.762 0 CA-C-N 115.32 -0.854 . . . . 1.0 111.407 -179.708 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 64.0 tp60 -58.31 146.83 32.98 Favored 'General case' 0 CA--C 1.518 -0.257 0 N-CA-C 109.988 -0.375 . . . . 1.0 109.988 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.47 ' HG2' ' N ' ' A' ' 103' ' ' ILE . 11.7 ttp -131.54 153.06 50.22 Favored 'General case' 0 N--CA 1.468 0.446 0 CA-C-N 116.216 -0.447 . . . . 1.0 110.897 -179.951 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.483 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.9 tt -146.51 142.12 20.92 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 109.5 -0.556 . . . . 1.0 109.5 177.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -112.54 143.41 43.74 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.47 0.653 . . . . 1.0 110.427 -179.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 90.9 m-85 -129.52 156.96 43.31 Favored 'General case' 0 C--O 1.235 0.324 0 CA-C-N 114.814 -1.084 . . . . 1.0 110.567 -179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 5.6 p -143.73 15.62 1.78 Allowed 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 115.433 -0.803 . . . . 1.0 110.592 179.77 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.413 ' C ' ' NE ' ' A' ' 169' ' ' ARG . 16.8 pt-20 -156.6 -168.55 2.73 Favored 'General case' 0 N--CA 1.462 0.147 0 C-N-CA 120.632 -0.427 . . . . 1.0 110.202 178.485 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.631 ' N ' ' NE ' ' A' ' 169' ' ' ARG . 49.1 p30 -79.87 147.98 31.51 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.805 179.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.408 ' O ' ' OG ' ' A' ' 166' ' ' SER . 2.2 t -138.03 93.95 2.83 Favored 'General case' 0 N--CA 1.466 0.339 0 CA-C-N 116.013 -0.54 . . . . 1.0 109.996 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 79.3 p -65.04 -22.28 66.96 Favored 'General case' 0 C--N 1.323 -0.552 0 C-N-CA 120.809 -0.357 . . . . 1.0 111.209 -179.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 16.4 t -140.56 94.23 2.71 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-O 121.311 0.577 . . . . 1.0 110.618 -179.467 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.534 ' C ' ' H ' ' A' ' 114' ' ' ASP . 56.0 tp -62.62 -43.5 98.65 Favored 'General case' 0 N--CA 1.453 -0.284 0 CA-C-N 115.342 -0.845 . . . . 1.0 110.299 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.679 ' NE2' HD22 ' A' ' 119' ' ' ASN . 22.5 mp0 -48.93 -7.65 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.012 -0.54 . . . . 1.0 110.925 179.706 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.534 ' H ' ' C ' ' A' ' 112' ' ' LEU . 45.7 t0 -94.88 -26.49 16.15 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.945 0.402 . . . . 1.0 110.346 179.933 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.409 ' N ' ' O ' ' A' ' 112' ' ' LEU . 30.8 mmt180 -108.31 -34.46 6.8 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.191 -179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.483 ' CD1' HG21 ' A' ' 103' ' ' ILE . 5.3 t80 -124.23 118.48 26.93 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.12 0.486 . . . . 1.0 109.871 178.499 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 75.8 mtt180 -54.51 -67.62 0.25 Allowed 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.529 -0.76 . . . . 1.0 111.12 -179.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.466 ' CG ' ' CG ' ' A' ' 94' ' ' GLU . 92.6 m-85 -40.14 141.66 0.45 Allowed 'General case' 0 N--CA 1.463 0.207 0 CA-C-N 116.156 -0.474 . . . . 1.0 110.233 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.679 HD22 ' NE2' ' A' ' 113' ' ' GLN . 19.1 t-20 -102.22 2.32 37.02 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-O 120.809 0.338 . . . . 1.0 111.35 -178.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -130.24 138.86 50.76 Favored 'General case' 0 N--CA 1.463 0.2 0 CA-C-O 121.219 0.533 . . . . 1.0 111.045 -178.146 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.717 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 37.4 mm -122.2 125.9 73.56 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.348 0 CA-C-N 115.303 -0.862 . . . . 1.0 109.358 178.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.437 ' O ' ' OG ' ' A' ' 123' ' ' SER . 29.5 m-70 -114.06 17.57 17.71 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 115.607 -0.724 . . . . 1.0 111.473 -178.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.584 ' C ' HD13 ' A' ' 124' ' ' LEU . 3.2 m 170.5 156.08 0.06 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 120.997 0.427 . . . . 1.0 110.965 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.684 HD11 ' CZ3' ' A' ' 157' ' ' TRP . 0.0 OUTLIER -160.11 162.08 33.94 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.664 -0.698 . . . . 1.0 110.818 179.466 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.57 112.31 16.04 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 109.045 -0.724 . . . . 1.0 109.045 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.567 HG22 HD12 ' A' ' 90' ' ' ILE . 40.4 t -101.72 103.95 15.66 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 CA-C-N 115.886 -0.597 . . . . 1.0 109.634 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.932 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -79.55 -37.45 36.43 Favored 'General case' 0 CA--C 1.516 -0.332 0 CA-C-N 115.591 -0.731 . . . . 1.0 110.75 -179.744 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.433 ' O ' ' O ' ' A' ' 129' ' ' GLY . 31.1 tp10 -138.87 158.34 44.39 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-O 120.875 0.369 . . . . 1.0 110.416 -179.083 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.433 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 45.08 -173.2 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.275 0 N-CA-C 111.078 -0.809 . . . . 1.0 111.078 -179.682 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.497 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.7 OUTLIER -115.71 176.18 5.2 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.384 -0.598 . . . . 1.0 109.384 179.545 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.497 ' CD1' ' C ' ' A' ' 130' ' ' SER . 67.3 m95 -147.12 161.1 41.55 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 115.694 -0.684 . . . . 1.0 110.346 -178.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 60.1 t -132.05 134.01 60.13 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.31 0 CA-C-N 116.058 -0.519 . . . . 1.0 109.771 179.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.48 143.53 37.32 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 110.155 -0.313 . . . . 1.0 110.155 179.444 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . 0.536 ' OH ' ' NE ' ' A' ' 168' ' ' ARG . 13.6 m-85 -119.43 131.9 55.72 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-O 121.041 0.448 . . . . 1.0 110.306 -179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 84.0 tt0 -47.69 -23.43 0.7 Allowed 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.945 -179.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.479 ' C ' HD12 ' A' ' 136' ' ' LEU . 0.3 OUTLIER -147.75 179.67 7.53 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-O 121.061 0.458 . . . . 1.0 110.199 -179.981 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 17.5 p -84.8 170.58 13.04 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.841 -0.618 . . . . 1.0 111.023 179.364 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . 0.642 ' ND2' ' HE ' ' A' ' 140' ' ' ARG . 57.5 t30 66.01 16.37 10.44 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.049 -0.978 . . . . 1.0 110.262 -179.563 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.545 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 5.1 m-85 40.37 78.66 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.801 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.642 ' HE ' ' ND2' ' A' ' 138' ' ' ASN . 90.9 mtt-85 -147.94 37.38 0.87 Allowed 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 120.905 0.383 . . . . 1.0 110.658 179.345 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.456 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -148.3 -145.64 4.19 Favored Glycine 0 CA--C 1.522 0.509 0 N-CA-C 111.428 -0.669 . . . . 1.0 111.428 -178.407 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 79.8 mtp85 -74.34 157.45 35.72 Favored 'General case' 0 C--O 1.222 -0.384 0 N-CA-C 110.18 -0.304 . . . . 1.0 110.18 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.472 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 66.1 mt-30 -133.75 133.66 42.02 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.538 -179.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 6.0 m-85 -128.5 133.3 48.43 Favored 'General case' 0 N--CA 1.471 0.607 0 N-CA-C 109.305 -0.628 . . . . 1.0 109.305 178.498 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.618 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.6 OUTLIER -91.54 128.72 37.48 Favored 'General case' 0 N--CA 1.467 0.398 0 CA-C-O 121.363 0.602 . . . . 1.0 110.587 -179.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.639 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.3 mm? -113.34 90.55 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.194 -0.912 . . . . 1.0 109.103 -178.608 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.8 OUTLIER -68.86 150.72 97.54 Favored Pre-proline 0 N--CA 1.448 -0.551 0 CA-C-N 114.857 -1.065 . . . . 1.0 111.097 -178.657 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_exo -44.93 119.22 2.28 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 C-N-CA 121.404 1.403 . . . . 1.0 111.298 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 166.2 -151.0 19.02 Favored Glycine 0 CA--C 1.529 0.947 0 N-CA-C 110.405 -1.078 . . . . 1.0 110.405 -179.764 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 96.4 m-20 -136.01 125.54 25.19 Favored 'General case' 0 N--CA 1.463 0.224 0 CA-C-O 120.676 0.274 . . . . 1.0 110.614 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.558 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 3.1 m-85 -116.43 129.41 56.21 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 109.325 -0.62 . . . . 1.0 109.325 179.533 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . 0.411 ' C ' ' OG ' ' A' ' 123' ' ' SER . 72.9 mtm-85 -107.24 -1.54 21.69 Favored 'General case' 0 CA--C 1.517 -0.316 0 CA-C-O 121.02 0.438 . . . . 1.0 110.432 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.681 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -156.99 163.03 39.56 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-O 121.474 0.654 . . . . 1.0 110.867 179.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.542 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 9.1 p90 -78.28 -21.08 50.32 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 114.905 -1.043 . . . . 1.0 112.565 -177.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.681 ' NE2' HH21 ' A' ' 153' ' ' ARG . 55.0 mt-30 -68.8 -20.03 64.31 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.93 -0.577 . . . . 1.0 111.167 -179.604 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 98.8 m-20 -51.96 -48.42 64.32 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-N 116.166 -0.47 . . . . 1.0 110.86 -178.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.708 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 16.8 p90 -95.77 20.92 9.12 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.666 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.84 75.76 0.2 Allowed Glycine 0 CA--C 1.521 0.429 0 N-CA-C 111.212 -0.755 . . . . 1.0 111.212 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.708 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.85 149.24 41.87 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 121.086 0.469 . . . . 1.0 110.146 179.633 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 13.4 t -76.93 -21.3 55.04 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.254 -0.884 . . . . 1.0 110.207 178.124 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . . . . . . . . . 18.8 m120 -163.33 -170.1 2.17 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 120.879 0.371 . . . . 1.0 110.492 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.717 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.91 -7.12 15.5 Favored 'General case' 0 C--O 1.223 -0.3 0 CA-C-N 116.102 -0.499 . . . . 1.0 110.577 179.728 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 73.0 mtp85 -49.23 119.56 3.39 Favored 'General case' 0 CA--C 1.508 -0.639 0 CA-C-O 121.067 0.461 . . . . 1.0 111.121 -178.519 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 42.9 t -135.05 121.25 32.59 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 CA-C-N 115.372 -0.831 . . . . 1.0 109.382 177.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.438 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -100.54 -23.09 10.48 Favored Glycine 0 N--CA 1.467 0.717 0 N-CA-C 111.716 -0.554 . . . . 1.0 111.716 -179.903 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.537 ' OG ' ' N ' ' A' ' 167' ' ' LEU . 5.2 t -156.77 179.94 8.8 Favored 'General case' 0 CA--C 1.512 -0.494 0 C-N-CA 120.266 -0.573 . . . . 1.0 110.314 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.537 ' N ' ' OG ' ' A' ' 166' ' ' SER . 1.5 pp -166.29 142.65 4.92 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.002 -0.544 . . . . 1.0 111.165 -179.902 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.545 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 13.4 ptp180 -136.15 152.57 50.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.836 0.351 . . . . 1.0 110.123 179.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.631 ' NE ' ' N ' ' A' ' 108' ' ' ASP . 0.0 OUTLIER -81.01 159.16 24.91 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 109.193 -0.669 . . . . 1.0 109.193 177.792 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 170' ' ' VAL . 27.1 m -92.41 66.14 0.46 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 115.797 -0.638 . . . . 1.0 111.791 -178.983 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.773 HD11 ' CD2' ' A' ' 88' ' ' HIS . 19.5 mt -121.77 131.43 73.13 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-O 121.441 0.639 . . . . 1.0 110.948 179.441 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -95.18 -26.79 15.84 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 114.886 -1.052 . . . . 1.0 110.58 179.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.504 ' CE2' HG23 ' A' ' 171' ' ' ILE . 51.3 p90 -89.33 -165.47 1.35 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-O 120.9 0.381 . . . . 1.0 110.747 -179.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 46.4 t . . . . . 0 C--O 1.22 -0.453 0 CA-C-O 117.989 -1.005 . . . . 1.0 110.635 -179.995 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.488 ' O ' ' O ' ' A' ' 2' ' ' GLY . 86.9 mt-30 . . . . . 0 N--CA 1.489 1.476 0 N-CA-C 109.461 -0.57 . . . . 1.0 109.461 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.488 ' O ' ' O ' ' A' ' 1' ' ' GLN . . . 51.18 168.17 0.01 OUTLIER Glycine 0 C--N 1.333 0.393 0 N-CA-C 110.726 -0.95 . . . . 1.0 110.726 -179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.2 tttp -174.77 100.4 0.09 Allowed 'General case' 0 C--N 1.325 -0.459 0 C-N-CA 120.673 -0.411 . . . . 1.0 110.24 178.765 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.99 164.8 16.04 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 CA-C-N 116.264 -0.426 . . . . 1.0 110.278 -178.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.522 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.8 m -124.16 118.6 27.25 Favored 'General case' 0 CA--C 1.518 -0.284 0 N-CA-C 108.29 -1.004 . . . . 1.0 108.29 177.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.8 mt -102.79 133.14 48.34 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 114.853 -1.067 . . . . 1.0 109.853 -179.681 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.522 ' CE1' HG22 ' A' ' 5' ' ' THR . 66.0 m-85 -115.92 126.1 53.45 Favored 'General case' 0 N--CA 1.468 0.429 0 CA-C-N 115.499 -0.773 . . . . 1.0 111.005 -178.575 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.533 ' OE1' ' NE ' ' A' ' 15' ' ' ARG . 82.0 tt0 -53.51 -31.57 46.65 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 115.677 -0.692 . . . . 1.0 110.608 179.672 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -115.16 153.67 30.38 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-O 121.283 0.564 . . . . 1.0 110.439 179.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.42 ' C ' ' N ' ' A' ' 12' ' ' PHE . 4.4 ptm180 -58.63 -173.14 0.01 OUTLIER 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 115.609 -0.723 . . . . 1.0 110.265 -179.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.47 26.84 0.25 Allowed Glycine 0 N--CA 1.462 0.388 0 N-CA-C 110.956 -0.858 . . . . 1.0 110.956 178.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.42 ' N ' ' C ' ' A' ' 10' ' ' ARG . 11.5 m-85 50.28 70.94 0.45 Allowed 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.362 -0.419 . . . . 1.0 110.279 -179.736 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 59.7 mt-30 -132.0 -158.81 0.92 Allowed 'General case' 0 N--CA 1.471 0.615 0 CA-C-O 120.92 0.391 . . . . 1.0 110.532 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.89 -151.93 0.3 Allowed Glycine 0 CA--C 1.526 0.732 0 N-CA-C 111.023 -0.831 . . . . 1.0 111.023 179.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.533 ' NE ' ' OE1' ' A' ' 8' ' ' GLU . 89.0 mtm180 -68.77 146.57 52.79 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.816 0.341 . . . . 1.0 110.768 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 18.3 p-80 -136.03 152.66 51.14 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.247 0.546 . . . . 1.0 110.377 -179.755 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.531 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -146.69 141.51 26.89 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.494 -0.776 . . . . 1.0 110.294 -179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.531 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.0 tt0 -110.2 123.1 49.14 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.057 -0.52 . . . . 1.0 110.177 -179.621 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.423 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.1 t -112.69 126.92 55.92 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 116.325 -0.398 . . . . 1.0 110.86 -179.387 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 5.6 t -117.49 10.85 13.66 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 116.087 -0.506 . . . . 1.0 110.353 179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 37.0 p -154.34 165.95 34.73 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.61 -178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.437 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 47.1 p-10 -58.32 141.65 50.42 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.549 -0.75 . . . . 1.0 111.446 -179.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.423 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -136.19 146.22 46.59 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 115.389 -0.823 . . . . 1.0 110.484 179.88 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.6 p -112.78 -16.17 12.81 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-N 115.738 -0.664 . . . . 1.0 111.651 -179.144 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -151.03 117.48 5.7 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 121.271 0.558 . . . . 1.0 110.667 -179.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.4 mt -118.24 -0.41 11.54 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.728 -0.669 . . . . 1.0 110.283 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.608 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 45.6 mt-30 -46.39 -53.44 23.63 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-N 116.321 -0.399 . . . . 1.0 110.795 178.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.608 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.4 Cg_endo -54.35 -30.35 62.45 Favored 'Trans proline' 0 C--N 1.311 -1.438 0 C-N-CA 121.842 1.695 . . . . 1.0 111.977 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.433 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 1.0 OUTLIER -96.27 -54.32 3.32 Favored 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 120.586 -0.446 . . . . 1.0 110.664 -179.062 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 7.9 mt -117.74 126.95 53.4 Favored 'General case' 0 N--CA 1.466 0.364 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.756 -179.031 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.2 t -95.28 -9.45 33.07 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 115.746 -0.661 . . . . 1.0 111.499 -179.209 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 94.4 mtm-85 -146.36 -59.56 0.3 Allowed 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 -178.145 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.0 t 64.8 76.37 0.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.939 0.399 . . . . 1.0 110.004 -178.21 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 -92.55 3.78 54.85 Favored 'General case' 0 C--O 1.223 -0.302 0 CA-C-N 115.999 -0.546 . . . . 1.0 111.383 -178.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.0 p -158.67 158.76 34.38 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 120.818 0.342 . . . . 1.0 110.274 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.92 155.73 34.82 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.016 -0.538 . . . . 1.0 110.995 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.3 mtp180 -134.67 123.62 24.01 Favored 'General case' 0 C--O 1.209 -1.079 0 N-CA-C 108.96 -0.756 . . . . 1.0 108.96 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 57.4 t -109.06 132.66 56.5 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 N-CA-C 109.364 -0.606 . . . . 1.0 109.364 179.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -93.92 -43.59 8.49 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.772 -0.649 . . . . 1.0 110.627 179.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 30.7 t -160.99 151.84 18.46 Favored 'General case' 0 N--CA 1.449 -0.476 0 CA-C-N 116.269 -0.423 . . . . 1.0 109.874 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.26 175.78 47.58 Favored Glycine 0 C--N 1.319 -0.405 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 179.47 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 77.4 m -113.02 137.52 51.28 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 109.509 -0.552 . . . . 1.0 109.509 178.403 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.448 ' CE2' HD13 ' A' ' 81' ' ' LEU . 46.8 m95 -124.02 155.98 37.29 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.242 0.544 . . . . 1.0 110.904 -178.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.424 ' C ' HD23 ' A' ' 45' ' ' LEU . 1.4 tpt -127.78 129.1 46.47 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.694 -0.854 . . . . 1.0 108.694 178.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.424 HD23 ' C ' ' A' ' 44' ' ' MET . 2.7 mt -108.69 130.33 55.35 Favored 'General case' 0 C--N 1.332 -0.179 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.451 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 73.3 m-85 -108.26 131.61 54.53 Favored 'General case' 0 C--O 1.243 0.724 0 CA-C-O 121.665 0.745 . . . . 1.0 110.758 -179.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.629 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 4.7 pt-20 -59.25 -35.11 73.1 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.711 -1.131 . . . . 1.0 110.347 -179.348 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.414 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.3 mt-30 -111.0 153.41 43.85 Favored Pre-proline 0 N--CA 1.462 0.146 0 CA-C-N 116.446 -0.343 . . . . 1.0 110.49 -178.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.93 159.17 43.44 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 C-N-CA 122.443 2.095 . . . . 1.0 112.623 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.681 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.64 39.21 11.53 Favored 'General case' 0 CA--C 1.522 -0.131 0 CA-C-N 115.731 -0.668 . . . . 1.0 111.023 179.754 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.451 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 5.2 m-85 48.17 74.22 0.18 Allowed 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 115.291 -0.868 . . . . 1.0 110.746 -179.43 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.8 m -141.5 153.15 44.74 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 121.063 0.459 . . . . 1.0 110.168 -179.253 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 88.42 -147.26 19.95 Favored Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 120.91 -0.662 . . . . 1.0 111.675 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.629 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 37.2 tp -80.31 146.0 31.82 Favored 'General case' 0 N--CA 1.447 -0.617 0 CA-C-N 115.388 -0.406 . . . . 1.0 110.647 -179.309 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.429 ' NE2' ' H ' ' A' ' 145' ' ' LEU . 12.1 pt20 -121.78 150.86 41.26 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.839 0.352 . . . . 1.0 110.537 179.612 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.425 ' CE1' ' HA2' ' A' ' 71' ' ' GLY . 24.7 m-85 -127.53 132.54 49.9 Favored 'General case' 0 N--CA 1.462 0.165 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.236 179.628 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.491 ' C ' HD22 ' A' ' 58' ' ' LEU . 57.5 t80 -80.77 118.3 22.18 Favored 'General case' 0 C--N 1.331 -0.213 0 CA-C-O 121.576 0.703 . . . . 1.0 109.961 -178.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.491 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.5 mm? -111.71 133.89 53.64 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.131 -0.94 . . . . 1.0 109.704 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 31.4 ptt85 -133.65 162.12 32.81 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-N 115.441 -0.799 . . . . 1.0 110.204 -179.6 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -41.06 123.88 2.09 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.322 -0.399 . . . . 1.0 110.91 -177.905 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 159.08 178.63 33.27 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.86 -0.896 . . . . 1.0 110.86 -179.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.4 p-10 -115.29 124.43 51.3 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 121.206 0.527 . . . . 1.0 110.222 179.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 55.4 m-85 -119.32 112.46 19.48 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 109.244 -0.651 . . . . 1.0 109.244 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.427 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.24 -4.04 54.65 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.496 -179.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.427 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.9 m-20 -147.58 138.34 23.37 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 109.398 -0.593 . . . . 1.0 109.398 179.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.611 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 5.7 p80 -58.48 -40.96 84.19 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.133 0.492 . . . . 1.0 110.969 -179.338 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 74.6 mt-30 -54.3 -7.82 0.17 Allowed 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 115.924 -0.58 . . . . 1.0 110.709 179.292 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.463 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.1 mm-40 -81.89 -34.82 29.79 Favored 'General case' 0 CA--C 1.518 -0.253 0 C-N-CA 120.386 -0.526 . . . . 1.0 111.05 -177.771 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.476 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.75 13.19 18.91 Favored 'General case' 0 C--N 1.321 -0.643 0 C-N-CA 120.963 -0.295 . . . . 1.0 110.311 179.179 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.424 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 52.6 mtt 74.51 35.98 0.66 Allowed 'General case' 0 C--O 1.225 -0.213 0 O-C-N 123.915 0.759 . . . . 1.0 109.967 -178.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.483 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -72.67 42.91 0.9 Allowed Glycine 0 CA--C 1.531 1.057 0 C-N-CA 120.158 -1.02 . . . . 1.0 111.463 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.475 ' C ' ' O ' ' A' ' 71' ' ' GLY . 14.9 mt -25.13 -44.36 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 122.761 0.424 . . . . 1.0 111.094 -178.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.483 ' N ' ' O ' ' A' ' 71' ' ' GLY . 47.1 t -119.42 114.09 21.78 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 108.563 -0.902 . . . . 1.0 108.563 177.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.559 ' OD1' ' ND1' ' A' ' 66' ' ' HIS . 91.2 m-20 -62.43 -161.89 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.73 -0.471 . . . . 1.0 109.73 -179.213 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.55 ' O ' ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER 83.48 69.0 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.905 0 CA-C-O 120.836 0.35 . . . . 1.0 111.387 178.975 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -100.02 114.4 38.39 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.124 0 N-CA-C 108.607 -0.886 . . . . 1.0 108.607 178.173 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.9 mtm180 -121.49 4.12 10.19 Favored 'General case' 0 CA--C 1.515 -0.368 0 CA-C-N 115.867 -0.606 . . . . 1.0 111.566 -178.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.2 p -163.22 162.69 25.51 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 121.177 0.513 . . . . 1.0 110.543 179.131 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 25.2 p -155.55 147.26 23.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.706 -0.679 . . . . 1.0 110.188 -178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -127.08 146.46 50.36 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 109.933 -0.395 . . . . 1.0 109.933 179.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.448 HD13 ' CE2' ' A' ' 43' ' ' TRP . 24.0 tp -96.41 136.15 37.3 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.485 -0.932 . . . . 1.0 108.485 178.095 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.443 ' H ' HD12 ' A' ' 81' ' ' LEU . 2.2 mt -96.41 112.91 61.42 Favored Pre-proline 0 CA--C 1.54 0.571 0 N-CA-C 109.606 -0.516 . . . . 1.0 109.606 179.76 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -51.77 148.62 21.55 Favored 'Trans proline' 0 N--CA 1.498 1.783 0 C-N-CA 122.143 1.895 . . . . 1.0 113.224 179.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 32.4 m170 -71.03 179.44 2.76 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 115.452 -0.795 . . . . 1.0 110.301 179.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.2 t -171.91 153.24 3.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.089 -0.505 . . . . 1.0 110.906 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -100.59 -58.35 0.85 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.471 -1.052 . . . . 1.0 110.471 179.2 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 3.9 m -88.04 147.65 24.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.835 0.35 . . . . 1.0 110.244 179.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 4.8 m80 -136.06 114.69 11.91 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 116.188 -0.46 . . . . 1.0 110.94 -179.338 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 62.2 ttp180 -142.29 133.76 26.55 Favored 'General case' 0 C--N 1.329 -0.302 0 N-CA-C 110.195 -0.298 . . . . 1.0 110.195 178.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.515 HD12 HG22 ' A' ' 126' ' ' VAL . 16.9 tt -145.93 143.29 21.48 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 116.387 -0.37 . . . . 1.0 111.007 -179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 74.4 mtp85 -121.58 101.75 7.8 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.751 -0.659 . . . . 1.0 111.447 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 18.9 mt -82.89 139.29 33.51 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.964 -0.562 . . . . 1.0 110.908 179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.471 ' CE1' ' CG ' ' A' ' 102' ' ' MET . 67.7 m-85 -115.15 136.96 52.55 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-O 121.527 0.679 . . . . 1.0 111.276 179.815 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.614 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 17.4 pt-20 -58.48 -47.12 85.1 Favored 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.278 -0.874 . . . . 1.0 110.354 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.493 ' N ' ' CG ' ' A' ' 94' ' ' GLU . 24.7 mtt85 -115.22 165.91 12.42 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.086 -0.506 . . . . 1.0 111.089 -178.355 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.641 ' O ' ' O ' ' A' ' 97' ' ' ASP . 95.7 mt-10 -52.91 159.07 1.22 Allowed 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 115.312 -0.858 . . . . 1.0 110.354 179.027 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.791 ' O ' ' N ' ' A' ' 99' ' ' ARG . 53.3 t0 50.66 124.94 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.703 0 O-C-N 124.235 0.959 . . . . 1.0 108.686 -179.104 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.2 OUTLIER -35.0 73.51 0.0 OUTLIER 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 116.292 -0.413 . . . . 1.0 111.501 -177.868 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.791 ' N ' ' O ' ' A' ' 97' ' ' ASP . 10.3 ptm180 -139.68 169.99 16.72 Favored 'General case' 0 C--O 1.231 0.09 0 C-N-CA 120.636 -0.426 . . . . 1.0 109.917 -178.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 69.94 -161.98 52.82 Favored Glycine 0 CA--C 1.521 0.413 0 N-CA-C 110.828 -0.909 . . . . 1.0 110.828 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.614 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 11.6 tp-100 -61.39 139.45 58.19 Favored 'General case' 0 C--N 1.325 -0.489 0 C-N-CA 120.917 -0.313 . . . . 1.0 110.205 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.724 ' SD ' ' N ' ' A' ' 103' ' ' ILE . 4.3 tmm? -131.73 137.66 48.32 Favored 'General case' 0 N--CA 1.466 0.35 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.585 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.724 ' N ' ' SD ' ' A' ' 102' ' ' MET . 8.3 tt -134.37 137.41 51.63 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.662 0 N-CA-C 109.094 -0.706 . . . . 1.0 109.094 178.134 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -111.33 146.88 36.3 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-O 121.526 0.679 . . . . 1.0 110.362 -179.03 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.838 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 89.0 m-85 -130.27 155.67 45.93 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.037 -0.983 . . . . 1.0 110.466 -179.156 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 11.6 p -143.77 27.76 1.47 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.92 -0.582 . . . . 1.0 110.681 179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.408 ' CD ' ' N ' ' A' ' 107' ' ' GLU . 1.4 pm0 -168.08 -167.68 0.86 Allowed 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.713 -0.395 . . . . 1.0 110.47 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.521 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 56.5 t0 -81.64 147.34 29.6 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.419 179.554 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.521 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 3.2 m -139.16 97.05 3.21 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.229 179.537 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.4 m -64.44 -30.88 71.92 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 120.901 0.382 . . . . 1.0 110.983 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 51.5 m -137.74 93.14 2.75 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 115.982 -0.553 . . . . 1.0 110.511 -179.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.838 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 13.4 tp -60.59 -39.19 87.19 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.448 -0.796 . . . . 1.0 110.365 -179.319 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.634 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 25.3 mp0 -43.86 -13.49 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 CA-C-N 116.389 -0.369 . . . . 1.0 111.634 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.517 ' N ' ' O ' ' A' ' 112' ' ' LEU . 93.6 m-20 -93.82 2.07 56.29 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.189 0.519 . . . . 1.0 110.751 -179.66 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.528 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.3 mmt180 -133.59 -39.87 0.89 Allowed 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 114.886 -1.052 . . . . 1.0 112.654 -177.019 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.727 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -123.1 136.08 54.65 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 122.061 0.934 . . . . 1.0 111.136 -179.036 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' C ' ' A' ' 118' ' ' PHE . 20.3 mmm180 -72.44 -70.09 0.36 Allowed 'General case' 0 C--N 1.315 -0.898 0 O-C-N 121.059 -1.026 . . . . 1.0 110.367 -178.438 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.672 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 61.0 m-85 -31.51 143.0 0.02 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 O-C-N 123.618 0.574 . . . . 1.0 110.187 179.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -105.03 6.79 33.65 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.998 0.428 . . . . 1.0 110.522 -178.409 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -139.74 139.86 36.61 Favored 'General case' 0 C--N 1.331 -0.203 0 CA-C-N 115.929 -0.578 . . . . 1.0 110.937 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.726 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 42.0 mm -120.11 120.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 CA-C-N 115.385 -0.825 . . . . 1.0 109.108 178.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 38.8 m-70 -110.59 22.29 15.6 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.884 -0.598 . . . . 1.0 111.584 -178.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.478 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.8 p 169.08 151.71 0.03 OUTLIER 'General case' 0 CA--C 1.516 -0.344 0 CA-C-O 121.071 0.463 . . . . 1.0 110.015 179.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.475 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.0 OUTLIER -161.96 157.11 23.24 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-N 115.62 -0.718 . . . . 1.0 110.183 -178.528 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.68 HD22 HD11 ' A' ' 127' ' ' LEU . 11.4 t30 -125.01 117.67 24.53 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 109.815 -0.439 . . . . 1.0 109.815 179.567 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.515 HG22 HD12 ' A' ' 90' ' ' ILE . 22.0 t -101.59 105.07 17.26 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.164 0 N-CA-C 109.597 -0.52 . . . . 1.0 109.597 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.902 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.8 OUTLIER -78.54 -40.95 33.51 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.787 -0.642 . . . . 1.0 111.494 -179.751 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.7 mm-40 -139.69 167.3 22.42 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.443 0.639 . . . . 1.0 110.633 -178.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 44.26 -179.49 0.01 OUTLIER Glycine 0 C--N 1.315 -0.637 0 CA-C-N 113.911 -1.495 . . . . 1.0 110.897 179.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 20.2 m -119.4 149.63 41.52 Favored 'General case' 0 N--CA 1.465 0.297 0 N-CA-C 109.358 -0.608 . . . . 1.0 109.358 179.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.459 ' N ' ' CD1' ' A' ' 131' ' ' TRP . 37.2 m95 -121.61 167.19 13.18 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.822 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.613 HG12 ' O ' ' A' ' 168' ' ' ARG . 2.0 p -141.8 96.5 0.7 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.386 0 C-N-CA 120.911 -0.315 . . . . 1.0 110.917 178.853 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 7.7 mt -66.53 142.63 57.45 Favored 'General case' 0 CA--C 1.515 -0.403 0 C-N-CA 120.389 -0.524 . . . . 1.0 110.966 -178.115 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 57.0 m-85 -117.8 129.96 55.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.731 -0.668 . . . . 1.0 109.773 178.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.7 tt0 -43.21 -49.11 6.62 Favored 'General case' 0 CA--C 1.516 -0.344 0 CA-C-N 115.994 -0.548 . . . . 1.0 111.053 -179.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.527 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.39 175.45 7.1 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.197 0.522 . . . . 1.0 110.559 -179.122 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 13.2 p -81.81 172.78 12.94 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 115.562 -0.745 . . . . 1.0 110.508 179.625 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 38.4 m-20 63.44 17.65 10.47 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.29 -0.868 . . . . 1.0 110.278 -179.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.419 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 7.4 m-85 36.29 77.89 0.04 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 116.174 -0.467 . . . . 1.0 111.71 179.675 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.45 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 52.9 ttm-85 -147.0 39.87 1.04 Allowed 'General case' 0 N--CA 1.471 0.607 0 CA-C-O 120.953 0.406 . . . . 1.0 110.64 179.74 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.452 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -154.51 -138.62 2.65 Favored Glycine 0 CA--C 1.524 0.608 0 N-CA-C 111.105 -0.798 . . . . 1.0 111.105 -178.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -79.27 169.59 17.89 Favored 'General case' 0 C--N 1.333 -0.142 0 CA-C-O 120.93 0.395 . . . . 1.0 110.246 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -148.94 137.91 21.41 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.747 -178.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . 0.448 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 17.8 m-85 -125.48 137.97 53.98 Favored 'General case' 0 C--O 1.22 -0.452 0 N-CA-C 108.609 -0.886 . . . . 1.0 108.609 177.979 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.585 ' C ' HD22 ' A' ' 146' ' ' LEU . 38.5 tp -95.05 126.37 40.34 Favored 'General case' 0 CA--C 1.517 -0.29 0 CA-C-O 121.339 0.59 . . . . 1.0 111.149 -178.898 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.838 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.6 mm? -114.33 109.31 18.14 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.208 -0.905 . . . . 1.0 109.832 179.616 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 2.0 mpp? -83.26 166.66 33.76 Favored Pre-proline 0 CA--C 1.535 0.381 0 CA-C-N 116.295 -0.411 . . . . 1.0 110.1 -179.682 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -62.01 114.03 2.13 Favored 'Trans proline' 0 N--CA 1.495 1.575 0 C-N-CA 121.979 1.786 . . . . 1.0 111.223 177.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.43 -150.87 11.3 Favored Glycine 0 CA--C 1.526 0.752 0 N-CA-C 110.587 -1.005 . . . . 1.0 110.587 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 66.6 t0 -128.56 134.62 48.68 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-O 120.815 0.34 . . . . 1.0 110.551 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 26.6 m-85 -125.95 131.4 52.29 Favored 'General case' 0 N--CA 1.465 0.299 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.209 -179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 92.7 mtt180 -117.22 -1.31 11.86 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-O 120.952 0.406 . . . . 1.0 110.419 -179.852 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.678 HH21 ' NE2' ' A' ' 155' ' ' GLN . 13.4 ptm180 -157.16 165.3 36.37 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.892 -0.595 . . . . 1.0 110.402 179.649 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.458 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 14.4 p90 -79.39 -20.77 46.82 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.261 -0.881 . . . . 1.0 112.253 -177.772 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.678 ' NE2' HH21 ' A' ' 153' ' ' ARG . 51.8 mt-30 -68.6 -19.61 64.46 Favored 'General case' 0 C--N 1.327 -0.402 0 CA-C-N 116.204 -0.453 . . . . 1.0 111.218 -179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.5 m-20 -51.37 -48.81 62.42 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.066 -0.515 . . . . 1.0 110.894 -179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.723 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 17.8 p90 -97.64 20.74 11.37 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.714 179.73 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.92 75.57 0.21 Allowed Glycine 0 CA--C 1.518 0.223 0 N-CA-C 111.125 -0.79 . . . . 1.0 111.125 179.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.723 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -117.84 149.59 40.58 Favored 'General case' 0 C--O 1.221 -0.436 0 CA-C-O 121.069 0.461 . . . . 1.0 110.274 179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.3 t -79.11 -12.46 60.0 Favored 'General case' 0 C--N 1.326 -0.431 0 CA-C-N 115.354 -0.839 . . . . 1.0 110.238 178.372 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.53 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 9.0 t-20 -170.5 -171.25 1.04 Allowed 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.996 0.427 . . . . 1.0 110.486 179.656 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.726 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.98 -8.83 15.14 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.624 -179.845 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -48.37 123.88 7.18 Favored 'General case' 0 N--CA 1.446 -0.625 0 CA-C-O 121.498 0.666 . . . . 1.0 111.171 -178.38 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . . . . . . . . . 41.5 t -131.28 133.78 61.9 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.67 0 CA-C-N 115.215 -0.902 . . . . 1.0 109.924 178.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.518 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -111.19 -31.18 2.92 Favored Glycine 0 CA--C 1.522 0.485 0 N-CA-C 111.715 -0.554 . . . . 1.0 111.715 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 9.3 p -158.84 -169.46 2.7 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.763 0.316 . . . . 1.0 110.462 -179.483 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.547 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -173.03 138.1 0.74 Allowed 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.183 -0.462 . . . . 1.0 110.794 -179.299 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.613 ' O ' HG12 ' A' ' 132' ' ' VAL . 0.3 OUTLIER -129.6 141.96 50.84 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.57 0.7 . . . . 1.0 109.878 179.414 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.84 ' H ' ' CD ' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -77.22 145.91 37.29 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.155 178.135 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.476 ' C ' HD12 ' A' ' 171' ' ' ILE . 48.7 t -82.52 88.32 1.99 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 C-N-CA 120.691 -0.404 . . . . 1.0 111.839 -178.712 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.476 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.1 mp -144.27 111.61 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.242 0 CA-C-N 116.187 -0.46 . . . . 1.0 110.496 179.368 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -68.4 -35.52 77.77 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.776 -0.647 . . . . 1.0 110.512 179.402 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 85.0 m-85 -59.34 -78.48 0.03 OUTLIER 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.951 -179.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 63.3 m . . . . . 0 C--O 1.219 -0.503 0 CA-C-O 117.942 -1.028 . . . . 1.0 110.532 179.956 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . 0.497 ' O ' ' O ' ' A' ' 2' ' ' GLY . 12.9 pt20 . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 109.586 -0.524 . . . . 1.0 109.586 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.497 ' O ' ' O ' ' A' ' 1' ' ' GLN . . . 50.4 168.63 0.01 OUTLIER Glycine 0 C--N 1.334 0.463 0 N-CA-C 110.752 -0.939 . . . . 1.0 110.752 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.1 tttt -176.34 100.87 0.06 Allowed 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 120.498 -0.481 . . . . 1.0 110.319 178.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.409 ' HA ' ' O ' ' A' ' 37' ' ' ARG . 0.1 OUTLIER -118.89 165.38 14.26 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.223 0 CA-C-N 116.125 -0.489 . . . . 1.0 110.659 -179.401 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.472 HG22 ' CE1' ' A' ' 7' ' ' TYR . 26.9 m -124.0 120.3 32.05 Favored 'General case' 0 N--CA 1.452 -0.363 0 N-CA-C 108.542 -0.91 . . . . 1.0 108.542 177.48 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 37.4 mt -104.11 132.87 49.91 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 114.94 -1.027 . . . . 1.0 109.845 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.472 ' CE1' HG22 ' A' ' 5' ' ' THR . 67.1 m-85 -115.05 124.99 53.01 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 115.531 -0.759 . . . . 1.0 110.938 -178.58 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -52.71 -29.85 29.04 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.596 179.759 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -117.23 154.96 30.26 Favored 'General case' 0 N--CA 1.464 0.267 0 CA-C-O 121.112 0.482 . . . . 1.0 110.298 179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.41 ' O ' ' N ' ' A' ' 12' ' ' PHE . 11.5 ptm180 -59.86 -172.73 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.548 -0.751 . . . . 1.0 110.362 -179.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.11 25.71 0.27 Allowed Glycine 0 N--CA 1.461 0.336 0 N-CA-C 111.086 -0.805 . . . . 1.0 111.086 178.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.55 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 51.44 69.17 0.69 Allowed 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.527 -0.337 . . . . 1.0 110.25 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 86.9 mm-40 -131.28 -156.58 0.76 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.032 0.444 . . . . 1.0 110.521 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.12 -153.15 0.17 Allowed Glycine 0 CA--C 1.525 0.708 0 N-CA-C 111.071 -0.812 . . . . 1.0 111.071 179.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 83.8 mtp180 -69.25 148.33 49.95 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.74 0.305 . . . . 1.0 110.712 179.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 22.0 p-80 -136.64 152.57 50.56 Favored 'General case' 0 C--N 1.331 -0.202 0 CA-C-O 121.138 0.494 . . . . 1.0 110.453 -179.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.526 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.5 t80 -145.13 140.98 28.37 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.2 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.526 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 61.8 tt0 -110.3 123.63 50.17 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 116.029 -0.532 . . . . 1.0 110.269 -179.86 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.499 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.2 t -112.58 127.0 55.96 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.737 -179.805 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 4.7 t -118.06 15.52 14.16 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 116.026 -0.533 . . . . 1.0 110.481 179.487 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 36.1 p -158.89 167.58 29.03 Favored 'General case' 0 N--CA 1.452 -0.326 0 CA-C-N 116.033 -0.53 . . . . 1.0 110.458 -178.629 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.458 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 54.1 p-10 -57.75 141.36 49.01 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 115.502 -0.772 . . . . 1.0 111.388 -179.517 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.499 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.1 OUTLIER -136.43 145.14 44.91 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.198 179.693 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 18.2 p -112.16 -16.66 12.97 Favored 'General case' 0 N--CA 1.466 0.355 0 CA-C-N 115.59 -0.732 . . . . 1.0 111.735 -179.332 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.403 ' ND2' ' H ' ' A' ' 27' ' ' GLN . 0.4 OUTLIER -150.8 120.34 6.94 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.1 0.476 . . . . 1.0 110.624 -179.635 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 13.3 mt -119.1 0.11 11.19 Favored 'General case' 0 N--CA 1.464 0.271 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 31.5 mt-30 -48.41 -52.13 45.62 Favored Pre-proline 0 C--N 1.327 -0.407 0 CA-C-N 116.143 -0.481 . . . . 1.0 110.784 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.617 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 13.8 Cg_endo -54.55 -32.58 74.92 Favored 'Trans proline' 0 N--CA 1.492 1.405 0 C-N-CA 121.933 1.756 . . . . 1.0 112.22 -179.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.2 m-85 -94.37 -52.37 4.37 Favored 'General case' 0 C--N 1.333 -0.127 0 C-N-CA 120.527 -0.469 . . . . 1.0 110.555 -178.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 8.2 mt -116.95 127.07 53.86 Favored 'General case' 0 CA--C 1.518 -0.269 0 CA-C-N 115.74 -0.664 . . . . 1.0 110.714 -178.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -95.13 -10.56 30.27 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-N 115.591 -0.731 . . . . 1.0 111.47 -179.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.529 ' NH2' ' OD1' ' A' ' 74' ' ' ASP . 3.0 tpt85 -145.55 -61.97 0.34 Allowed 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.28 -0.418 . . . . 1.0 111.475 -178.333 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 52.8 t 66.83 81.32 0.2 Allowed 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 109.779 -0.452 . . . . 1.0 109.779 -178.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.517 ' OD1' ' CE1' ' A' ' 66' ' ' HIS . 2.4 t30 -96.93 1.78 50.84 Favored 'General case' 0 C--O 1.222 -0.381 0 CA-C-O 120.687 0.28 . . . . 1.0 110.966 -179.028 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.55 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.9 t -155.2 156.51 35.8 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 120.835 0.35 . . . . 1.0 110.087 179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.4 153.72 34.15 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-N 115.912 -0.585 . . . . 1.0 110.926 -179.339 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.409 ' O ' ' HA ' ' A' ' 4' ' ' ILE . 22.5 mtp180 -136.05 123.41 21.94 Favored 'General case' 0 C--O 1.206 -1.189 0 N-CA-C 109.347 -0.612 . . . . 1.0 109.347 179.456 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.542 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.5 p -109.66 132.0 59.02 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.487 0 CA-C-O 121.036 0.446 . . . . 1.0 110.259 179.133 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -85.41 -42.59 14.38 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.231 179.375 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.1 t -163.95 150.42 11.52 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 109.937 -0.394 . . . . 1.0 109.937 179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.56 177.81 42.73 Favored Glycine 0 CA--C 1.521 0.453 0 N-CA-C 110.745 -0.942 . . . . 1.0 110.745 179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 89.9 m -111.85 140.8 46.2 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.594 -0.521 . . . . 1.0 109.594 178.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.409 ' CE2' HD13 ' A' ' 81' ' ' LEU . 57.2 m95 -128.46 133.75 48.58 Favored 'General case' 0 N--CA 1.463 0.216 0 CA-C-O 121.495 0.664 . . . . 1.0 111.355 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.572 ' C ' HD12 ' A' ' 45' ' ' LEU . 27.5 tpp -107.45 129.37 54.95 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 115.294 -0.866 . . . . 1.0 109.233 178.49 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.572 HD12 ' C ' ' A' ' 44' ' ' MET . 9.9 mp -109.32 130.86 55.48 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 115.868 -0.605 . . . . 1.0 109.832 -179.239 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -111.09 130.65 55.55 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-O 120.86 0.362 . . . . 1.0 111.402 -179.589 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.634 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 9.3 pt-20 -56.69 -37.26 70.64 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-N 115.767 -0.651 . . . . 1.0 111.214 -179.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.448 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 5.2 mt-30 -106.29 153.53 40.33 Favored Pre-proline 0 C--O 1.233 0.203 0 CA-C-N 115.83 -0.623 . . . . 1.0 110.688 -178.661 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -65.26 159.23 48.21 Favored 'Trans proline' 0 C--N 1.308 -1.587 0 C-N-CA 122.386 2.058 . . . . 1.0 112.208 179.202 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.675 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.4 45.04 6.79 Favored 'General case' 0 CA--C 1.519 -0.237 0 CA-C-N 115.744 -0.662 . . . . 1.0 111.149 179.904 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 42.96 74.93 0.1 Allowed 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.419 -0.81 . . . . 1.0 110.837 -179.395 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.3 m -145.38 157.31 44.05 Favored 'General case' 0 CA--C 1.514 -0.425 0 CA-C-O 121.061 0.458 . . . . 1.0 109.867 -178.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.7 -148.15 23.47 Favored Glycine 0 N--CA 1.445 -0.713 0 C-N-CA 120.732 -0.746 . . . . 1.0 111.683 179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.634 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.7 tp -76.83 142.41 40.27 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.44 -0.38 . . . . 1.0 110.202 -179.768 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 16.2 pt20 -119.41 150.42 40.22 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 110.487 -0.19 . . . . 1.0 110.487 179.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.43 ' C ' ' SD ' ' A' ' 44' ' ' MET . 18.5 m-85 -126.18 124.15 39.82 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 116.52 -0.309 . . . . 1.0 110.771 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.406 ' C ' HD12 ' A' ' 58' ' ' LEU . 46.6 t80 -84.23 123.64 30.35 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.255 -0.43 . . . . 1.0 109.893 -179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.406 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.5 mp -118.32 147.33 43.59 Favored 'General case' 0 N--CA 1.465 0.285 0 CA-C-N 115.84 -0.618 . . . . 1.0 109.82 179.931 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.438 ' O ' ' C ' ' A' ' 60' ' ' ARG . 31.4 mtm-85 -134.74 155.02 51.3 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 115.242 -0.89 . . . . 1.0 109.89 -178.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.438 ' C ' ' O ' ' A' ' 59' ' ' ARG . 27.7 tpt85 -32.41 125.46 0.31 Allowed 'General case' 0 C--N 1.33 -0.253 0 O-C-N 123.542 0.526 . . . . 1.0 110.996 -179.92 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.542 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 153.62 -177.34 31.2 Favored Glycine 0 CA--C 1.523 0.571 0 N-CA-C 110.242 -1.143 . . . . 1.0 110.242 -179.375 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -115.6 136.18 53.33 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 120.825 0.345 . . . . 1.0 110.186 179.816 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -128.25 112.41 14.46 Favored 'General case' 0 CA--C 1.518 -0.274 0 CA-C-N 116.077 -0.51 . . . . 1.0 109.819 179.738 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.51 -4.57 55.34 Favored 'General case' 0 C--N 1.317 -0.847 0 CA-C-N 115.677 -0.692 . . . . 1.0 111.339 179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.405 ' O ' ' CG ' ' A' ' 68' ' ' GLN . 19.6 m-20 -147.14 141.94 26.81 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 109.417 -0.586 . . . . 1.0 109.417 179.361 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.517 ' CE1' ' OD1' ' A' ' 34' ' ' ASN . 29.9 p-80 -63.6 -39.92 95.61 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 120.979 0.419 . . . . 1.0 111.367 -179.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 99.4 mt-30 -54.43 -6.77 0.12 Allowed 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.803 -0.635 . . . . 1.0 110.244 178.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.496 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.3 mm-40 -83.65 -35.28 24.7 Favored 'General case' 0 N--CA 1.468 0.45 0 C-N-CA 120.676 -0.41 . . . . 1.0 111.402 -177.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.477 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.9 p90 -95.92 19.53 11.36 Favored 'General case' 0 C--N 1.313 -0.991 0 CA-C-O 119.229 -0.415 . . . . 1.0 110.978 179.56 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.45 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 48.6 mtt 81.46 12.15 0.73 Allowed 'General case' 0 N--CA 1.464 0.25 0 O-C-N 123.91 0.756 . . . . 1.0 110.35 -178.608 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.403 ' N ' ' CD1' ' A' ' 69' ' ' TRP . . . -60.14 102.39 0.35 Allowed Glycine 0 C--N 1.342 0.88 0 C-N-CA 120.548 -0.834 . . . . 1.0 111.152 179.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 44.9 mt -80.55 -34.69 35.23 Favored 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 109.79 -0.448 . . . . 1.0 109.79 177.096 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 86.8 p -121.34 109.73 15.26 Favored 'General case' 0 N--CA 1.47 0.534 0 N-CA-C 108.978 -0.749 . . . . 1.0 108.978 178.607 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.529 ' OD1' ' NH2' ' A' ' 32' ' ' ARG . 50.9 p-10 -69.58 50.84 0.1 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-N 115.964 -0.562 . . . . 1.0 110.496 -179.216 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.525 ' O ' ' C ' ' A' ' 76' ' ' VAL . 2.1 m -111.31 -47.13 3.22 Favored 'General case' 0 CA--C 1.517 -0.324 0 CA-C-N 116.548 -0.297 . . . . 1.0 111.336 -179.416 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.525 ' C ' ' O ' ' A' ' 75' ' ' SER . 1.4 p 19.6 92.66 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.766 0 O-C-N 123.979 0.799 . . . . 1.0 110.487 -179.638 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 78.8 mtt180 -102.24 8.74 40.42 Favored 'General case' 0 C--N 1.327 -0.376 0 C-N-CA 120.795 -0.362 . . . . 1.0 110.656 -177.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 15.2 p -163.81 162.69 23.89 Favored 'General case' 0 CA--C 1.518 -0.28 0 CA-C-O 121.068 0.461 . . . . 1.0 110.828 179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 13.3 p -155.34 146.88 23.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.689 -0.687 . . . . 1.0 110.273 -178.633 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.604 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 3.3 ptm180 -128.4 150.05 50.28 Favored 'General case' 0 CA--C 1.517 -0.31 0 CA-C-O 120.786 0.327 . . . . 1.0 110.455 -179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.409 HD13 ' CE2' ' A' ' 43' ' ' TRP . 38.0 tp -96.99 133.94 41.0 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.033 -0.729 . . . . 1.0 109.033 177.833 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 10.0 mt -97.18 112.7 61.6 Favored Pre-proline 0 CA--C 1.538 0.517 0 N-CA-C 109.807 -0.442 . . . . 1.0 109.807 179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_exo -50.6 149.92 12.84 Favored 'Trans proline' 0 N--CA 1.499 1.817 0 C-N-CA 122.353 2.035 . . . . 1.0 112.983 -179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 79.0 m80 -71.82 -178.07 2.18 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.515 -0.766 . . . . 1.0 110.32 179.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.0 m -163.98 157.93 19.05 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.207 -0.452 . . . . 1.0 110.747 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.98 -76.62 1.33 Allowed Glycine 0 CA--C 1.52 0.37 0 N-CA-C 110.229 -1.149 . . . . 1.0 110.229 179.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.5 m -85.96 156.53 20.44 Favored 'General case' 0 CA--C 1.519 -0.234 0 N-CA-C 109.718 -0.475 . . . . 1.0 109.718 179.677 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 5.4 m170 -128.94 109.02 10.88 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 121.061 -0.256 . . . . 1.0 111.166 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 42.7 mtp180 -138.46 141.9 39.46 Favored 'General case' 0 N--CA 1.465 0.314 0 C-N-CA 120.384 -0.526 . . . . 1.0 110.516 178.469 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.486 HD12 HG22 ' A' ' 126' ' ' VAL . 19.4 tt -155.52 149.86 11.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.491 -0.322 . . . . 1.0 110.637 -179.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.518 ' HE ' ' CB ' ' A' ' 125' ' ' ASN . 22.8 ptt180 -131.47 103.94 6.7 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.558 0.694 . . . . 1.0 111.048 179.064 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.59 150.15 26.11 Favored 'General case' 0 CA--C 1.507 -0.681 0 CA-C-N 115.598 -0.728 . . . . 1.0 111.801 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.443 ' CG ' ' HA ' ' A' ' 98' ' ' TYR . 99.6 m-85 -122.55 136.93 55.01 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.26 -0.882 . . . . 1.0 111.371 -179.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.631 ' CD ' ' H ' ' A' ' 95' ' ' ARG . 0.0 OUTLIER -55.23 -52.95 61.74 Favored 'General case' 0 N--CA 1.466 0.335 0 CA-C-N 115.276 -0.875 . . . . 1.0 111.017 179.55 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.631 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 74.5 mtp180 -109.12 177.02 4.88 Favored 'General case' 0 C--N 1.341 0.235 0 CA-C-O 120.843 0.354 . . . . 1.0 110.138 -178.378 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.627 ' O ' ' O ' ' A' ' 97' ' ' ASP . 57.6 mp0 -61.1 161.17 8.97 Favored 'General case' 0 CA--C 1.508 -0.668 0 CA-C-N 115.45 -0.796 . . . . 1.0 110.229 179.861 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.767 ' O ' ' N ' ' A' ' 99' ' ' ARG . 33.9 t70 50.31 125.2 0.0 OUTLIER 'General case' 0 C--O 1.215 -0.736 0 O-C-N 124.305 1.003 . . . . 1.0 108.843 -179.223 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.485 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.6 OUTLIER -40.58 73.63 0.0 OUTLIER 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 116.026 -0.534 . . . . 1.0 111.312 -177.69 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.767 ' N ' ' O ' ' A' ' 97' ' ' ASP . 13.8 ptm180 -127.18 -159.75 0.96 Allowed 'General case' 0 CA--C 1.519 -0.214 0 N-CA-C 109.922 -0.399 . . . . 1.0 109.922 -178.257 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.404 ' O ' ' O ' ' A' ' 99' ' ' ARG . . . 36.91 -157.19 0.01 OUTLIER Glycine 0 CA--C 1.523 0.556 0 N-CA-C 111.076 -0.809 . . . . 1.0 111.076 -179.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.466 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 66.4 tp60 -65.91 148.67 51.42 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.554 0.692 . . . . 1.0 111.174 -179.287 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.0 ptm -136.64 149.17 47.82 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.34 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.519 HG21 ' CD1' ' A' ' 116' ' ' PHE . 10.3 tt -140.5 140.46 34.09 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.618 0 N-CA-C 109.437 -0.579 . . . . 1.0 109.437 178.412 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -113.71 132.09 55.94 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-O 121.369 0.604 . . . . 1.0 110.935 -179.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.485 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 96.9 m-85 -116.06 155.87 27.37 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 114.658 -1.155 . . . . 1.0 110.106 179.515 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.2 p -144.38 20.18 1.71 Allowed 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.532 179.747 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 22.1 pt-20 -159.43 -170.8 3.07 Favored 'General case' 0 C--O 1.233 0.195 0 C-N-CA 120.595 -0.442 . . . . 1.0 110.109 178.596 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.452 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 53.6 p-10 -73.82 141.83 46.15 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.08 0.467 . . . . 1.0 111.2 179.632 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.414 ' O ' ' OH ' ' A' ' 139' ' ' TYR . 2.8 m -131.17 118.91 21.14 Favored 'General case' 0 N--CA 1.465 0.288 0 N-CA-C 109.259 -0.645 . . . . 1.0 109.259 179.231 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 87.6 p -95.86 -22.42 17.47 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.513 -0.312 . . . . 1.0 111.006 -179.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 50.3 t -146.07 96.82 2.85 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-O 121.299 0.571 . . . . 1.0 111.839 -179.257 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.572 HD11 HD22 ' A' ' 167' ' ' LEU . 8.3 mt -62.45 -41.19 98.56 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.025 179.421 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -45.15 -12.58 0.02 OUTLIER 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 116.139 -0.482 . . . . 1.0 111.098 -179.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.541 ' N ' ' O ' ' A' ' 112' ' ' LEU . 64.5 t0 -96.77 -27.18 14.85 Favored 'General case' 0 C--N 1.333 -0.133 0 CA-C-O 120.958 0.409 . . . . 1.0 110.508 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.501 ' N ' ' O ' ' A' ' 112' ' ' LEU . 31.4 mmt180 -108.77 -40.64 4.99 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 116.103 -0.498 . . . . 1.0 111.497 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.519 ' CD1' HG21 ' A' ' 103' ' ' ILE . 5.9 t80 -121.94 118.52 29.07 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.208 0.528 . . . . 1.0 110.341 179.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -56.51 -69.07 0.16 Allowed 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.215 -0.902 . . . . 1.0 111.079 -179.222 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -39.72 138.46 0.74 Allowed 'General case' 0 N--CA 1.463 0.192 0 N-CA-C 110.059 -0.348 . . . . 1.0 110.059 -179.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -99.81 -0.41 39.85 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 116.515 -0.312 . . . . 1.0 111.038 -179.04 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 11.2 mp0 -125.52 138.36 53.97 Favored 'General case' 0 N--CA 1.466 0.365 0 CA-C-O 121.538 0.685 . . . . 1.0 110.854 -179.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.5 mm -121.17 119.01 58.0 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.32 0 CA-C-N 114.973 -1.012 . . . . 1.0 109.617 178.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.417 ' O ' ' CB ' ' A' ' 123' ' ' SER . 23.0 m-70 -110.92 22.02 15.8 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.694 -0.685 . . . . 1.0 111.675 -178.802 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.565 ' C ' HD13 ' A' ' 124' ' ' LEU . 1.8 p 166.97 152.52 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.311 0 CA-C-O 120.865 0.364 . . . . 1.0 110.651 179.493 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.653 HD13 ' N ' ' A' ' 124' ' ' LEU . 0.0 OUTLIER -162.32 163.94 27.71 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.557 -179.518 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.518 ' CB ' ' HE ' ' A' ' 91' ' ' ARG . 0.1 OUTLIER -126.92 116.06 20.24 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 109.009 -0.737 . . . . 1.0 109.009 179.634 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.486 HG22 HD12 ' A' ' 90' ' ' ILE . 58.0 t -99.72 106.38 19.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.469 0 O-C-N 123.553 0.533 . . . . 1.0 110.649 -179.636 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.896 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.99 -42.74 23.3 Favored 'General case' 0 CA--C 1.518 -0.274 0 O-C-N 124.025 0.828 . . . . 1.0 110.556 179.63 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -157.77 145.38 18.54 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 120.457 -0.497 . . . . 1.0 110.625 -179.349 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.516 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 72.6 82.83 0.29 Allowed Glycine 0 N--CA 1.451 -0.319 0 CA-C-N 115.827 -0.624 . . . . 1.0 113.061 177.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.461 ' O ' ' O ' ' A' ' 129' ' ' GLY . 13.7 t -31.51 150.24 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.288 0 CA-C-O 121.162 0.506 . . . . 1.0 110.616 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.516 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 53.3 m95 -124.12 163.49 21.4 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.802 -0.636 . . . . 1.0 111.13 -178.132 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.408 ' HA ' ' O ' ' A' ' 144' ' ' TYR . 46.4 t -134.22 137.93 50.95 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.57 0 CA-C-N 115.881 -0.6 . . . . 1.0 109.479 179.188 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.641 ' HG ' HD11 ' A' ' 146' ' ' LEU . 28.5 mt -109.02 140.39 42.6 Favored 'General case' 0 C--O 1.219 -0.522 0 N-CA-C 109.166 -0.679 . . . . 1.0 109.166 179.158 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . 0.624 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 30.8 m-85 -117.27 132.36 56.63 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.89 0.376 . . . . 1.0 110.875 179.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.439 ' OE2' ' CZ ' ' A' ' 163' ' ' ARG . 84.6 tt0 -40.7 -55.18 2.45 Favored 'General case' 0 CA--C 1.518 -0.275 0 CA-C-N 116.053 -0.522 . . . . 1.0 111.08 179.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.575 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -121.26 172.84 7.71 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 121.122 0.487 . . . . 1.0 110.098 -178.87 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.42 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 2.1 t -74.7 169.5 17.71 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.546 179.297 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . 0.42 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.9 t30 66.96 15.77 10.22 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.231 -0.895 . . . . 1.0 110.019 -178.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.414 ' OH ' ' O ' ' A' ' 109' ' ' CYS . 2.5 m-85 40.21 80.66 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.119 -0.491 . . . . 1.0 111.698 179.224 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.548 ' C ' HD11 ' A' ' 136' ' ' LEU . 61.8 ttt180 -149.89 40.57 0.81 Allowed 'General case' 0 N--CA 1.47 0.572 0 CA-C-O 121.2 0.524 . . . . 1.0 109.786 179.313 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -150.84 -140.43 3.18 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 111.281 -0.728 . . . . 1.0 111.281 -177.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.442 ' C ' HE21 ' A' ' 143' ' ' GLN . 80.7 mtp85 -76.25 171.25 14.86 Favored 'General case' 0 CA--C 1.517 -0.291 0 N-CA-C 110.121 -0.325 . . . . 1.0 110.121 179.708 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.442 HE21 ' C ' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -150.3 137.42 19.44 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.129 -0.487 . . . . 1.0 111.012 -179.706 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . 0.408 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 6.8 m-85 -127.52 141.28 51.69 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 109.195 -0.668 . . . . 1.0 109.195 178.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 59.1 tp -93.83 126.78 39.22 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.121 -0.49 . . . . 1.0 111.422 -179.266 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.641 HD11 ' HG ' ' A' ' 133' ' ' LEU . 13.4 mt -116.33 90.46 3.34 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.83 -0.623 . . . . 1.0 109.397 179.81 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.604 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.6 mtm -73.59 161.61 78.07 Favored Pre-proline 0 C--N 1.324 -0.504 0 C-N-CA 120.435 -0.506 . . . . 1.0 110.939 -178.871 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -49.94 113.58 1.05 Allowed 'Trans proline' 0 N--CA 1.491 1.349 0 C-N-CA 121.934 1.756 . . . . 1.0 111.31 178.028 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 173.08 -152.28 15.68 Favored Glycine 0 CA--C 1.529 0.915 0 N-CA-C 110.454 -1.058 . . . . 1.0 110.454 -179.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.462 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 47.0 p-10 -135.48 127.19 29.11 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-O 120.831 0.348 . . . . 1.0 111.248 -179.294 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.613 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 1.8 m-85 -118.58 133.66 55.7 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 109.385 -0.598 . . . . 1.0 109.385 179.731 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 83.3 mtp180 -112.85 -4.65 13.94 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 120.814 0.34 . . . . 1.0 110.739 179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.3 ptt180 -153.42 162.81 40.9 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.251 0.548 . . . . 1.0 110.208 179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.615 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.04 -19.83 59.85 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.134 -0.939 . . . . 1.0 112.202 -178.494 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.557 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -67.48 -20.88 65.52 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.85 -179.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 97.8 m-20 -51.64 -47.94 63.54 Favored 'General case' 0 C--N 1.308 -1.22 0 C-N-CA 120.252 -0.579 . . . . 1.0 110.793 -178.536 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.637 ' CZ3' HD11 ' A' ' 124' ' ' LEU . 37.9 p90 -101.9 18.53 20.34 Favored 'General case' 0 C--N 1.332 -0.168 0 CA-C-O 121.039 0.447 . . . . 1.0 110.305 179.881 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.69 77.85 0.13 Allowed Glycine 0 C--N 1.331 0.265 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 179.626 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.615 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . . . -96.12 -170.42 2.11 Favored 'General case' 0 CA--C 1.535 0.396 0 CA-C-O 121.093 0.473 . . . . 1.0 109.995 179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -124.09 -34.92 2.89 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.462 -0.79 . . . . 1.0 111.621 -179.16 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.673 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.6 OUTLIER -150.17 -15.81 0.25 Allowed 'General case' 0 N--CA 1.469 0.477 0 N-CA-C 111.85 0.315 . . . . 1.0 111.85 -178.86 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.745 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 88.52 -23.61 0.11 Allowed 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.787 -0.642 . . . . 1.0 110.827 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.439 ' CZ ' ' OE2' ' A' ' 135' ' ' GLU . 34.2 ptt180 -42.17 119.4 1.35 Allowed 'General case' 0 N--CA 1.451 -0.404 0 CA-C-O 121.568 0.699 . . . . 1.0 110.866 -179.315 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.745 HG23 ' O ' ' A' ' 162' ' ' ALA . 30.4 t -121.33 132.09 71.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.413 0 CA-C-N 115.504 -0.771 . . . . 1.0 109.894 179.72 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -108.73 -26.87 5.15 Favored Glycine 0 N--CA 1.465 0.608 0 N-CA-C 111.338 -0.705 . . . . 1.0 111.338 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 12.7 p -163.88 169.02 18.75 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 120.961 0.41 . . . . 1.0 110.784 -178.941 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.572 HD22 HD11 ' A' ' 112' ' ' LEU . 0.5 OUTLIER -153.32 146.38 24.58 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.899 -0.592 . . . . 1.0 111.552 -179.969 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.624 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 7.0 ptp180 -136.94 148.8 47.18 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 109.615 -0.513 . . . . 1.0 109.615 179.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.873 ' H ' HH11 ' A' ' 169' ' ' ARG . 0.0 OUTLIER -82.06 152.59 26.54 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.219 -0.901 . . . . 1.0 109.622 177.735 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.793 ' C ' HD12 ' A' ' 171' ' ' ILE . 59.2 t -85.67 85.23 2.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-O 120.935 0.398 . . . . 1.0 111.453 -179.22 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.793 HD12 ' C ' ' A' ' 170' ' ' VAL . 2.3 mp -136.65 117.86 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.267 0 CA-C-N 115.944 -0.571 . . . . 1.0 110.35 179.131 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.412 ' O ' ' OD1' ' A' ' 172' ' ' ASP . 64.0 t0 -66.9 -39.91 87.56 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.43 -0.805 . . . . 1.0 110.32 178.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -58.43 -81.41 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.364 -0.38 . . . . 1.0 110.937 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 14.3 t . . . . . 0 C--O 1.22 -0.463 0 CA-C-O 117.932 -1.032 . . . . 1.0 110.472 179.698 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 29.5 pt20 . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 109.268 -0.642 . . . . 1.0 109.268 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.568 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -91.95 178.71 40.8 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 110.504 -1.038 . . . . 1.0 110.504 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 35.3 ttmt -172.92 106.47 0.15 Allowed 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 121.062 -0.255 . . . . 1.0 110.698 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.454 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.0 OUTLIER -119.55 173.31 5.75 Favored 'Isoleucine or valine' 0 CA--C 1.52 -0.203 0 CA-C-O 120.813 0.34 . . . . 1.0 111.264 -179.311 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.543 HG22 ' CE1' ' A' ' 7' ' ' TYR . 33.5 m -130.24 120.96 25.27 Favored 'General case' 0 C--N 1.33 -0.281 0 N-CA-C 108.456 -0.942 . . . . 1.0 108.456 177.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.1 mt -105.91 133.09 51.19 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.044 -0.98 . . . . 1.0 110.058 -179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.543 ' CE1' HG22 ' A' ' 5' ' ' THR . 56.9 m-85 -114.29 129.55 56.64 Favored 'General case' 0 N--CA 1.469 0.515 0 CA-C-N 115.553 -0.749 . . . . 1.0 111.231 -178.457 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.486 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 79.4 tt0 -56.15 -20.98 19.95 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.465 -0.789 . . . . 1.0 110.324 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -127.14 154.56 44.6 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-O 121.146 0.498 . . . . 1.0 110.086 179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.436 ' O ' ' N ' ' A' ' 12' ' ' PHE . 29.0 ptt85 -58.95 -172.04 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 115.619 -0.719 . . . . 1.0 110.299 -179.444 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 41.15 26.1 0.16 Allowed Glycine 0 N--CA 1.463 0.44 0 N-CA-C 111.083 -0.807 . . . . 1.0 111.083 178.799 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.436 ' N ' ' O ' ' A' ' 10' ' ' ARG . 5.7 m-85 50.54 66.99 1.0 Allowed 'General case' 0 C--N 1.32 -0.698 0 N-CA-C 109.934 -0.395 . . . . 1.0 109.934 -179.697 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 69.4 mt-30 -126.15 -155.84 0.7 Allowed 'General case' 0 N--CA 1.47 0.573 0 CA-C-O 120.825 0.345 . . . . 1.0 110.469 -179.74 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 39.78 -149.1 0.14 Allowed Glycine 0 CA--C 1.525 0.683 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 35.2 mmt180 -71.19 149.0 46.75 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-O 120.906 0.384 . . . . 1.0 110.497 -179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -135.01 144.78 47.54 Favored 'General case' 0 C--N 1.331 -0.227 0 CA-C-N 116.011 -0.54 . . . . 1.0 110.353 -179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.561 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.5 t80 -140.94 142.34 34.39 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-N 115.344 -0.843 . . . . 1.0 110.039 -179.974 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.561 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 40.5 tt0 -110.82 122.1 47.01 Favored 'General case' 0 N--CA 1.463 0.19 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.269 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -109.46 127.21 54.24 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 116.187 -0.461 . . . . 1.0 110.513 179.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 14.9 m -117.56 14.6 14.54 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.443 179.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 95.5 p -159.62 169.17 24.34 Favored 'General case' 0 C--N 1.33 -0.243 0 CA-C-N 116.118 -0.492 . . . . 1.0 110.538 -179.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.4 ' OD1' ' N ' ' A' ' 81' ' ' LEU . 47.7 m-20 -57.82 139.88 53.06 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 115.722 -0.672 . . . . 1.0 110.884 -179.774 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -134.83 148.58 50.19 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.552 -0.749 . . . . 1.0 110.146 -179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 69.3 p -118.84 -18.84 8.8 Favored 'General case' 0 CA--C 1.512 -0.511 0 CA-C-N 115.654 -0.703 . . . . 1.0 112.07 -179.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 12.7 t30 -143.87 108.66 4.91 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-O 121.197 0.522 . . . . 1.0 109.954 -178.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 26.0 mt -111.78 0.41 16.21 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-N 115.747 -0.661 . . . . 1.0 110.172 -179.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.614 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 3.8 mt-30 -55.28 -42.97 98.71 Favored Pre-proline 0 C--N 1.33 -0.246 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.621 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.614 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 38.3 Cg_exo -58.85 -36.89 96.22 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.277 1.985 . . . . 1.0 112.029 -179.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.7 m-85 -93.33 -44.61 8.21 Favored 'General case' 0 N--CA 1.463 0.185 0 CA-C-O 120.962 0.41 . . . . 1.0 111.067 -178.769 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 12.0 mt -122.74 127.8 49.67 Favored 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 115.766 -0.652 . . . . 1.0 111.444 -178.438 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -91.44 -11.41 37.69 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 116.102 -0.499 . . . . 1.0 111.143 179.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.486 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 42.0 ttm180 -176.16 120.39 0.16 Allowed 'General case' 0 C--O 1.213 -0.848 0 N-CA-C 109.066 -0.716 . . . . 1.0 109.066 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 48.1 t -101.49 107.42 18.71 Favored 'General case' 0 C--N 1.325 -0.496 0 O-C-N 122.115 -0.366 . . . . 1.0 110.394 179.252 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 84.3 m-20 -103.56 -4.71 23.54 Favored 'General case' 0 C--O 1.218 -0.566 0 CA-C-N 116.046 -0.525 . . . . 1.0 110.375 179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 12.6 p -156.18 156.41 34.14 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 120.965 0.412 . . . . 1.0 110.333 -179.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.84 155.14 36.54 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.897 -0.592 . . . . 1.0 110.997 -179.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 13.3 mtt-85 -136.03 122.34 20.51 Favored 'General case' 0 C--O 1.209 -1.05 0 CA-C-N 115.74 -0.664 . . . . 1.0 109.567 179.199 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.481 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.4 p -110.47 129.39 65.66 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 CA-C-O 120.981 0.42 . . . . 1.0 110.948 179.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.8 t0 -81.06 -46.02 15.63 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.453 179.185 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 46.5 t -162.37 153.33 17.55 Favored 'General case' 0 N--CA 1.45 -0.436 0 N-CA-C 110.018 -0.364 . . . . 1.0 110.018 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 91.54 175.27 43.17 Favored Glycine 0 C--N 1.32 -0.357 0 N-CA-C 110.876 -0.89 . . . . 1.0 110.876 179.385 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 84.5 m -111.0 132.36 54.27 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.209 -0.663 . . . . 1.0 109.209 178.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.526 ' CE2' HD13 ' A' ' 81' ' ' LEU . 50.3 m95 -118.62 146.93 44.26 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.074 -0.512 . . . . 1.0 111.195 -179.075 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.587 ' C ' HD12 ' A' ' 45' ' ' LEU . 0.2 OUTLIER -117.99 127.18 53.57 Favored 'General case' 0 N--CA 1.462 0.167 0 N-CA-C 109.246 -0.649 . . . . 1.0 109.246 178.876 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.587 HD12 ' C ' ' A' ' 44' ' ' MET . 10.4 mp -108.27 127.38 53.8 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 109.53 -0.544 . . . . 1.0 109.53 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -103.88 131.12 51.4 Favored 'General case' 0 C--O 1.241 0.648 0 CA-C-O 121.579 0.704 . . . . 1.0 111.429 -179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.593 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 22.1 pt-20 -60.53 -35.34 75.76 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 114.908 -1.042 . . . . 1.0 109.557 -179.296 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.418 ' O ' ' OG ' ' A' ' 78' ' ' SER . 6.8 mt-30 -102.24 152.59 38.3 Favored Pre-proline 0 C--O 1.234 0.241 0 CA-C-N 115.715 -0.675 . . . . 1.0 110.066 -179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.547 ' C ' HD22 ' A' ' 50' ' ' ASN . 18.1 Cg_endo -56.94 151.16 51.01 Favored 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 121.752 1.635 . . . . 1.0 110.796 179.293 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.746 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER 70.26 -116.11 0.1 Allowed 'General case' 0 CA--C 1.513 -0.457 0 N-CA-C 108.241 -1.022 . . . . 1.0 108.241 -177.711 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.584 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 1.4 m-85 -152.83 70.94 0.9 Allowed 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 109.548 -0.538 . . . . 1.0 109.548 178.298 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.7 t -137.18 18.08 2.97 Favored 'General case' 0 CA--C 1.512 -0.492 0 CA-C-O 120.785 0.326 . . . . 1.0 110.888 -178.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -134.68 -171.18 12.42 Favored Glycine 0 CA--C 1.519 0.341 0 N-CA-C 111.069 -0.812 . . . . 1.0 111.069 -179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.593 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.2 tp -58.54 151.03 21.32 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 115.524 -0.338 . . . . 1.0 110.153 -179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.9 pt20 -121.08 149.24 43.03 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-O 120.631 0.253 . . . . 1.0 111.196 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -126.09 129.18 48.6 Favored 'General case' 0 C--N 1.343 0.32 0 CA-C-N 116.42 -0.355 . . . . 1.0 110.849 179.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.515 ' C ' HD22 ' A' ' 58' ' ' LEU . 21.8 t80 -82.94 120.43 25.68 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-O 121.419 0.628 . . . . 1.0 110.138 -178.619 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.515 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.9 mm? -110.79 133.78 53.06 Favored 'General case' 0 CA--C 1.513 -0.45 0 CA-C-N 115.135 -0.939 . . . . 1.0 109.678 -179.822 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.707 ' NH1' HH12 ' A' ' 168' ' ' ARG . 76.6 mtm180 -127.92 145.67 50.88 Favored 'General case' 0 CA--C 1.519 -0.24 0 CA-C-N 115.266 -0.879 . . . . 1.0 109.534 -179.25 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.466 ' HA ' HG13 ' A' ' 38' ' ' VAL . 73.1 ttt-85 -31.71 126.8 0.22 Allowed 'General case' 0 N--CA 1.464 0.258 0 O-C-N 123.447 0.467 . . . . 1.0 111.323 -179.589 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.481 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 152.09 -174.34 31.1 Favored Glycine 0 CA--C 1.524 0.632 0 N-CA-C 110.472 -1.051 . . . . 1.0 110.472 -179.252 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.434 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.63 133.36 56.11 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 121.004 0.43 . . . . 1.0 110.353 -179.962 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 69.1 m-85 -127.39 113.33 16.08 Favored 'General case' 0 CA--C 1.517 -0.315 0 CA-C-N 116.042 -0.526 . . . . 1.0 109.646 179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.39 -3.68 54.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-N 115.973 -0.558 . . . . 1.0 111.302 -179.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -146.63 143.48 28.84 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.395 -0.594 . . . . 1.0 109.395 179.851 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.521 ' C ' ' H ' ' A' ' 68' ' ' GLN . 22.7 p-80 -66.03 -42.43 89.63 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.98 0.419 . . . . 1.0 110.928 -179.141 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 78.4 mt-30 -52.01 -7.71 0.06 Allowed 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.802 -0.635 . . . . 1.0 110.449 179.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.521 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.5 mm-40 -82.38 -36.14 27.05 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 120.825 -0.35 . . . . 1.0 111.212 -177.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.7 p90 -93.53 19.58 8.32 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-O 119.391 -0.338 . . . . 1.0 111.007 -179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.591 ' C ' ' H ' ' A' ' 72' ' ' LEU . 66.6 mtp 79.88 17.19 0.75 Allowed 'General case' 0 C--O 1.233 0.209 0 O-C-N 123.942 0.776 . . . . 1.0 109.749 -178.858 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.573 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -64.23 29.81 0.09 OUTLIER Glycine 0 C--N 1.343 0.972 0 C-N-CA 120.898 -0.668 . . . . 1.0 112.123 179.563 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.591 ' H ' ' C ' ' A' ' 70' ' ' MET . 2.0 pp -22.47 -43.46 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.087 0.555 . . . . 1.0 110.891 -179.554 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.573 ' N ' ' O ' ' A' ' 71' ' ' GLY . 12.2 t -116.12 118.07 31.84 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 108.532 -0.914 . . . . 1.0 108.532 177.609 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.534 ' CG ' ' H ' ' A' ' 75' ' ' SER . 32.8 t0 -70.23 -158.05 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.687 -0.405 . . . . 1.0 110.028 -179.035 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.548 ' O ' ' O ' ' A' ' 47' ' ' GLU . 0.8 OUTLIER 81.78 67.2 0.02 OUTLIER 'General case' 0 C--O 1.214 -0.791 0 CA-C-O 120.741 0.305 . . . . 1.0 111.395 178.9 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 5.4 t -103.66 121.35 54.98 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.986 0 N-CA-C 109.053 -0.721 . . . . 1.0 109.053 179.11 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 87.8 mtm180 -127.94 6.25 6.02 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 115.974 -0.557 . . . . 1.0 111.477 -178.576 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.418 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 11.5 p -161.65 159.98 28.14 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.147 0.498 . . . . 1.0 110.305 179.221 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 17.6 p -155.8 146.98 22.49 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 115.7 -0.682 . . . . 1.0 110.109 -178.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.4 ptm180 -127.26 145.51 50.75 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.862 -0.421 . . . . 1.0 109.862 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.568 HD21 ' H ' ' A' ' 2' ' ' GLY . 34.3 tp -95.04 134.36 37.81 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 109.052 -0.722 . . . . 1.0 109.052 178.382 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.497 HD11 ' SD ' ' A' ' 44' ' ' MET . 2.2 mt -95.33 113.53 61.83 Favored Pre-proline 0 CA--C 1.541 0.608 0 N-CA-C 109.543 -0.54 . . . . 1.0 109.543 179.485 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.6 Cg_exo -51.24 147.54 20.76 Favored 'Trans proline' 0 N--CA 1.498 1.763 0 C-N-CA 122.257 1.971 . . . . 1.0 112.968 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.445 ' N ' ' ND1' ' A' ' 84' ' ' HIS . 2.1 m-70 -71.82 179.93 2.95 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 115.413 -0.812 . . . . 1.0 110.39 179.635 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 13.0 t -172.15 156.75 4.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.107 -0.497 . . . . 1.0 110.716 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -102.75 -59.04 0.75 Allowed Glycine 0 N--CA 1.466 0.665 0 N-CA-C 110.494 -1.043 . . . . 1.0 110.494 179.386 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m -85.89 148.06 25.97 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.767 0.318 . . . . 1.0 110.377 179.311 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.537 ' CD2' HD11 ' A' ' 171' ' ' ILE . 5.5 m80 -136.54 111.9 9.18 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 116.341 -0.39 . . . . 1.0 110.981 -179.549 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 43.5 mtm-85 -142.32 139.21 31.75 Favored 'General case' 0 C--N 1.329 -0.315 0 C-N-CA 120.755 -0.378 . . . . 1.0 110.425 178.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 20.4 tt -152.81 153.63 8.85 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.378 0 CA-C-N 116.321 -0.4 . . . . 1.0 111.063 -179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 5.8 ptm180 -133.36 112.96 12.04 Favored 'General case' 0 N--CA 1.464 0.265 0 CA-C-N 115.742 -0.663 . . . . 1.0 111.294 179.791 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.82 ' N ' HD22 ' A' ' 92' ' ' LEU . 1.5 mm? -88.92 123.47 33.3 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.419 -0.809 . . . . 1.0 109.821 -179.75 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.585 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 26.6 m-85 -100.04 135.43 41.47 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 115.308 -0.86 . . . . 1.0 110.757 -179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.486 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 3.5 tm-20 -57.2 -60.58 3.4 Favored 'General case' 0 N--CA 1.437 -1.08 0 CA-C-N 115.585 -0.734 . . . . 1.0 111.394 -179.37 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.466 ' O ' ' OG ' ' A' ' 123' ' ' SER . 84.4 mtp180 -102.2 166.8 10.39 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.225 -0.443 . . . . 1.0 110.748 -178.708 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.7 mt-10 -46.78 157.66 0.15 Allowed 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 115.641 -0.709 . . . . 1.0 110.711 178.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.65 ' O ' ' CD1' ' A' ' 98' ' ' TYR . 37.4 t70 58.03 -111.3 0.57 Allowed 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 114.749 -1.114 . . . . 1.0 110.624 -179.595 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.65 ' CD1' ' O ' ' A' ' 97' ' ' ASP . 3.9 m-85 -150.82 30.58 0.65 Allowed 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.89 -0.411 . . . . 1.0 109.89 -179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -102.17 79.78 1.9 Allowed 'General case' 0 N--CA 1.465 0.308 0 CA-C-O 121.102 0.477 . . . . 1.0 110.412 -178.635 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 161.15 -172.14 37.34 Favored Glycine 0 CA--C 1.527 0.837 0 CA-C-N 115.469 -0.787 . . . . 1.0 111.142 179.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 11.7 tp-100 -62.12 143.15 57.08 Favored 'General case' 0 CA--C 1.519 -0.246 0 C-N-CA 121.071 -0.251 . . . . 1.0 110.392 -179.959 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.585 ' SD ' ' CZ ' ' A' ' 93' ' ' TYR . 11.3 ttp -133.38 149.57 51.84 Favored 'General case' 0 N--CA 1.465 0.319 0 CA-C-N 116.202 -0.454 . . . . 1.0 110.814 179.886 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.411 ' N ' ' HG2' ' A' ' 102' ' ' MET . 11.0 tt -143.0 141.8 26.48 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.766 0 N-CA-C 109.57 -0.53 . . . . 1.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -113.93 143.98 43.81 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.394 0.616 . . . . 1.0 110.715 -179.17 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.66 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 82.6 m-85 -131.36 154.83 48.18 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.011 -0.995 . . . . 1.0 110.489 -179.64 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 22.6 p -144.52 19.85 1.69 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.805 -0.634 . . . . 1.0 111.137 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 1.019 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.0 pt-20 -167.45 83.35 0.21 Allowed 'General case' 0 C--O 1.213 -0.865 0 CA-C-O 118.025 -0.988 . . . . 1.0 109.967 179.068 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 1.019 ' O ' ' O ' ' A' ' 107' ' ' GLU . 51.9 p30 16.49 163.0 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 CA-C-O 122.359 1.076 . . . . 1.0 113.358 178.995 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.436 ' SG ' ' C ' ' A' ' 108' ' ' ASP . 8.8 m -146.66 107.17 4.07 Favored 'General case' 0 C--N 1.308 -1.235 0 O-C-N 120.18 -1.575 . . . . 1.0 109.545 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.416 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.6 p -66.33 -27.16 67.68 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 116.317 -0.401 . . . . 1.0 110.969 -179.164 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 15.7 t -142.52 88.9 2.1 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 121.13 0.491 . . . . 1.0 110.208 -179.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.66 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 11.7 tp -61.55 -41.71 97.77 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 115.553 -0.749 . . . . 1.0 110.265 -178.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.644 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 22.2 mp0 -43.15 -10.06 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 116.258 -0.428 . . . . 1.0 111.719 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.588 ' N ' ' O ' ' A' ' 112' ' ' LEU . 62.7 t0 -95.29 -21.81 18.18 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.055 0.455 . . . . 1.0 110.748 179.497 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.529 ' N ' ' O ' ' A' ' 112' ' ' LEU . 25.2 mmt85 -108.86 -36.71 6.05 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.899 0.703 . . . . 1.0 112.899 -179.033 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.706 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.16 138.37 54.24 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-O 122.2 1.0 . . . . 1.0 110.861 -179.996 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.448 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.3 mmt-85 -75.33 -73.72 0.24 Allowed 'General case' 0 C--N 1.312 -1.041 0 O-C-N 120.641 -1.287 . . . . 1.0 110.62 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.683 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.4 m-85 -31.31 144.77 0.01 OUTLIER 'General case' 0 C--O 1.218 -0.564 0 O-C-N 123.508 0.505 . . . . 1.0 110.314 179.867 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 97.6 m-20 -105.6 9.25 33.38 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-O 120.826 0.346 . . . . 1.0 111.075 -178.564 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 97.0 mt-10 -137.85 138.75 39.43 Favored 'General case' 0 N--CA 1.462 0.127 0 CA-C-N 116.008 -0.542 . . . . 1.0 111.173 -178.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.734 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.6 mm -120.98 121.35 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.435 0 CA-C-N 115.426 -0.807 . . . . 1.0 109.183 178.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 35.3 m-70 -111.24 20.74 17.05 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-N 115.883 -0.599 . . . . 1.0 111.634 -178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.466 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 3.1 p 169.85 153.83 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 121.069 0.461 . . . . 1.0 110.273 179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.434 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.5 pp -165.94 161.59 17.63 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.662 -0.699 . . . . 1.0 110.788 -178.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . 0.471 HD22 HD11 ' A' ' 127' ' ' LEU . 3.0 t30 -128.55 120.85 27.51 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 116.368 -0.378 . . . . 1.0 110.152 179.548 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . . . . . . . . . 25.0 t -100.93 105.57 17.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.262 0 N-CA-C 109.1 -0.704 . . . . 1.0 109.1 178.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.915 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.44 -42.2 30.62 Favored 'General case' 0 CA--C 1.516 -0.328 0 CA-C-N 115.932 -0.576 . . . . 1.0 111.212 -179.507 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.517 ' O ' ' O ' ' A' ' 129' ' ' GLY . 51.0 mm-40 -138.8 166.97 23.03 Favored 'General case' 0 CA--C 1.504 -0.81 0 CA-C-O 121.534 0.683 . . . . 1.0 110.498 -179.456 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.517 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 42.96 -176.99 0.01 OUTLIER Glycine 0 CA--C 1.528 0.888 0 CA-C-N 113.953 -1.476 . . . . 1.0 111.007 -179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -119.36 152.9 35.99 Favored 'General case' 0 N--CA 1.466 0.359 0 N-CA-C 109.379 -0.6 . . . . 1.0 109.379 179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 39.6 m95 -125.25 168.09 13.97 Favored 'General case' 0 CA--C 1.513 -0.456 0 CA-C-N 116.223 -0.444 . . . . 1.0 110.697 -178.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.537 HG12 ' O ' ' A' ' 168' ' ' ARG . 1.9 p -141.83 99.27 0.83 Allowed 'Isoleucine or valine' 0 C--O 1.235 0.318 0 CA-C-N 116.303 -0.408 . . . . 1.0 110.733 179.329 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 9.2 mt -67.57 141.08 56.93 Favored 'General case' 0 CA--C 1.514 -0.424 0 C-N-CA 120.275 -0.57 . . . . 1.0 110.789 -178.155 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.2 m-85 -118.51 131.63 56.23 Favored 'General case' 0 C--N 1.332 -0.158 0 CA-C-N 115.843 -0.617 . . . . 1.0 109.703 178.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 79.0 tt0 -46.93 -49.17 20.97 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.033 -0.53 . . . . 1.0 111.679 -179.178 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.53 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -123.2 175.63 6.55 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-O 121.318 0.58 . . . . 1.0 110.383 -178.957 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.7 p -82.7 170.68 14.83 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.437 -0.801 . . . . 1.0 110.355 179.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . 0.417 ' OD1' ' O ' ' A' ' 138' ' ' ASN . 41.1 t-20 66.22 17.34 10.71 Favored 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.203 -0.908 . . . . 1.0 110.261 -179.431 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 11.8 m-85 37.13 79.25 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.142 -0.481 . . . . 1.0 111.751 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.423 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 28.2 ttm180 -149.59 39.24 0.79 Allowed 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 121.026 0.441 . . . . 1.0 110.508 179.407 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.448 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -152.93 -143.11 3.61 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.374 -0.691 . . . . 1.0 111.374 -178.269 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 96.4 mtt-85 -74.41 168.45 19.68 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 120.985 0.421 . . . . 1.0 110.24 -179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.486 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 6.6 pt20 -150.57 141.35 22.76 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 115.77 -0.65 . . . . 1.0 111.449 -179.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . 0.449 ' O ' ' HA ' ' A' ' 132' ' ' VAL . 15.8 m-85 -131.02 139.33 49.95 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 108.494 -0.928 . . . . 1.0 108.494 178.747 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.617 ' C ' HD22 ' A' ' 146' ' ' LEU . 49.4 tp -92.67 126.47 37.77 Favored 'General case' 0 C--N 1.331 -0.206 0 O-C-N 123.634 0.584 . . . . 1.0 111.617 -179.258 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.826 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.7 mm? -114.83 102.71 10.25 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.437 -0.802 . . . . 1.0 109.608 179.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 3.6 mtm -81.99 164.82 46.68 Favored Pre-proline 0 C--N 1.326 -0.455 0 CA-C-N 115.849 -0.614 . . . . 1.0 110.451 -179.134 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_exo -57.62 119.28 6.44 Favored 'Trans proline' 0 N--CA 1.492 1.383 0 C-N-CA 121.968 1.779 . . . . 1.0 111.312 178.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 169.65 -153.17 21.22 Favored Glycine 0 CA--C 1.525 0.663 0 N-CA-C 110.536 -1.026 . . . . 1.0 110.536 -179.78 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.8 m-20 -128.36 132.63 48.56 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-O 120.755 0.312 . . . . 1.0 110.387 -179.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.466 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 33.5 m-85 -123.26 132.07 53.89 Favored 'General case' 0 N--CA 1.464 0.259 0 CA-C-N 116.287 -0.415 . . . . 1.0 110.003 179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -117.03 -6.72 11.39 Favored 'General case' 0 N--CA 1.467 0.38 0 N-CA-C 110.01 -0.367 . . . . 1.0 110.01 -179.928 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.9 ptp180 -153.05 163.96 38.89 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-O 121.34 0.591 . . . . 1.0 110.03 179.548 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.451 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.4 p90 -76.76 -20.55 56.35 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-N 115.061 -0.972 . . . . 1.0 112.239 -178.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -68.82 -19.64 64.28 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 120.931 0.396 . . . . 1.0 111.065 -179.425 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.0 m-20 -50.76 -49.56 57.76 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 116.136 -0.484 . . . . 1.0 110.934 -178.927 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.689 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 17.3 p90 -96.84 22.54 8.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.317 -0.402 . . . . 1.0 110.713 179.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.46 75.56 0.21 Allowed Glycine 0 CA--C 1.517 0.195 0 N-CA-C 111.223 -0.751 . . . . 1.0 111.223 179.56 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.689 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.37 147.05 43.93 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 110.26 179.591 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 14.9 t -78.21 -10.09 59.5 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.097 178.231 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.514 ' CG ' ' H ' ' A' ' 162' ' ' ALA . 8.1 t-20 -171.99 -169.15 0.63 Allowed 'General case' 0 C--N 1.322 -0.603 0 C-N-CA 120.583 -0.447 . . . . 1.0 110.259 178.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.734 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -110.28 -18.86 13.18 Favored 'General case' 0 C--O 1.219 -0.505 0 CA-C-N 116.375 -0.375 . . . . 1.0 110.659 179.884 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.402 ' C ' ' O ' ' A' ' 162' ' ' ALA . 20.0 ptp180 -37.22 123.69 0.93 Allowed 'General case' 0 N--CA 1.454 -0.271 0 CA-C-O 121.309 0.576 . . . . 1.0 111.695 -178.688 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.724 HG23 ' O ' ' A' ' 162' ' ' ALA . 22.0 t -127.32 159.84 37.13 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-N 115.567 -0.742 . . . . 1.0 110.02 179.137 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.52 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -135.27 -35.7 0.23 Allowed Glycine 0 CA--C 1.518 0.249 0 CA-C-N 115.689 -0.687 . . . . 1.0 111.543 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.416 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.6 m -158.88 -168.36 2.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 120.702 0.287 . . . . 1.0 110.278 -178.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.521 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -173.36 134.24 0.52 Allowed 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.273 -0.421 . . . . 1.0 110.472 -179.479 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.707 HH12 ' NH1' ' A' ' 59' ' ' ARG . 1.8 ttm180 -129.32 145.08 51.44 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 121.409 0.623 . . . . 1.0 109.643 179.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.421 ' H ' ' HG2' ' A' ' 169' ' ' ARG . 10.4 ptt180 -80.27 153.44 28.47 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 114.841 -1.072 . . . . 1.0 110.075 178.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.742 ' C ' HD12 ' A' ' 171' ' ' ILE . 47.9 t -90.33 86.03 2.47 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.387 0 CA-C-O 120.861 0.363 . . . . 1.0 111.851 -178.671 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.742 HD12 ' C ' ' A' ' 170' ' ' VAL . 3.0 mp -140.29 115.92 7.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.127 -0.488 . . . . 1.0 110.264 179.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -66.89 -39.12 87.36 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.712 -0.677 . . . . 1.0 110.488 179.337 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -55.77 -79.75 0.02 OUTLIER 'General case' 0 C--N 1.332 -0.181 0 CA-C-N 116.133 -0.485 . . . . 1.0 110.747 -179.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 30.5 t . . . . . 0 C--O 1.221 -0.432 0 CA-C-O 118.026 -0.988 . . . . 1.0 110.713 179.739 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 . . . . . 0 N--CA 1.489 1.492 0 N-CA-C 109.225 -0.657 . . . . 1.0 109.225 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.575 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -88.61 176.3 44.53 Favored Glycine 0 CA--C 1.523 0.558 0 N-CA-C 110.39 -1.084 . . . . 1.0 110.39 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.0 ttpt -171.7 105.06 0.2 Allowed 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 121.021 -0.271 . . . . 1.0 110.398 179.266 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.453 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -118.83 167.8 11.74 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-O 121.111 0.481 . . . . 1.0 111.399 -178.966 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.5 m -124.87 121.4 34.4 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 108.029 -1.1 . . . . 1.0 108.029 177.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.2 mt -106.39 133.82 50.49 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.015 -0.993 . . . . 1.0 110.364 -179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.479 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.6 m-85 -115.8 126.85 54.54 Favored 'General case' 0 N--CA 1.467 0.418 0 CA-C-N 115.539 -0.755 . . . . 1.0 111.256 -178.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 81.1 tt0 -53.88 -28.07 34.11 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.853 -0.612 . . . . 1.0 110.515 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.4 m-20 -119.45 151.4 38.61 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-O 121.433 0.635 . . . . 1.0 110.621 179.735 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 20.8 ptt-85 -56.87 -175.54 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.154 -0.93 . . . . 1.0 110.847 -179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.3 25.54 0.78 Allowed Glycine 0 N--CA 1.462 0.397 0 N-CA-C 110.912 -0.875 . . . . 1.0 110.912 178.887 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.9 m-85 51.61 67.16 1.0 Allowed 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 110.198 -0.297 . . . . 1.0 110.198 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 84.3 mm-40 -128.86 -157.91 0.85 Allowed 'General case' 0 N--CA 1.469 0.52 0 CA-C-O 121.085 0.469 . . . . 1.0 110.555 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 42.59 -151.31 0.31 Allowed Glycine 0 CA--C 1.526 0.736 0 N-CA-C 110.822 -0.911 . . . . 1.0 110.822 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -70.14 148.36 48.79 Favored 'General case' 0 C--N 1.33 -0.276 0 C-N-CA 120.871 -0.332 . . . . 1.0 110.87 -179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.3 p-80 -136.0 149.48 48.86 Favored 'General case' 0 CA--C 1.52 -0.177 0 CA-C-O 121.37 0.605 . . . . 1.0 110.374 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 4.4 t80 -143.95 142.45 30.75 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.255 -0.884 . . . . 1.0 110.014 -179.993 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 70.5 tt0 -110.83 121.43 45.33 Favored 'General case' 0 N--CA 1.463 0.219 0 CA-C-N 116.141 -0.481 . . . . 1.0 110.264 -179.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.8 t -108.71 126.79 53.38 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-N 116.349 -0.387 . . . . 1.0 110.739 -179.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 50.0 m -117.61 12.08 13.93 Favored 'General case' 0 N--CA 1.464 0.257 0 CA-C-N 115.751 -0.659 . . . . 1.0 110.56 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 40.5 m -157.48 168.46 27.26 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 121.177 0.513 . . . . 1.0 110.447 -179.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -58.51 140.7 53.67 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.054 -179.783 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.71 148.99 49.08 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 115.966 -0.561 . . . . 1.0 110.338 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 71.6 p -118.79 -13.54 9.54 Favored 'General case' 0 CA--C 1.515 -0.397 0 CA-C-N 115.748 -0.66 . . . . 1.0 112.047 -178.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.1 t30 -150.28 111.99 4.51 Favored 'General case' 0 C--N 1.318 -0.8 0 CA-C-O 121.314 0.578 . . . . 1.0 109.773 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.3 mt -116.02 -0.55 12.73 Favored 'General case' 0 N--CA 1.465 0.308 0 CA-C-N 115.317 -0.856 . . . . 1.0 110.402 -179.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.5 OUTLIER -53.16 -42.28 90.26 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-N 115.928 -0.578 . . . . 1.0 110.3 -179.775 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 34.3 Cg_exo -58.23 -34.91 99.04 Favored 'Trans proline' 0 C--N 1.307 -1.628 0 C-N-CA 122.03 1.82 . . . . 1.0 111.548 179.809 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.4 m-85 -95.98 -52.82 3.89 Favored 'General case' 0 N--CA 1.463 0.217 0 C-N-CA 121.037 -0.265 . . . . 1.0 111.072 -178.919 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.2 mt -118.57 127.41 53.59 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.976 -178.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -95.06 -7.52 39.31 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.794 -0.639 . . . . 1.0 111.955 -179.465 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -146.75 -60.46 0.29 Allowed 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 112.418 0.525 . . . . 1.0 112.418 -178.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 50.3 t 64.99 75.38 0.37 Allowed 'General case' 0 C--N 1.326 -0.434 0 C-N-CA 122.499 0.319 . . . . 1.0 110.158 -178.164 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 8.4 m120 -92.01 4.33 53.29 Favored 'General case' 0 C--O 1.222 -0.352 0 CA-C-N 116.264 -0.426 . . . . 1.0 111.305 -178.766 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.7 p -156.9 157.58 35.12 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 120.969 0.414 . . . . 1.0 110.19 179.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.81 154.46 32.79 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-N 115.813 -0.631 . . . . 1.0 111.336 -178.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 23.0 mtp180 -132.1 121.0 23.1 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 108.83 -0.804 . . . . 1.0 108.83 178.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 60.7 t -107.21 114.82 47.14 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.406 0 O-C-N 123.63 0.582 . . . . 1.0 110.424 -179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 36.9 m-20 -75.37 -44.37 45.34 Favored 'General case' 0 C--N 1.321 -0.666 0 CA-C-N 115.391 -0.822 . . . . 1.0 110.101 179.318 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 40.1 p -160.91 159.07 29.22 Favored 'General case' 0 N--CA 1.445 -0.683 0 N-CA-C 109.38 -0.6 . . . . 1.0 109.38 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 82.14 175.79 50.8 Favored Glycine 0 C--N 1.315 -0.586 0 N-CA-C 111.026 -0.83 . . . . 1.0 111.026 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 85.6 m -113.46 136.99 52.19 Favored 'General case' 0 C--O 1.237 0.402 0 N-CA-C 109.0 -0.741 . . . . 1.0 109.0 178.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.528 ' CE2' HD13 ' A' ' 81' ' ' LEU . 58.2 m95 -124.66 142.42 51.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.247 0.546 . . . . 1.0 111.415 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.537 ' C ' HD23 ' A' ' 45' ' ' LEU . 10.4 tpp -115.91 129.01 56.22 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.331 -0.85 . . . . 1.0 109.164 178.373 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.537 HD23 ' C ' ' A' ' 44' ' ' MET . 1.0 OUTLIER -107.97 130.17 55.07 Favored 'General case' 0 N--CA 1.464 0.236 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 -179.465 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 51.7 m-85 -104.81 131.87 51.75 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-O 121.674 0.75 . . . . 1.0 111.17 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.547 ' O ' ' O ' ' A' ' 75' ' ' SER . 0.4 OUTLIER -60.33 -33.82 72.95 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-N 114.672 -1.149 . . . . 1.0 110.808 -178.159 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.878 ' NE2' ' H ' ' A' ' 52' ' ' SER . 3.1 pp0? -108.54 154.64 41.46 Favored Pre-proline 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 1.0 108.861 -179.61 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.463 ' O ' ' OE1' ' A' ' 48' ' ' GLN . 20.9 Cg_endo -56.38 148.76 60.05 Favored 'Trans proline' 0 C--N 1.304 -1.786 0 C-N-CA 121.372 1.381 . . . . 1.0 111.621 179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.858 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.3 OUTLIER 74.83 -123.92 0.03 OUTLIER 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 108.812 -0.81 . . . . 1.0 108.812 -178.685 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.536 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.9 OUTLIER -150.83 74.65 1.17 Allowed 'General case' 0 N--CA 1.474 0.773 0 CA-C-O 121.198 0.523 . . . . 1.0 110.695 179.061 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.878 ' H ' ' NE2' ' A' ' 48' ' ' GLN . 1.4 t -142.72 20.59 2.0 Allowed 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.764 -0.653 . . . . 1.0 111.893 -177.922 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -139.2 -159.53 8.03 Favored Glycine 0 N--CA 1.46 0.282 0 N-CA-C 111.181 -0.768 . . . . 1.0 111.181 179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.596 HD21 HD21 ' A' ' 72' ' ' LEU . 46.5 tp -64.77 146.47 54.77 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 120.818 -0.353 . . . . 1.0 110.499 -178.795 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -122.73 150.5 42.67 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.721 0.296 . . . . 1.0 110.971 -179.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.574 ' OH ' HD23 ' A' ' 54' ' ' LEU . 63.7 m-85 -125.61 123.66 39.5 Favored 'General case' 0 N--CA 1.468 0.439 0 CA-C-N 116.079 -0.51 . . . . 1.0 110.569 179.785 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.629 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 46.1 t80 -83.94 121.73 27.78 Favored 'General case' 0 CA--C 1.516 -0.346 0 CA-C-O 121.237 0.541 . . . . 1.0 110.201 -178.643 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.414 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.5 mp -117.22 143.46 45.85 Favored 'General case' 0 N--CA 1.468 0.436 0 CA-C-N 115.586 -0.734 . . . . 1.0 109.972 179.793 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.436 ' O ' ' C ' ' A' ' 60' ' ' ARG . 28.6 mtt85 -129.67 153.67 47.9 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-N 115.58 -0.736 . . . . 1.0 109.398 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.436 ' C ' ' O ' ' A' ' 59' ' ' ARG . 17.0 ptm180 -32.69 127.58 0.27 Allowed 'General case' 0 CA--C 1.534 0.35 0 O-C-N 123.294 0.371 . . . . 1.0 111.431 -179.533 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 151.4 -175.47 30.26 Favored Glycine 0 CA--C 1.524 0.63 0 N-CA-C 110.814 -0.914 . . . . 1.0 110.814 -179.565 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.435 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.8 p-10 -116.2 134.2 55.18 Favored 'General case' 0 C--N 1.333 -0.146 0 CA-C-O 121.085 0.469 . . . . 1.0 110.696 -179.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 43.4 m-85 -127.57 114.56 17.56 Favored 'General case' 0 N--CA 1.464 0.254 0 CA-C-N 115.937 -0.574 . . . . 1.0 109.792 179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.414 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -93.58 -3.78 52.09 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 116.152 -0.477 . . . . 1.0 111.605 -179.264 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.414 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -147.64 142.74 27.1 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.979 -0.749 . . . . 1.0 108.979 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.511 ' C ' ' H ' ' A' ' 68' ' ' GLN . 11.6 p-80 -62.11 -46.06 90.75 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-O 121.119 0.485 . . . . 1.0 111.116 -179.175 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 96.6 mt-30 -49.22 -8.97 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.501 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.945 179.73 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.511 ' H ' ' C ' ' A' ' 66' ' ' HIS . 17.4 mm-40 -82.84 -35.32 26.43 Favored 'General case' 0 N--CA 1.465 0.296 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.193 -178.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.513 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.7 p90 -91.49 19.73 5.94 Favored 'General case' 0 CA--C 1.505 -0.754 0 CA-C-O 118.956 -0.545 . . . . 1.0 111.571 -179.582 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.513 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 61.6 mtp 87.38 8.33 0.19 Allowed 'General case' 0 N--CA 1.461 0.111 0 O-C-N 124.22 0.95 . . . . 1.0 109.368 -178.215 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -59.47 97.54 0.1 OUTLIER Glycine 0 C--N 1.341 0.813 0 N-CA-C 110.238 -1.145 . . . . 1.0 110.238 178.405 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.596 HD21 HD21 ' A' ' 54' ' ' LEU . 2.2 pp -93.36 -26.87 17.08 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 109.274 -0.639 . . . . 1.0 109.274 179.271 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 19.3 t -133.65 120.89 21.23 Favored 'General case' 0 C--O 1.232 0.136 0 N-CA-C 108.295 -1.002 . . . . 1.0 108.295 178.013 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.484 ' O ' ' CB ' ' A' ' 75' ' ' SER . 47.3 p-10 -65.65 -162.88 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.367 0 C-N-CA 120.454 -0.498 . . . . 1.0 110.029 -178.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.547 ' O ' ' O ' ' A' ' 47' ' ' GLU . 0.9 OUTLIER 84.23 67.64 0.01 OUTLIER 'General case' 0 C--O 1.216 -0.675 0 O-C-N 123.342 0.401 . . . . 1.0 111.919 178.948 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 3.8 t -99.46 114.03 36.33 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.09 0 N-CA-C 108.836 -0.802 . . . . 1.0 108.836 178.443 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.5 mtm180 -120.32 1.95 10.78 Favored 'General case' 0 C--N 1.346 0.418 0 CA-C-N 115.96 -0.563 . . . . 1.0 111.796 -178.133 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 48' ' ' GLN . 6.1 p -161.44 160.69 29.66 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.404 0.621 . . . . 1.0 110.808 178.717 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.0 p -154.32 146.33 23.6 Favored 'General case' 0 CA--C 1.513 -0.467 0 CA-C-N 115.177 -0.919 . . . . 1.0 110.034 -179.122 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -127.86 146.05 50.74 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.889 -0.411 . . . . 1.0 109.889 179.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.575 HD21 ' H ' ' A' ' 2' ' ' GLY . 31.1 tp -96.96 134.79 39.86 Favored 'General case' 0 C--N 1.322 -0.597 0 N-CA-C 108.815 -0.809 . . . . 1.0 108.815 177.87 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.45 ' H ' HD12 ' A' ' 81' ' ' LEU . 2.3 mt -96.24 111.26 55.99 Favored Pre-proline 0 CA--C 1.545 0.78 0 N-CA-C 109.485 -0.561 . . . . 1.0 109.485 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -50.62 151.41 10.57 Favored 'Trans proline' 0 N--CA 1.501 1.948 0 C-N-CA 121.872 1.715 . . . . 1.0 113.285 -179.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 77.2 m80 -70.34 -178.9 1.84 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.24 -0.891 . . . . 1.0 110.44 179.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 69.8 m -166.84 150.33 6.8 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.035 -0.529 . . . . 1.0 111.156 179.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -91.64 -73.32 1.25 Allowed Glycine 0 CA--C 1.523 0.546 0 N-CA-C 109.82 -1.312 . . . . 1.0 109.82 178.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.9 m -82.96 150.42 26.42 Favored 'General case' 0 C--N 1.332 -0.195 0 N-CA-C 109.667 -0.494 . . . . 1.0 109.667 179.115 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.589 ' CD2' HD11 ' A' ' 171' ' ' ILE . 4.5 m80 -130.28 104.73 7.45 Favored 'General case' 0 N--CA 1.467 0.421 0 C-N-CA 121.124 -0.23 . . . . 1.0 110.999 -179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 2.5 ptt180 -137.06 141.15 42.41 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 120.804 -0.359 . . . . 1.0 110.951 179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.445 HD12 HG22 ' A' ' 126' ' ' VAL . 19.9 tt -150.63 144.25 17.06 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.231 0 CA-C-N 116.157 -0.474 . . . . 1.0 111.272 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 84.6 mtp180 -120.11 97.85 5.79 Favored 'General case' 0 N--CA 1.469 0.525 0 CA-C-N 115.948 -0.569 . . . . 1.0 111.626 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 28.6 mt -78.54 142.67 37.2 Favored 'General case' 0 CA--C 1.512 -0.502 0 CA-C-N 115.966 -0.561 . . . . 1.0 109.936 179.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.511 ' CG ' ' HB3' ' A' ' 98' ' ' TYR . 38.3 m-85 -121.18 138.93 53.98 Favored 'General case' 0 C--O 1.242 0.68 0 CA-C-O 121.339 0.59 . . . . 1.0 111.801 -178.275 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.524 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 8.9 tp10 -63.1 -37.72 88.34 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.649 -0.705 . . . . 1.0 110.829 179.67 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 56.9 mtt180 -128.2 169.27 14.34 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.364 0.602 . . . . 1.0 111.075 -178.75 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.421 ' O ' ' N ' ' A' ' 98' ' ' TYR . 93.6 mt-10 -61.38 163.42 6.65 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.928 -1.033 . . . . 1.0 110.717 179.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.53 ' C ' ' CD1' ' A' ' 98' ' ' TYR . 9.9 m-20 41.53 25.71 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.989 179.474 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.547 ' CD2' ' O ' ' A' ' 98' ' ' TYR . 26.4 p90 33.54 76.97 0.04 OUTLIER 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.539 -0.755 . . . . 1.0 110.958 179.782 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -116.67 -5.46 11.62 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.554 -0.748 . . . . 1.0 111.108 -179.165 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -118.27 -144.42 7.57 Favored Glycine 0 N--CA 1.47 0.954 0 CA-C-N 115.422 -0.808 . . . . 1.0 111.189 179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 67.9 tp60 -68.16 142.91 55.58 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-O 120.752 0.31 . . . . 1.0 110.878 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.9 ptm -133.27 155.25 49.73 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 116.183 -0.462 . . . . 1.0 111.612 -179.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.511 HG21 ' CD1' ' A' ' 116' ' ' PHE . 11.8 tt -147.97 142.0 19.25 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.645 0 N-CA-C 109.817 -0.438 . . . . 1.0 109.817 178.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 84.5 tt0 -112.8 142.39 45.5 Favored 'General case' 0 N--CA 1.471 0.623 0 CA-C-O 121.809 0.814 . . . . 1.0 110.811 -179.706 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -127.12 157.05 40.73 Favored 'General case' 0 CA--C 1.518 -0.268 0 CA-C-N 114.441 -1.254 . . . . 1.0 110.506 -179.228 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 1.6 p -142.27 19.11 2.08 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.828 -0.624 . . . . 1.0 110.3 179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -164.13 -167.18 1.27 Allowed 'General case' 0 C--N 1.332 -0.157 0 CA-C-O 120.938 0.399 . . . . 1.0 110.87 178.636 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.437 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 51.2 p30 -78.9 148.4 32.73 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.262 0.553 . . . . 1.0 111.021 179.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.439 ' O ' ' OG ' ' A' ' 166' ' ' SER . 1.8 t -135.65 93.98 3.02 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 115.592 -0.731 . . . . 1.0 109.759 179.819 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.2 m -65.31 -27.68 68.78 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.618 -0.433 . . . . 1.0 111.274 -179.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . 0.501 ' O ' ' SG ' ' A' ' 111' ' ' CYS . 28.2 p -139.28 95.67 2.97 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-O 121.415 0.626 . . . . 1.0 110.849 -179.042 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.525 ' O ' ' N ' ' A' ' 114' ' ' ASP . 19.3 tp -62.47 -41.22 98.62 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.285 -0.87 . . . . 1.0 110.121 -179.573 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.596 HE21 HD22 ' A' ' 119' ' ' ASN . 27.8 mp0 -45.23 -11.96 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.327 -0.397 . . . . 1.0 111.435 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.535 ' C ' ' HE ' ' A' ' 115' ' ' ARG . 21.8 m-20 -95.07 -25.11 16.59 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.095 0.474 . . . . 1.0 110.73 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.535 ' HE ' ' C ' ' A' ' 114' ' ' ASP . 6.4 mmp_? -107.87 -41.73 4.9 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-N 115.785 -0.643 . . . . 1.0 111.937 -179.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.511 ' CD1' HG21 ' A' ' 103' ' ' ILE . 2.3 t80 -123.54 122.24 37.68 Favored 'General case' 0 N--CA 1.471 0.612 0 CA-C-O 121.217 0.532 . . . . 1.0 109.68 178.966 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 76.2 mtt-85 -61.64 -46.16 90.94 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.514 -0.766 . . . . 1.0 111.059 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.524 ' CD1' ' OE1' ' A' ' 94' ' ' GLU . 97.3 m-85 -58.05 139.67 54.12 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.691 -0.686 . . . . 1.0 109.616 -179.496 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . 0.596 HD22 HE21 ' A' ' 113' ' ' GLN . 19.3 t-20 -100.89 4.14 42.43 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.886 -179.29 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 75.0 mt-10 -135.11 141.41 46.01 Favored 'General case' 0 N--CA 1.464 0.266 0 CA-C-O 121.193 0.52 . . . . 1.0 110.913 -178.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 39.5 mm -122.94 117.25 51.2 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.502 0 CA-C-N 115.553 -0.749 . . . . 1.0 109.658 178.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.406 ' O ' ' CB ' ' A' ' 123' ' ' SER . 27.2 m-70 -105.9 27.56 8.42 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 116.188 -0.46 . . . . 1.0 112.03 -178.354 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.406 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 10.3 t 163.39 152.65 0.02 OUTLIER 'General case' 0 C--N 1.325 -0.461 0 O-C-N 123.495 0.497 . . . . 1.0 109.818 179.091 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.48 HD12 ' CD1' ' A' ' 151' ' ' TYR . 1.0 OUTLIER -163.58 158.09 20.27 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.888 -0.596 . . . . 1.0 110.476 -178.69 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.74 116.98 24.67 Favored 'General case' 0 N--CA 1.467 0.407 0 N-CA-C 109.411 -0.588 . . . . 1.0 109.411 178.838 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.445 HG22 HD12 ' A' ' 90' ' ' ILE . 39.1 t -101.63 105.58 18.16 Favored 'Isoleucine or valine' 0 C--O 1.234 0.279 0 CA-C-N 116.143 -0.481 . . . . 1.0 109.791 179.872 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.865 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -78.78 -45.1 21.78 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 115.962 -0.563 . . . . 1.0 110.725 179.633 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -156.99 149.94 23.75 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 120.745 -0.382 . . . . 1.0 111.043 -178.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.512 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 70.07 79.57 0.32 Allowed Glycine 0 C--N 1.329 0.163 0 CA-C-N 116.198 -0.456 . . . . 1.0 112.384 177.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.431 ' C ' ' O ' ' A' ' 129' ' ' GLY . 45.7 p -32.17 149.44 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.163 0 CA-C-O 121.219 0.533 . . . . 1.0 111.202 179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.512 ' CD1' ' O ' ' A' ' 129' ' ' GLY . 44.1 m95 -123.38 164.99 17.77 Favored 'General case' 0 CA--C 1.509 -0.621 0 CA-C-N 115.466 -0.788 . . . . 1.0 111.521 -178.066 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 29.0 t -131.88 133.99 60.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.246 0 N-CA-C 108.957 -0.757 . . . . 1.0 108.957 178.791 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 10.3 mt -108.47 142.22 39.17 Favored 'General case' 0 CA--C 1.514 -0.441 0 N-CA-C 109.533 -0.543 . . . . 1.0 109.533 179.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 54.9 m-85 -120.54 136.82 54.67 Favored 'General case' 0 N--CA 1.465 0.288 0 O-C-N 123.084 0.24 . . . . 1.0 110.917 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 68.9 tt0 -48.94 -44.93 41.09 Favored 'General case' 0 CA--C 1.517 -0.308 0 C-N-CA 120.474 -0.49 . . . . 1.0 111.219 179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.494 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -124.7 178.01 5.67 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-O 121.321 0.582 . . . . 1.0 110.684 -178.905 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 10.2 m -82.52 171.71 13.8 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.523 -0.762 . . . . 1.0 111.022 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 31.2 m-80 62.78 20.43 12.12 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.053 -0.976 . . . . 1.0 110.18 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.432 ' CD1' ' N ' ' A' ' 139' ' ' TYR . 1.0 OUTLIER 35.59 78.94 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 116.067 -0.515 . . . . 1.0 111.644 179.056 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.41 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 30.5 ttm180 -148.3 38.58 0.88 Allowed 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.02 0.438 . . . . 1.0 110.408 179.524 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.438 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -153.6 -137.67 2.52 Favored Glycine 0 CA--C 1.521 0.435 0 N-CA-C 111.13 -0.788 . . . . 1.0 111.13 -178.672 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 13.3 mmp_? -72.42 164.38 26.46 Favored 'General case' 0 CA--C 1.516 -0.358 0 CA-C-O 120.658 0.266 . . . . 1.0 110.439 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.629 ' OE1' ' N ' ' A' ' 57' ' ' PHE . 5.7 pt20 -149.31 139.2 21.95 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 115.886 -0.597 . . . . 1.0 110.839 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.0 m-85 -131.09 135.94 47.95 Favored 'General case' 0 N--CA 1.466 0.345 0 N-CA-C 108.698 -0.852 . . . . 1.0 108.698 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.681 HD22 ' SD ' ' A' ' 147' ' ' MET . 0.8 OUTLIER -91.13 129.45 37.13 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 121.382 0.61 . . . . 1.0 109.649 -179.642 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.627 ' N ' HD23 ' A' ' 145' ' ' LEU . 1.6 mm? -114.43 102.92 10.54 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 108.212 -1.033 . . . . 1.0 108.212 -179.277 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.681 ' SD ' HD22 ' A' ' 145' ' ' LEU . 1.8 mpp? -80.53 165.95 42.76 Favored Pre-proline 0 CA--C 1.539 0.54 0 N-CA-C 109.72 -0.474 . . . . 1.0 109.72 -179.096 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -60.53 122.99 12.15 Favored 'Trans proline' 0 N--CA 1.496 1.665 0 C-N-CA 121.624 1.55 . . . . 1.0 111.406 179.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.31 -154.14 23.78 Favored Glycine 0 CA--C 1.527 0.792 0 N-CA-C 110.647 -0.981 . . . . 1.0 110.647 -179.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 94.5 m-20 -126.46 133.4 51.22 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 120.893 0.378 . . . . 1.0 110.327 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.1 m-85 -122.94 128.25 50.0 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.549 -0.537 . . . . 1.0 109.549 179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.8 mtt-85 -114.08 -5.13 13.09 Favored 'General case' 0 N--CA 1.466 0.367 0 N-CA-C 110.341 -0.244 . . . . 1.0 110.341 -179.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 19.7 ptp180 -154.96 163.22 40.62 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-O 121.494 0.664 . . . . 1.0 110.513 179.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.556 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.02 -22.01 58.73 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 115.175 -0.92 . . . . 1.0 111.807 -178.582 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.0 OUTLIER -64.23 -22.39 66.93 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 116.134 -0.485 . . . . 1.0 111.361 -179.106 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . 0.498 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 49.2 t0 -47.59 -50.03 25.16 Favored 'General case' 0 C--N 1.315 -0.892 0 CA-C-N 116.034 -0.53 . . . . 1.0 111.333 -178.651 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.599 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.3 p90 -99.59 19.32 16.0 Favored 'General case' 0 N--CA 1.462 0.169 0 CA-C-O 121.029 0.442 . . . . 1.0 110.131 179.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 51.93 72.72 0.47 Allowed Glycine 0 CA--C 1.522 0.481 0 CA-C-N 115.654 -0.703 . . . . 1.0 111.43 179.395 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.599 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.25 -171.66 2.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.689 0.757 . . . . 1.0 110.84 179.885 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.13 -35.69 3.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 114.696 -1.138 . . . . 1.0 112.089 -178.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.597 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.2 OUTLIER -146.58 -25.55 0.42 Allowed 'General case' 0 C--N 1.327 -0.401 0 C-N-CA 121.006 -0.278 . . . . 1.0 111.64 -178.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.819 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 97.96 -19.87 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.419 0 O-C-N 124.301 1.001 . . . . 1.0 110.255 -179.664 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -42.15 116.29 0.8 Allowed 'General case' 0 CA--C 1.507 -0.678 0 CA-C-N 115.145 -0.934 . . . . 1.0 111.345 -178.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.819 HG23 ' O ' ' A' ' 162' ' ' ALA . 60.8 t -123.3 124.41 69.83 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.475 0 CA-C-N 115.656 -0.702 . . . . 1.0 109.393 178.384 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.454 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -103.42 -24.76 7.7 Favored Glycine 0 N--CA 1.462 0.407 0 N-CA-C 111.055 -0.818 . . . . 1.0 111.055 179.891 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 109' ' ' CYS . 5.7 t -160.14 171.34 19.43 Favored 'General case' 0 CA--C 1.513 -0.477 0 C-N-CA 120.644 -0.422 . . . . 1.0 110.311 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.431 ' N ' ' OG ' ' A' ' 166' ' ' SER . 0.9 OUTLIER -157.92 144.29 17.58 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-N 116.046 -0.524 . . . . 1.0 111.699 -178.998 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 3.1 ptm180 -133.42 162.35 32.1 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 109.604 -0.517 . . . . 1.0 109.604 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.465 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -96.42 153.9 17.57 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.446 -0.797 . . . . 1.0 109.261 178.922 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.424 HG21 ' OG ' ' A' ' 130' ' ' SER . 48.1 t -89.7 82.05 1.97 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 O-C-N 121.969 -0.457 . . . . 1.0 111.788 -178.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.589 HD11 ' CD2' ' A' ' 88' ' ' HIS . 1.2 mp -134.37 128.38 51.74 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.576 0 CA-C-N 116.182 -0.463 . . . . 1.0 110.166 179.734 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 23.6 p-10 -97.79 -11.19 23.61 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.705 179.499 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.432 ' CD2' HG23 ' A' ' 171' ' ' ILE . 49.5 p90 -102.64 -171.81 2.02 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.155 -0.475 . . . . 1.0 110.758 -179.888 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 5.1 t . . . . . 0 C--O 1.22 -0.499 0 CA-C-O 118.003 -0.998 . . . . 1.0 110.625 -179.896 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.327 -0.62 . . . . 1.0 109.327 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.28 174.02 42.46 Favored Glycine 0 CA--C 1.524 0.621 0 N-CA-C 110.609 -0.997 . . . . 1.0 110.609 -179.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -171.76 105.81 0.21 Allowed 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 120.856 -0.338 . . . . 1.0 110.589 179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.18 168.8 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.299 0 CA-C-O 120.908 0.385 . . . . 1.0 110.942 -178.841 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.489 HG22 ' CE1' ' A' ' 7' ' ' TYR . 28.3 m -126.28 120.73 30.7 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.263 -1.014 . . . . 1.0 108.263 176.79 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -105.4 132.91 50.99 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 115.1 -0.954 . . . . 1.0 110.242 -179.628 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.489 ' CE1' HG22 ' A' ' 5' ' ' THR . 70.6 m-85 -115.58 126.55 54.35 Favored 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 115.224 -0.898 . . . . 1.0 111.201 -178.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 83.7 tt0 -52.13 -31.66 31.96 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 115.487 -0.779 . . . . 1.0 110.464 179.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 42.9 t0 -116.75 160.26 21.05 Favored 'General case' 0 N--CA 1.465 0.306 0 CA-C-O 121.285 0.564 . . . . 1.0 110.486 179.42 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.414 ' C ' ' N ' ' A' ' 12' ' ' PHE . 11.2 ptm180 -63.87 -173.16 0.07 Allowed 'General case' 0 C--N 1.324 -0.51 0 CA-C-N 115.338 -0.846 . . . . 1.0 110.702 -179.18 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.43 24.66 0.4 Allowed Glycine 0 N--CA 1.459 0.224 0 N-CA-C 110.732 -0.947 . . . . 1.0 110.732 178.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.543 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 8.3 m-85 50.43 70.09 0.55 Allowed 'General case' 0 C--N 1.321 -0.667 0 CA-C-N 115.527 -0.336 . . . . 1.0 110.275 -179.749 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 82.5 mm-40 -131.83 -155.37 0.68 Allowed 'General case' 0 N--CA 1.469 0.481 0 CA-C-O 121.045 0.45 . . . . 1.0 110.309 179.581 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.64 -150.06 0.16 Allowed Glycine 0 CA--C 1.526 0.764 0 N-CA-C 111.036 -0.826 . . . . 1.0 111.036 179.818 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 95.9 mtt-85 -69.36 145.92 52.55 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-O 120.774 0.321 . . . . 1.0 110.682 -179.972 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.1 p-80 -135.86 149.86 49.18 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-O 121.179 0.514 . . . . 1.0 110.296 -179.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.553 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.1 t80 -144.32 141.57 29.85 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 115.36 -0.837 . . . . 1.0 110.204 179.835 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.553 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 33.0 tt0 -110.53 122.63 48.21 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 116.019 -0.537 . . . . 1.0 110.304 -179.985 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 t -109.89 126.23 53.63 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.315 -0.402 . . . . 1.0 110.638 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 83.9 p -117.99 9.55 12.81 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-N 115.934 -0.576 . . . . 1.0 110.475 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.5 p -154.91 167.1 31.42 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 115.823 -0.626 . . . . 1.0 110.713 -178.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 86.4 m-20 -58.08 137.45 56.89 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 115.557 -0.747 . . . . 1.0 111.512 -179.011 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.37 141.47 47.91 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.685 -0.689 . . . . 1.0 110.156 179.821 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 29.9 p -108.92 -14.49 14.56 Favored 'General case' 0 CA--C 1.516 -0.349 0 CA-C-N 115.679 -0.691 . . . . 1.0 111.841 -179.192 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -152.6 118.16 5.33 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.103 0.478 . . . . 1.0 110.602 -179.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.437 HD11 ' SG ' ' A' ' 79' ' ' CYS . 11.0 mt -117.46 0.84 12.25 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-N 115.582 -0.736 . . . . 1.0 110.266 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.609 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 55.5 mt-30 -48.8 -51.4 54.44 Favored Pre-proline 0 C--N 1.327 -0.393 0 CA-C-N 116.124 -0.489 . . . . 1.0 110.759 179.177 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.609 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.8 Cg_endo -55.93 -32.94 87.46 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 121.544 1.496 . . . . 1.0 112.33 -179.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -94.27 -52.02 4.54 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 120.296 -0.562 . . . . 1.0 110.644 -178.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.1 mt -117.28 127.73 54.37 Favored 'General case' 0 CA--C 1.519 -0.229 0 CA-C-N 115.832 -0.622 . . . . 1.0 110.551 -179.385 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 6.1 t -95.51 -10.23 30.29 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.527 -0.761 . . . . 1.0 111.631 -179.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -147.12 -55.32 0.24 Allowed 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.392 -0.367 . . . . 1.0 111.824 -178.36 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 27.7 t 59.96 75.48 0.4 Allowed 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 -178.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 99.3 m-20 -92.88 4.12 54.46 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-N 116.169 -0.469 . . . . 1.0 111.339 -178.656 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.543 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 1.6 t -154.69 155.44 34.6 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 120.906 0.384 . . . . 1.0 110.036 179.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.2 154.53 35.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.05 -0.523 . . . . 1.0 111.153 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 21.9 mtp180 -134.46 122.41 22.45 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 108.554 -0.906 . . . . 1.0 108.554 178.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 81.9 t -107.61 117.39 53.2 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 CA-C-O 121.276 0.56 . . . . 1.0 109.869 179.593 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -79.81 -43.33 22.64 Favored 'General case' 0 C--N 1.322 -0.625 0 CA-C-N 115.395 -0.821 . . . . 1.0 110.76 179.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 42.2 t -161.64 155.91 22.43 Favored 'General case' 0 N--CA 1.445 -0.714 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 83.48 173.87 50.0 Favored Glycine 0 C--N 1.317 -0.523 0 N-CA-C 110.97 -0.852 . . . . 1.0 110.97 179.621 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 58.2 m -110.28 140.77 44.1 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 109.456 -0.572 . . . . 1.0 109.456 178.383 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.418 ' CD1' ' CG2' ' A' ' 4' ' ' ILE . 56.1 m95 -128.3 155.76 44.12 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.322 0.582 . . . . 1.0 111.063 -179.168 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.511 ' SD ' ' OE1' ' A' ' 55' ' ' GLN . 15.7 ttm -131.17 131.28 43.94 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 108.827 -0.805 . . . . 1.0 108.827 178.358 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.495 HD23 ' C ' ' A' ' 44' ' ' MET . 0.8 OUTLIER -108.62 131.1 55.22 Favored 'General case' 0 N--CA 1.461 0.118 0 N-CA-C 108.948 -0.76 . . . . 1.0 108.948 -179.621 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.427 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 61.6 m-85 -107.37 131.54 54.14 Favored 'General case' 0 C--O 1.243 0.754 0 CA-C-O 121.725 0.774 . . . . 1.0 110.667 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.616 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.1 pt-20 -58.35 -36.35 73.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.917 -1.038 . . . . 1.0 110.974 -178.243 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.452 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.6 mt-30 -109.88 152.81 43.19 Favored Pre-proline 0 C--O 1.232 0.153 0 CA-C-N 116.104 -0.498 . . . . 1.0 110.47 -178.759 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 157.28 54.02 Favored 'Trans proline' 0 C--N 1.309 -1.545 0 C-N-CA 122.378 2.052 . . . . 1.0 112.591 178.786 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.698 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 64.86 36.57 7.73 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-N 115.261 -0.881 . . . . 1.0 110.871 -179.984 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.427 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.7 m-85 50.83 75.1 0.2 Allowed 'General case' 0 C--N 1.319 -0.73 0 CA-C-N 115.051 -0.977 . . . . 1.0 111.038 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.4 m -142.61 154.27 44.25 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-O 120.884 0.373 . . . . 1.0 110.139 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.2 -148.13 22.06 Favored Glycine 0 N--CA 1.448 -0.512 0 C-N-CA 120.854 -0.688 . . . . 1.0 111.728 179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.616 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 43.8 tp -77.9 146.81 35.36 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 115.466 -0.367 . . . . 1.0 110.597 -179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.511 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 18.0 pt20 -122.86 153.72 39.24 Favored 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 110.065 -0.346 . . . . 1.0 110.065 179.433 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.457 ' CE1' ' O ' ' A' ' 70' ' ' MET . 20.6 m-85 -129.38 129.67 45.05 Favored 'General case' 0 C--O 1.222 -0.393 0 CA-C-N 116.126 -0.488 . . . . 1.0 110.923 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.427 ' C ' HD22 ' A' ' 58' ' ' LEU . 45.6 t80 -82.53 121.22 26.51 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 121.389 0.614 . . . . 1.0 109.814 -179.44 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.427 HD22 ' C ' ' A' ' 57' ' ' PHE . 2.8 mm? -109.94 136.75 48.73 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.56 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.412 ' O ' ' C ' ' A' ' 60' ' ' ARG . 23.0 mtm-85 -129.05 154.89 46.22 Favored 'General case' 0 N--CA 1.464 0.245 0 CA-C-N 115.485 -0.779 . . . . 1.0 109.934 -179.248 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.412 ' C ' ' O ' ' A' ' 59' ' ' ARG . 78.8 ttt-85 -38.29 125.9 1.33 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 116.49 -0.323 . . . . 1.0 110.668 -179.607 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.0 -177.84 32.85 Favored Glycine 0 CA--C 1.524 0.614 0 N-CA-C 110.625 -0.99 . . . . 1.0 110.625 -179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 46.1 p-10 -116.16 125.38 52.24 Favored 'General case' 0 N--CA 1.463 0.188 0 CA-C-O 121.151 0.501 . . . . 1.0 110.517 179.992 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 52.6 m-85 -119.23 112.49 19.55 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.846 -0.615 . . . . 1.0 109.35 179.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.428 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.46 -2.43 56.27 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.923 -0.58 . . . . 1.0 111.762 -179.534 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.428 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 77.3 m-20 -149.48 131.86 15.63 Favored 'General case' 0 C--N 1.324 -0.515 0 N-CA-C 109.201 -0.666 . . . . 1.0 109.201 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.699 ' CE1' HE21 ' A' ' 67' ' ' GLN . 5.4 p80 -53.67 -37.68 63.43 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 120.974 0.416 . . . . 1.0 110.963 -179.459 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.699 HE21 ' CE1' ' A' ' 66' ' ' HIS . 98.1 mm-40 -56.4 -7.89 0.45 Allowed 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.948 -0.569 . . . . 1.0 110.537 179.406 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.419 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.6 mm-40 -82.31 -32.91 29.22 Favored 'General case' 0 N--CA 1.469 0.495 0 C-N-CA 120.546 -0.461 . . . . 1.0 111.107 -178.774 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.482 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.2 p90 -96.21 13.47 27.33 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 120.868 -0.333 . . . . 1.0 110.586 179.329 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.457 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 58.3 mtt 74.77 31.61 0.91 Allowed 'General case' 0 C--O 1.225 -0.211 0 O-C-N 124.481 1.113 . . . . 1.0 110.306 -179.215 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.552 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -72.26 43.13 0.84 Allowed Glycine 0 C--N 1.333 0.404 0 C-N-CA 120.448 -0.882 . . . . 1.0 111.877 -179.176 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.489 ' C ' ' O ' ' A' ' 71' ' ' GLY . 55.0 mt -20.27 -47.06 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.805 0 O-C-N 124.167 0.569 . . . . 1.0 110.704 -178.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.552 ' N ' ' O ' ' A' ' 71' ' ' GLY . 5.0 t -106.54 112.05 24.87 Favored 'General case' 0 N--CA 1.468 0.448 0 CA-C-N 115.595 -0.729 . . . . 1.0 109.619 177.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 49.8 p-10 -72.57 38.56 0.08 Allowed 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.15 -0.477 . . . . 1.0 110.676 -179.253 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.503 ' O ' ' HA ' ' A' ' 47' ' ' GLU . 5.2 m -113.3 74.75 0.88 Allowed 'General case' 0 C--O 1.215 -0.722 0 CA-C-N 116.007 -0.542 . . . . 1.0 110.189 -179.664 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.7 t -100.37 121.24 50.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.536 0 N-CA-C 109.585 -0.524 . . . . 1.0 109.585 179.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.0 mtm180 -128.38 4.58 5.7 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 120.813 -0.355 . . . . 1.0 111.241 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 13.4 p -163.38 162.66 25.04 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.051 0.453 . . . . 1.0 110.851 179.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . 0.437 ' SG ' HD11 ' A' ' 26' ' ' LEU . 19.2 p -153.66 144.85 22.94 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.752 -0.658 . . . . 1.0 109.744 -178.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -127.37 150.08 49.77 Favored 'General case' 0 CA--C 1.519 -0.239 0 N-CA-C 110.084 -0.339 . . . . 1.0 110.084 179.91 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.411 HD13 ' CE2' ' A' ' 43' ' ' TRP . 17.2 tp -95.37 125.84 40.26 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 107.461 -1.311 . . . . 1.0 107.461 177.506 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.403 ' N ' HD12 ' A' ' 81' ' ' LEU . 22.9 mt -78.43 114.75 45.64 Favored Pre-proline 0 CA--C 1.54 0.588 0 C-N-CA 120.539 -0.464 . . . . 1.0 110.812 -178.294 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.477 ' C ' ' CG ' ' A' ' 84' ' ' HIS . 47.9 Cg_endo -81.63 175.68 9.24 Favored 'Trans proline' 0 N--CA 1.49 1.274 0 C-N-CA 122.017 1.811 . . . . 1.0 111.755 179.804 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.578 ' CD2' ' CD ' ' A' ' 148' ' ' PRO . 22.9 m-70 84.75 127.55 0.04 OUTLIER 'General case' 0 C--N 1.332 -0.164 0 O-C-N 123.993 0.808 . . . . 1.0 112.759 177.041 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 38.6 p -158.24 16.74 0.22 Allowed 'General case' 0 C--N 1.32 -0.715 0 C-N-CA 120.622 -0.431 . . . . 1.0 111.154 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.529 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . -86.07 -124.38 1.56 Allowed Glycine 0 CA--C 1.524 0.61 0 N-CA-C 110.897 -0.881 . . . . 1.0 110.897 179.64 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 8.8 m -72.84 155.28 40.07 Favored 'General case' 0 CA--C 1.515 -0.373 0 N-CA-C 109.967 -0.383 . . . . 1.0 109.967 179.538 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.529 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 1.1 m170 -124.31 99.51 6.25 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 120.898 -0.321 . . . . 1.0 111.736 -179.318 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 45.0 mtt85 -135.4 137.67 42.52 Favored 'General case' 0 N--CA 1.468 0.442 0 C-N-CA 120.558 -0.457 . . . . 1.0 110.359 177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.522 HG22 ' CH2' ' A' ' 131' ' ' TRP . 16.8 tt -149.18 145.48 17.82 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.307 0 CA-C-N 116.604 -0.271 . . . . 1.0 111.026 -179.437 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.61 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.4 mtp180 -124.39 98.83 5.92 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 116.051 -0.522 . . . . 1.0 111.633 -179.913 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 20.5 mt -79.01 137.79 37.73 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 115.873 -0.603 . . . . 1.0 110.878 179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.589 ' CZ ' ' SD ' ' A' ' 102' ' ' MET . 44.6 m-85 -116.5 135.29 53.95 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.638 -0.71 . . . . 1.0 110.711 179.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.527 ' CG ' ' CG ' ' A' ' 118' ' ' PHE . 1.0 OUTLIER -53.97 -67.01 0.3 Allowed 'General case' 0 N--CA 1.445 -0.678 0 CA-C-N 115.852 -0.613 . . . . 1.0 111.516 179.963 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.455 ' O ' ' OG ' ' A' ' 123' ' ' SER . 77.0 mtp85 -96.03 169.45 9.96 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.871 -0.604 . . . . 1.0 110.465 -179.222 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -46.31 156.82 0.15 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.847 -0.615 . . . . 1.0 110.495 179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 60.2 m-20 54.57 -94.75 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 115.849 -0.614 . . . . 1.0 109.44 -178.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.432 ' CB ' ' CE1' ' A' ' 93' ' ' TYR . 3.6 p90 -171.99 36.84 0.01 OUTLIER 'General case' 0 C--N 1.325 -0.499 0 C-N-CA 120.3 -0.56 . . . . 1.0 110.303 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -87.39 16.42 5.4 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.096 -0.502 . . . . 1.0 110.908 -178.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -139.7 -175.53 14.31 Favored Glycine 0 CA--C 1.524 0.636 0 N-CA-C 111.013 -0.835 . . . . 1.0 111.013 -179.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 25.8 tt0 -54.55 147.95 13.24 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.847 0.356 . . . . 1.0 110.348 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.61 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 8.1 ttp -130.88 151.17 51.6 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 116.117 -0.492 . . . . 1.0 110.352 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.462 ' N ' ' HG2' ' A' ' 102' ' ' MET . 10.7 tt -146.42 141.06 20.98 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.693 0 N-CA-C 109.119 -0.697 . . . . 1.0 109.119 177.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -112.41 143.96 42.66 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-O 121.677 0.751 . . . . 1.0 110.506 -179.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.768 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 88.2 m-85 -130.52 156.49 44.72 Favored 'General case' 0 CA--C 1.517 -0.314 0 CA-C-N 114.742 -1.117 . . . . 1.0 110.678 -179.482 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 21.2 p -143.93 32.09 1.26 Allowed 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.85 -0.614 . . . . 1.0 110.731 179.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 17.2 pt-20 -171.14 -166.71 0.49 Allowed 'General case' 0 C--N 1.33 -0.26 0 C-N-CA 120.536 -0.466 . . . . 1.0 110.557 178.001 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.494 ' OD1' ' N ' ' A' ' 109' ' ' CYS . 51.8 t0 -81.78 148.11 29.06 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.503 179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.494 ' N ' ' OD1' ' A' ' 108' ' ' ASP . 1.7 t -136.96 98.61 3.8 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 115.988 -0.551 . . . . 1.0 110.165 179.564 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.402 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.2 p -68.77 -23.84 64.36 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 120.878 0.371 . . . . 1.0 111.554 -179.521 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 6.2 p -144.48 88.86 1.95 Allowed 'General case' 0 C--N 1.327 -0.389 0 CA-C-N 116.047 -0.524 . . . . 1.0 110.388 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.768 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.9 tp -60.65 -40.91 93.74 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 115.693 -0.685 . . . . 1.0 110.368 -178.322 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.63 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 17.4 mp0 -43.85 -8.91 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 115.999 -0.546 . . . . 1.0 112.072 179.773 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.556 ' N ' ' O ' ' A' ' 112' ' ' LEU . 95.9 m-20 -94.78 -22.08 18.31 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.191 0.519 . . . . 1.0 110.42 179.316 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 112' ' ' LEU . 35.5 mmt180 -107.93 -36.28 6.41 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.346 -0.843 . . . . 1.0 112.448 -178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.677 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.55 136.52 54.95 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-O 122.47 1.129 . . . . 1.0 110.812 179.72 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 15.0 mmp_? -73.43 -71.16 0.33 Allowed 'General case' 0 C--N 1.315 -0.896 0 O-C-N 120.609 -1.307 . . . . 1.0 110.669 -178.292 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.633 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 96.9 m-85 -34.2 147.88 0.02 OUTLIER 'General case' 0 C--O 1.224 -0.287 0 CA-C-N 116.082 -0.508 . . . . 1.0 110.295 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 34.5 p-10 -106.98 8.19 30.31 Favored 'General case' 0 N--CA 1.467 0.412 0 CA-C-O 120.758 0.313 . . . . 1.0 110.949 -178.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 95.8 mt-10 -138.0 139.1 39.48 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-O 121.307 0.575 . . . . 1.0 111.118 -178.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.73 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.7 mm -120.96 119.64 59.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.403 0 CA-C-N 115.438 -0.801 . . . . 1.0 109.029 177.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 36.7 m-70 -110.02 20.86 17.49 Favored 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.022 -0.535 . . . . 1.0 111.433 -178.505 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.2 p 170.94 150.76 0.04 OUTLIER 'General case' 0 C--N 1.326 -0.441 0 CA-C-O 121.089 0.471 . . . . 1.0 109.859 179.811 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.463 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.0 OUTLIER -162.11 157.26 23.05 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-N 115.659 -0.7 . . . . 1.0 110.313 -178.407 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -122.57 112.95 18.62 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 109.349 -0.612 . . . . 1.0 109.349 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.515 HG22 HD12 ' A' ' 90' ' ' ILE . 21.4 t -100.34 105.46 17.68 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.13 0 CA-C-N 116.052 -0.522 . . . . 1.0 110.048 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.882 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.6 OUTLIER -78.36 -43.04 28.72 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-N 115.915 -0.584 . . . . 1.0 110.981 179.991 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.404 ' HG3' ' N ' ' A' ' 129' ' ' GLY . 26.0 tp10 -160.54 158.82 29.81 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 120.728 -0.389 . . . . 1.0 110.913 -178.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.521 ' O ' ' CD1' ' A' ' 131' ' ' TRP . . . 68.23 76.25 0.44 Allowed Glycine 0 CA--C 1.509 -0.324 0 CA-C-N 115.796 -0.638 . . . . 1.0 112.359 178.188 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.487 ' OG ' HD11 ' A' ' 145' ' ' LEU . 30.8 t -31.71 149.18 0.01 OUTLIER 'General case' 0 C--O 1.232 0.138 0 CA-C-O 121.074 0.464 . . . . 1.0 111.021 179.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.522 ' CH2' HG22 ' A' ' 90' ' ' ILE . 33.0 m95 -124.42 169.14 12.14 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.72 -0.673 . . . . 1.0 110.835 -178.367 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 25.1 t -138.2 103.52 2.43 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.125 0 CA-C-N 116.364 -0.38 . . . . 1.0 109.995 178.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 14.7 mt -77.38 141.77 39.65 Favored 'General case' 0 N--CA 1.467 0.405 0 CA-C-N 115.979 -0.555 . . . . 1.0 110.787 -179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -120.54 133.82 55.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 116.432 -0.349 . . . . 1.0 110.618 179.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.564 ' CD ' HH21 ' A' ' 142' ' ' ARG . 48.0 tp10 -44.91 -49.95 10.74 Favored 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 116.453 -0.34 . . . . 1.0 110.634 179.687 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.77 171.06 10.97 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.411 0.624 . . . . 1.0 110.186 -179.484 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 31.6 m -75.76 179.47 5.42 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-N 115.086 -0.961 . . . . 1.0 111.12 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . 0.411 ' O ' ' C ' ' A' ' 139' ' ' TYR . 10.3 m120 58.16 21.99 8.62 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.42 -1.264 . . . . 1.0 109.555 -179.088 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.445 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.4 m-85 33.82 77.67 0.03 OUTLIER 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.95 -0.568 . . . . 1.0 111.21 179.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 59.1 ttm-85 -148.75 44.1 1.0 Allowed 'General case' 0 N--CA 1.466 0.368 0 CA-C-O 121.245 0.545 . . . . 1.0 109.859 179.729 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -153.44 -135.15 2.1 Favored Glycine 0 CA--C 1.52 0.382 0 N-CA-C 111.423 -0.671 . . . . 1.0 111.423 -179.556 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.628 HH12 ' CG2' ' A' ' 160' ' ' THR . 84.0 mtm180 -84.19 166.59 17.44 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 109.936 -0.394 . . . . 1.0 109.936 179.787 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.75 137.4 26.46 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.912 -0.586 . . . . 1.0 110.841 -179.385 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 19.2 m-85 -128.69 145.01 51.28 Favored 'General case' 0 N--CA 1.469 0.51 0 N-CA-C 109.109 -0.7 . . . . 1.0 109.109 178.825 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.554 ' C ' HD22 ' A' ' 146' ' ' LEU . 39.5 tp -94.28 122.56 36.95 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 123.479 0.487 . . . . 1.0 111.937 -179.446 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.851 HD22 ' N ' ' A' ' 146' ' ' LEU . 1.1 mm? -112.87 100.29 8.54 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 115.52 -0.764 . . . . 1.0 109.483 178.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.15 163.42 62.44 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 114.914 -1.039 . . . . 1.0 109.904 -179.37 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . 0.578 ' CD ' ' CD2' ' A' ' 84' ' ' HIS . 27.6 Cg_endo -63.67 107.23 0.7 Allowed 'Trans proline' 0 N--CA 1.494 1.505 0 C-N-CA 122.301 2.001 . . . . 1.0 111.532 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . -175.73 -153.04 9.95 Favored Glycine 0 CA--C 1.526 0.738 0 N-CA-C 110.598 -1.001 . . . . 1.0 110.598 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.453 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.0 p-10 -124.8 125.82 44.63 Favored 'General case' 0 N--CA 1.466 0.33 0 CA-C-O 121.054 0.454 . . . . 1.0 110.61 179.991 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.4 m-85 -117.84 129.59 55.75 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 115.953 -0.567 . . . . 1.0 109.83 -179.736 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 80.0 mtt85 -115.66 -4.24 12.22 Favored 'General case' 0 N--CA 1.467 0.375 0 CA-C-O 120.809 0.338 . . . . 1.0 110.134 -179.698 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 35.6 ptt-85 -155.54 161.62 40.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.618 0.723 . . . . 1.0 110.148 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.429 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 15.8 p90 -75.02 -19.2 60.17 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 114.654 -1.157 . . . . 1.0 112.227 -178.538 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . . . . . . . . . 30.4 mt-30 -70.05 -19.36 63.3 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 116.427 -0.351 . . . . 1.0 111.279 -179.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.2 m-20 -50.62 -49.14 57.44 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.048 -179.044 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.616 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 19.4 p90 -96.81 22.45 8.22 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 1.0 110.483 179.746 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.77 75.92 0.2 Allowed Glycine 0 CA--C 1.521 0.457 0 N-CA-C 111.326 -0.71 . . . . 1.0 111.326 179.379 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.616 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -122.0 145.52 48.05 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.06 0.457 . . . . 1.0 110.327 179.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . 0.628 ' CG2' HH12 ' A' ' 142' ' ' ARG . 14.7 t -74.15 -15.06 61.04 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.144 -0.934 . . . . 1.0 110.028 177.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.561 HD22 ' N ' ' A' ' 161' ' ' ASN . 0.0 OUTLIER -166.44 -167.4 1.01 Allowed 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.132 0.492 . . . . 1.0 110.308 178.915 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.73 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -109.37 -15.9 14.14 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 115.869 -0.605 . . . . 1.0 110.264 179.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -37.74 121.97 0.94 Allowed 'General case' 0 C--N 1.332 -0.175 0 CA-C-O 121.023 0.439 . . . . 1.0 111.889 -178.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.719 HG23 ' O ' ' A' ' 162' ' ' ALA . 24.7 t -125.39 158.68 33.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 CA-C-N 115.727 -0.67 . . . . 1.0 110.438 178.522 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.502 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -136.23 -36.77 0.19 Allowed Glycine 0 C--N 1.334 0.431 0 N-CA-C 111.461 -0.656 . . . . 1.0 111.461 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.402 ' OG ' ' O ' ' A' ' 110' ' ' SER . 11.4 m -156.77 -170.47 3.32 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 110.046 -0.353 . . . . 1.0 110.046 -179.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.686 HD21 HD13 ' A' ' 112' ' ' LEU . 1.9 pp -174.74 138.3 0.48 Allowed 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 116.197 -0.456 . . . . 1.0 110.492 -179.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -132.33 162.67 30.46 Favored 'General case' 0 N--CA 1.466 0.357 0 N-CA-C 109.958 -0.386 . . . . 1.0 109.958 179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.409 ' HG3' HD13 ' A' ' 171' ' ' ILE . 0.0 OUTLIER -91.76 146.24 23.93 Favored 'General case' 0 C--N 1.324 -0.542 0 N-CA-C 108.918 -0.771 . . . . 1.0 108.918 178.076 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.773 ' C ' HD12 ' A' ' 171' ' ' ILE . 42.2 t -79.22 84.62 1.14 Allowed 'Isoleucine or valine' 0 C--N 1.325 -0.486 0 CA-C-N 116.186 -0.461 . . . . 1.0 111.506 -178.652 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.773 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.9 mp -135.68 125.34 41.31 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.256 0 CA-C-O 121.076 0.465 . . . . 1.0 109.972 178.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.43 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 36.7 p-10 -71.04 -35.08 71.84 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.649 -0.705 . . . . 1.0 110.492 179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.43 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 90.2 m-85 -58.06 -79.03 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.204 -0.453 . . . . 1.0 110.698 -179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 29.3 t . . . . . 0 C--O 1.221 -0.423 0 CA-C-O 118.006 -0.997 . . . . 1.0 110.452 179.84 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.634 0 N-CA-C 109.16 -0.681 . . . . 1.0 109.16 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.539 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -171.9 -178.28 42.08 Favored Glycine 0 CA--C 1.526 0.772 0 N-CA-C 110.371 -1.092 . . . . 1.0 110.371 -179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 3.1 tttm -175.86 109.03 0.09 Allowed 'General case' 0 C--N 1.33 -0.263 0 C-N-CA 120.636 -0.426 . . . . 1.0 110.366 179.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.4 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -120.06 169.21 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.428 0 CA-C-O 120.952 0.406 . . . . 1.0 110.833 -179.08 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.467 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.9 m -127.89 119.72 26.18 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.203 -1.036 . . . . 1.0 108.203 177.568 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 56.8 mt -105.55 133.14 50.78 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.68 -1.145 . . . . 1.0 109.819 -179.473 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.467 ' CE1' HG22 ' A' ' 5' ' ' THR . 70.8 m-85 -115.1 130.09 56.84 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-N 115.623 -0.717 . . . . 1.0 111.644 -178.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.478 ' O ' ' O ' ' A' ' 32' ' ' ARG . 80.8 tt0 -54.9 -24.44 23.47 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 115.402 -0.817 . . . . 1.0 110.459 -179.817 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -125.39 161.06 27.88 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-O 121.284 0.564 . . . . 1.0 110.004 179.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.402 ' HG2' ' H ' ' A' ' 10' ' ' ARG . 8.3 ptp180 -65.28 -175.33 0.22 Allowed 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.311 -0.859 . . . . 1.0 110.929 -177.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 44.36 29.31 1.69 Allowed Glycine 0 C--N 1.335 0.482 0 N-CA-C 110.909 -0.876 . . . . 1.0 110.909 178.602 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.9 m-85 48.36 68.03 0.75 Allowed 'General case' 0 C--N 1.319 -0.749 0 CA-C-N 115.489 -0.355 . . . . 1.0 110.288 -179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.0 mt-30 -129.78 -158.5 0.89 Allowed 'General case' 0 N--CA 1.47 0.538 0 CA-C-O 120.966 0.412 . . . . 1.0 110.454 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 43.48 -148.66 0.77 Allowed Glycine 0 CA--C 1.525 0.711 0 N-CA-C 110.861 -0.895 . . . . 1.0 110.861 -179.806 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 96.9 mtt180 -72.11 148.51 45.65 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-O 120.767 0.318 . . . . 1.0 110.463 -179.997 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.0 p-80 -135.7 146.84 48.16 Favored 'General case' 0 CA--C 1.517 -0.289 0 CA-C-O 121.381 0.61 . . . . 1.0 110.256 -179.837 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.521 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 5.8 t80 -142.26 142.41 32.58 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.107 -0.951 . . . . 1.0 109.76 179.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.521 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 75.1 tt0 -111.7 123.48 50.33 Favored 'General case' 0 N--CA 1.462 0.147 0 CA-C-N 115.887 -0.597 . . . . 1.0 110.229 -179.488 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -110.6 126.54 54.57 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 116.306 -0.406 . . . . 1.0 110.67 179.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 59.3 p -118.17 11.06 13.12 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.861 -0.609 . . . . 1.0 110.425 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 34.6 p -156.45 169.36 24.8 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.913 -0.585 . . . . 1.0 110.579 -178.713 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 84.7 m-20 -58.94 136.09 57.78 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 115.786 -0.643 . . . . 1.0 111.104 -179.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.39 146.53 52.03 Favored 'General case' 0 N--CA 1.467 0.42 0 CA-C-N 115.676 -0.693 . . . . 1.0 110.423 179.832 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 82.3 p -117.52 -19.98 9.22 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.478 -0.783 . . . . 1.0 112.774 -178.724 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -141.29 106.28 4.96 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.461 0.648 . . . . 1.0 109.652 -178.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 31.5 mt -109.62 -3.38 16.9 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 115.171 -0.922 . . . . 1.0 110.058 -179.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.578 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 1.4 mt-30 -52.23 -51.11 75.09 Favored Pre-proline 0 C--N 1.331 -0.209 0 CA-C-N 115.921 -0.581 . . . . 1.0 110.735 179.487 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.578 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.0 Cg_endo -56.04 -35.08 94.21 Favored 'Trans proline' 0 N--CA 1.487 1.127 0 C-N-CA 121.22 1.28 . . . . 1.0 112.759 -179.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 2.8 m-85 -90.79 -40.97 11.49 Favored 'General case' 0 N--CA 1.463 0.198 0 C-N-CA 120.314 -0.555 . . . . 1.0 111.027 -178.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 19.4 mt -126.14 127.76 46.25 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.423 -0.808 . . . . 1.0 111.284 -178.726 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.5 t -90.36 -14.15 33.65 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 116.235 -0.439 . . . . 1.0 111.191 179.389 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.478 ' O ' ' O ' ' A' ' 8' ' ' GLU . 44.3 ttm180 -175.64 120.62 0.18 Allowed 'General case' 0 C--O 1.213 -0.819 0 N-CA-C 108.89 -0.781 . . . . 1.0 108.89 -179.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.5 t -100.22 106.36 18.03 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 120.712 0.292 . . . . 1.0 110.258 178.857 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.432 ' OD1' ' OD2' ' A' ' 74' ' ' ASP . 98.9 m-20 -101.59 -5.17 25.45 Favored 'General case' 0 C--O 1.219 -0.502 0 CA-C-N 116.341 -0.391 . . . . 1.0 110.521 179.504 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.449 ' OG ' ' C ' ' A' ' 64' ' ' ALA . 71.9 m -155.74 156.99 35.83 Favored 'General case' 0 N--CA 1.465 0.302 0 CA-C-O 120.977 0.417 . . . . 1.0 110.54 -179.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.56 155.48 37.48 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 115.826 -0.625 . . . . 1.0 110.949 -179.292 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 28.7 mtp180 -133.99 123.81 25.22 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 108.71 -0.848 . . . . 1.0 108.71 178.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 71.8 t -109.0 134.71 50.13 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.505 0 N-CA-C 109.098 -0.704 . . . . 1.0 109.098 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -97.42 -42.83 7.55 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.505 -0.771 . . . . 1.0 110.51 179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 23.1 m -161.45 160.46 29.34 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 109.426 -0.583 . . . . 1.0 109.426 179.99 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.51 176.26 48.73 Favored Glycine 0 C--N 1.316 -0.538 0 N-CA-C 111.085 -0.806 . . . . 1.0 111.085 179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 64.8 m -112.4 140.96 46.69 Favored 'General case' 0 C--N 1.328 -0.361 0 N-CA-C 108.884 -0.784 . . . . 1.0 108.884 178.225 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.619 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 48.2 m95 -127.42 150.44 49.63 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.63 -178.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.523 ' C ' HD23 ' A' ' 45' ' ' LEU . 0.8 OUTLIER -124.37 130.05 51.8 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.179 -0.674 . . . . 1.0 109.179 178.594 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.523 HD23 ' C ' ' A' ' 44' ' ' MET . 0.5 OUTLIER -109.78 131.71 54.81 Favored 'General case' 0 CA--C 1.533 0.308 0 N-CA-C 108.673 -0.862 . . . . 1.0 108.673 179.73 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 70.2 m-85 -106.19 131.45 53.43 Favored 'General case' 0 N--CA 1.473 0.693 0 CA-C-O 121.374 0.607 . . . . 1.0 111.279 -179.134 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.671 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -56.04 -34.8 66.21 Favored 'General case' 0 N--CA 1.445 -0.716 0 CA-C-N 115.398 -0.819 . . . . 1.0 110.367 -179.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 3.9 mt-30 -104.82 153.64 39.17 Favored Pre-proline 0 C--N 1.327 -0.41 0 O-C-N 121.945 -0.472 . . . . 1.0 109.918 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 19.8 Cg_endo -55.68 150.84 42.23 Favored 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 121.363 1.375 . . . . 1.0 110.873 178.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.837 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER 79.68 -122.95 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.735 0.814 . . . . 1.0 109.115 -178.82 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.525 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 15.3 m-85 -138.73 78.42 1.68 Allowed 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 116.017 -0.538 . . . . 1.0 109.907 179.218 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.0 m -152.3 163.53 39.26 Favored 'General case' 0 N--CA 1.448 -0.53 0 N-CA-C 109.738 -0.467 . . . . 1.0 109.738 -178.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 81.04 -153.16 33.81 Favored Glycine 0 N--CA 1.446 -0.639 0 CA-C-N 115.627 -0.715 . . . . 1.0 111.474 -179.906 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.671 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.3 tp -77.73 144.47 37.22 Favored 'General case' 0 N--CA 1.447 -0.588 0 CA-C-N 115.343 -0.429 . . . . 1.0 109.987 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.52 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 0.0 OUTLIER -121.41 154.17 36.87 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 120.691 0.282 . . . . 1.0 110.261 179.661 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.468 ' CE1' ' O ' ' A' ' 70' ' ' MET . 36.2 m-85 -127.04 129.56 48.27 Favored 'General case' 0 N--CA 1.467 0.378 0 CA-C-N 116.268 -0.424 . . . . 1.0 111.113 179.498 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.425 ' C ' HD22 ' A' ' 58' ' ' LEU . 36.8 t80 -81.64 119.42 23.79 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.689 -0.687 . . . . 1.0 109.704 -179.356 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.425 HD22 ' C ' ' A' ' 57' ' ' PHE . 3.3 mm? -111.36 134.42 52.96 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.148 -0.933 . . . . 1.0 109.9 -179.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.4 ' O ' ' C ' ' A' ' 60' ' ' ARG . 18.3 mtm-85 -129.52 154.84 46.63 Favored 'General case' 0 N--CA 1.464 0.235 0 CA-C-N 115.301 -0.863 . . . . 1.0 109.931 -179.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' CZ ' ' O ' ' A' ' 172' ' ' ASP . 34.5 ptt180 -36.6 128.54 0.81 Allowed 'General case' 0 CA--C 1.534 0.342 0 CA-C-O 121.186 0.517 . . . . 1.0 111.696 -179.837 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 154.18 179.92 29.88 Favored Glycine 0 CA--C 1.521 0.449 0 N-CA-C 111.117 -0.793 . . . . 1.0 111.117 -179.157 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -115.79 124.1 49.9 Favored 'General case' 0 C--N 1.331 -0.226 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 60.4 m-85 -118.92 113.5 21.12 Favored 'General case' 0 C--O 1.22 -0.487 0 N-CA-C 109.131 -0.692 . . . . 1.0 109.131 179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.449 ' C ' ' OG ' ' A' ' 35' ' ' SER . . . -93.99 3.42 55.38 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 121.015 0.436 . . . . 1.0 111.756 -179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.425 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 67.3 m-20 -152.14 140.68 20.71 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.77 -0.826 . . . . 1.0 108.77 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.659 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 5.6 p80 -64.36 -40.66 96.29 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 120.974 0.416 . . . . 1.0 110.846 -178.869 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 87.0 mt-30 -53.67 -8.17 0.14 Allowed 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.899 -0.591 . . . . 1.0 110.248 178.611 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.472 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.5 mm-40 -80.93 -32.95 34.43 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 120.43 -0.508 . . . . 1.0 111.306 -178.284 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.41 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.5 p90 -96.1 13.33 27.56 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 121.05 -0.26 . . . . 1.0 110.69 179.403 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.468 ' O ' ' CE1' ' A' ' 56' ' ' TYR . 54.9 mtt 76.26 30.01 0.71 Allowed 'General case' 0 C--N 1.331 -0.228 0 O-C-N 124.278 0.986 . . . . 1.0 109.807 -179.036 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.565 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.24 40.51 0.88 Allowed Glycine 0 C--N 1.34 0.762 0 C-N-CA 119.852 -1.166 . . . . 1.0 112.181 -179.052 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.487 ' CD1' HH12 ' A' ' 142' ' ' ARG . 19.7 mt -18.73 -47.03 0.0 OUTLIER 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.388 0.675 . . . . 1.0 111.002 -178.693 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.565 ' N ' ' O ' ' A' ' 71' ' ' GLY . 62.5 m -107.35 114.82 29.09 Favored 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.724 -0.671 . . . . 1.0 109.393 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . 0.437 ' O ' ' OD1' ' A' ' 74' ' ' ASP . 67.1 t0 -75.14 38.32 0.13 Allowed 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 116.288 -0.414 . . . . 1.0 110.274 -179.205 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.569 ' O ' ' O ' ' A' ' 47' ' ' GLU . 4.2 p -115.22 73.76 0.85 Allowed 'General case' 0 C--O 1.212 -0.88 0 CA-C-N 116.172 -0.467 . . . . 1.0 109.942 -179.109 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.5 p -114.48 131.5 66.37 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.507 0 O-C-N 123.631 0.582 . . . . 1.0 110.106 -179.546 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 86.1 mtm180 -137.39 14.25 3.0 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.743 -178.459 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 6.3 p -162.04 161.13 28.28 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 121.218 0.532 . . . . 1.0 110.795 178.461 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.2 p -155.67 146.94 22.63 Favored 'General case' 0 CA--C 1.513 -0.461 0 CA-C-N 115.471 -0.786 . . . . 1.0 110.662 -178.525 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.603 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 5.7 ptm180 -126.82 150.55 49.13 Favored 'General case' 0 CA--C 1.515 -0.371 0 N-CA-C 109.467 -0.568 . . . . 1.0 109.467 178.917 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.721 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -102.41 124.92 48.85 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.911 -1.144 . . . . 1.0 107.911 178.509 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.721 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.2 mt -84.2 116.58 65.62 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 116.333 -0.394 . . . . 1.0 110.146 -178.656 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo -52.85 148.53 28.69 Favored 'Trans proline' 0 N--CA 1.501 1.96 0 C-N-CA 121.906 1.737 . . . . 1.0 113.229 179.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.632 ' CG ' ' H ' ' A' ' 85' ' ' SER . 81.9 t60 -70.44 176.95 3.66 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.426 179.527 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.632 ' H ' ' CG ' ' A' ' 84' ' ' HIS . 2.2 t -164.75 144.7 7.34 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.296 -0.411 . . . . 1.0 110.991 -179.747 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -94.15 -64.19 1.03 Allowed Glycine 0 N--CA 1.465 0.577 0 N-CA-C 109.994 -1.242 . . . . 1.0 109.994 179.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.2 m -83.47 148.06 27.47 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 110.011 -0.366 . . . . 1.0 110.011 178.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.442 ' CD2' HD11 ' A' ' 171' ' ' ILE . 9.0 m80 -135.04 110.78 9.28 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 116.47 -0.332 . . . . 1.0 111.162 -179.207 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 53.8 mtp180 -143.54 135.61 26.75 Favored 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 120.746 -0.381 . . . . 1.0 110.068 178.101 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.5 HD12 HG22 ' A' ' 126' ' ' VAL . 17.6 tt -146.59 146.59 18.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.622 -0.263 . . . . 1.0 110.614 -179.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 89.9 mtm180 -125.88 104.89 8.56 Favored 'General case' 0 N--CA 1.467 0.423 0 O-C-N 123.488 0.492 . . . . 1.0 111.424 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.4 mp -85.42 139.07 31.82 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-O 121.416 0.627 . . . . 1.0 111.87 179.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -116.44 136.25 53.15 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-N 115.263 -0.88 . . . . 1.0 110.798 -179.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.51 ' OE1' ' CB ' ' A' ' 118' ' ' PHE . 78.2 mm-40 -55.72 -64.4 0.86 Allowed 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.455 -0.793 . . . . 1.0 112.702 -179.559 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 75.8 mtp180 -93.93 167.75 11.41 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 115.955 -0.566 . . . . 1.0 111.224 -177.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.655 ' O ' ' O ' ' A' ' 97' ' ' ASP . 96.6 mt-10 -53.68 159.62 1.54 Allowed 'General case' 0 CA--C 1.507 -0.697 0 CA-C-N 115.316 -0.857 . . . . 1.0 110.264 178.778 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.813 ' O ' ' N ' ' A' ' 99' ' ' ARG . 55.1 m-20 51.33 126.51 0.0 OUTLIER 'General case' 0 C--O 1.212 -0.893 0 N-CA-C 108.213 -1.032 . . . . 1.0 108.213 -178.514 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.507 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.4 OUTLIER -35.93 68.91 0.0 OUTLIER 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 116.143 -0.481 . . . . 1.0 112.011 -177.714 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . 0.813 ' N ' ' O ' ' A' ' 97' ' ' ASP . 74.3 mtt85 -134.82 165.83 24.37 Favored 'General case' 0 N--CA 1.455 -0.207 0 O-C-N 122.117 -0.364 . . . . 1.0 110.501 -178.349 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 79.31 -168.35 52.96 Favored Glycine 0 CA--C 1.519 0.331 0 N-CA-C 110.175 -1.17 . . . . 1.0 110.175 -179.508 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 69.6 tp60 -60.83 145.99 47.94 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.607 -0.437 . . . . 1.0 109.837 179.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 8.2 ttp -131.08 145.55 52.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.085 -0.507 . . . . 1.0 110.324 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.1 tt -138.8 138.35 42.09 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.503 0 N-CA-C 108.66 -0.867 . . . . 1.0 108.66 178.113 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 79.7 tt0 -111.59 143.66 42.1 Favored 'General case' 0 N--CA 1.468 0.466 0 CA-C-O 121.511 0.672 . . . . 1.0 110.66 -178.763 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.812 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 77.6 m-85 -129.15 153.15 47.97 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-N 114.586 -1.188 . . . . 1.0 110.537 -179.636 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 58.4 p -143.73 10.67 1.61 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.111 -0.495 . . . . 1.0 111.01 179.482 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.978 ' O ' ' O ' ' A' ' 108' ' ' ASP . 6.3 pt-20 -161.16 83.19 0.64 Allowed 'General case' 0 C--O 1.215 -0.746 0 CA-C-O 118.657 -0.687 . . . . 1.0 110.016 179.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.978 ' O ' ' O ' ' A' ' 107' ' ' GLU . 53.4 p-10 14.99 164.83 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.946 0 N-CA-C 114.021 1.119 . . . . 1.0 114.021 178.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -149.62 109.27 4.02 Favored 'General case' 0 C--N 1.316 -0.862 0 O-C-N 120.144 -1.597 . . . . 1.0 110.021 178.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 15.7 m -64.07 -31.88 73.24 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 115.574 -0.739 . . . . 1.0 110.651 -179.515 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 17.3 t -135.41 89.68 2.53 Favored 'General case' 0 N--CA 1.465 0.316 0 CA-C-O 121.246 0.546 . . . . 1.0 110.1 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.812 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.8 tp -61.4 -42.47 98.78 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.378 -0.828 . . . . 1.0 109.829 -178.843 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.406 ' HG2' ' H ' ' A' ' 113' ' ' GLN . 79.0 mm-40 -42.93 -8.31 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.864 -0.607 . . . . 1.0 112.028 179.474 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.57 ' N ' ' O ' ' A' ' 112' ' ' LEU . 47.0 t0 -97.2 -22.32 16.78 Favored 'General case' 0 N--CA 1.466 0.331 0 CA-C-O 121.118 0.485 . . . . 1.0 110.66 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.401 ' N ' ' O ' ' A' ' 112' ' ' LEU . 5.0 mmp_? -106.09 -37.21 6.68 Favored 'General case' 0 N--CA 1.468 0.473 0 N-CA-C 113.183 0.809 . . . . 1.0 113.183 -178.736 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.656 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.21 136.44 54.97 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-O 121.887 0.851 . . . . 1.0 110.128 179.96 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.423 ' O ' ' C ' ' A' ' 118' ' ' PHE . 68.6 mtt85 -72.73 -69.61 0.4 Allowed 'General case' 0 C--N 1.319 -0.718 0 O-C-N 120.632 -1.293 . . . . 1.0 110.371 -177.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.596 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 95.2 m-85 -33.54 146.77 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.427 -0.806 . . . . 1.0 110.426 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 46.4 p-10 -106.69 7.33 30.45 Favored 'General case' 0 N--CA 1.466 0.375 0 CA-C-O 120.729 0.299 . . . . 1.0 111.326 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.2 mt-10 -138.41 139.74 39.04 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-O 121.11 0.481 . . . . 1.0 111.098 -178.417 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.722 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 40.0 mm -122.9 124.92 71.47 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.474 0 CA-C-N 115.493 -0.776 . . . . 1.0 109.24 178.197 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.521 ' O ' ' OG ' ' A' ' 123' ' ' SER . 40.9 m-70 -116.0 21.62 13.62 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.543 -178.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.521 ' OG ' ' O ' ' A' ' 122' ' ' HIS . 11.4 m 171.94 153.25 0.07 Allowed 'General case' 0 CA--C 1.515 -0.39 0 CA-C-O 121.161 0.505 . . . . 1.0 110.558 179.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.471 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 2.0 pp -165.72 157.7 14.6 Favored 'General case' 0 N--CA 1.448 -0.564 0 CA-C-N 115.321 -0.854 . . . . 1.0 110.788 -178.521 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.51 120.53 31.18 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 116.067 -0.515 . . . . 1.0 110.056 -179.573 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.5 HG22 HD12 ' A' ' 90' ' ' ILE . 40.7 t -103.23 104.38 16.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.296 0 N-CA-C 109.681 -0.488 . . . . 1.0 109.681 179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.934 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -78.25 -40.68 36.43 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 115.675 -0.693 . . . . 1.0 111.231 -179.905 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.476 ' O ' ' O ' ' A' ' 129' ' ' GLY . 36.9 mm-40 -133.81 162.01 33.16 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-O 121.835 0.826 . . . . 1.0 110.933 -179.677 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.476 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 38.11 -165.51 0.01 OUTLIER Glycine 0 CA--C 1.53 0.988 0 CA-C-N 113.474 -1.694 . . . . 1.0 110.91 -179.669 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.478 ' OG ' ' CG2' ' A' ' 170' ' ' VAL . 32.1 p -119.73 162.41 19.09 Favored 'General case' 0 N--CA 1.466 0.332 0 N-CA-C 109.298 -0.631 . . . . 1.0 109.298 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -134.49 160.9 36.59 Favored 'General case' 0 CA--C 1.51 -0.572 0 CA-C-N 116.069 -0.514 . . . . 1.0 109.995 -178.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 46.6 t -132.09 139.39 50.36 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.703 0 N-CA-C 109.296 -0.631 . . . . 1.0 109.296 178.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.492 ' HG ' HD11 ' A' ' 146' ' ' LEU . 38.5 mt -111.11 141.73 44.21 Favored 'General case' 0 N--CA 1.473 0.681 0 N-CA-C 110.184 -0.302 . . . . 1.0 110.184 179.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -117.41 132.84 56.5 Favored 'General case' 0 N--CA 1.464 0.252 0 O-C-N 123.26 0.35 . . . . 1.0 110.812 179.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 78.3 tt0 -45.3 -36.85 4.33 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 116.371 -0.377 . . . . 1.0 110.725 180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.506 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -137.01 175.46 9.59 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.289 0.566 . . . . 1.0 110.767 -179.34 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 16.1 p -81.75 172.48 13.33 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 115.496 -0.775 . . . . 1.0 110.678 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 29.5 m-20 64.5 19.19 11.72 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 114.833 -1.076 . . . . 1.0 109.839 -179.032 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.511 ' CG ' ' NH2' ' A' ' 168' ' ' ARG . 13.2 m-85 35.8 79.36 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.814 -0.63 . . . . 1.0 111.919 179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . . . . . . . . . 60.6 ttt180 -148.97 38.89 0.83 Allowed 'General case' 0 N--CA 1.472 0.673 0 CA-C-O 121.393 0.616 . . . . 1.0 109.989 179.347 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.437 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -151.72 -140.8 3.21 Favored Glycine 0 CA--C 1.52 0.385 0 N-CA-C 111.406 -0.678 . . . . 1.0 111.406 -178.107 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.487 HH12 ' CD1' ' A' ' 72' ' ' LEU . 28.8 mmt180 -74.64 165.44 25.21 Favored 'General case' 0 C--N 1.328 -0.366 0 N-CA-C 109.918 -0.401 . . . . 1.0 109.918 -179.865 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.52 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 1.3 pt20 -146.83 135.3 21.93 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-N 115.902 -0.59 . . . . 1.0 110.955 -179.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . 0.408 ' HA ' ' NE2' ' A' ' 55' ' ' GLN . 7.2 m-85 -128.01 131.62 49.18 Favored 'General case' 0 N--CA 1.476 0.869 0 N-CA-C 109.593 -0.521 . . . . 1.0 109.593 178.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.457 ' HB2' ' HE2' ' A' ' 44' ' ' MET . 41.6 tp -87.72 126.37 34.94 Favored 'General case' 0 CA--C 1.513 -0.48 0 CA-C-O 121.29 0.567 . . . . 1.0 110.8 -179.534 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.492 HD11 ' HG ' ' A' ' 133' ' ' LEU . 28.6 mt -115.17 108.51 16.7 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-N 115.039 -0.982 . . . . 1.0 109.694 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.603 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 3.3 mtm -88.43 163.23 37.11 Favored Pre-proline 0 CA--C 1.536 0.431 0 C-N-CA 120.699 -0.4 . . . . 1.0 110.247 -179.603 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_exo -52.84 124.32 15.15 Favored 'Trans proline' 0 N--CA 1.492 1.439 0 C-N-CA 121.608 1.538 . . . . 1.0 111.393 178.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 165.64 -155.27 26.49 Favored Glycine 0 CA--C 1.529 0.913 0 N-CA-C 110.565 -1.014 . . . . 1.0 110.565 -179.748 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.402 ' OD1' ' N ' ' A' ' 151' ' ' TYR . 68.3 t0 -127.38 130.42 49.36 Favored 'General case' 0 N--CA 1.467 0.414 0 CA-C-O 120.803 0.335 . . . . 1.0 110.299 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 25.2 m-85 -121.36 129.26 52.96 Favored 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 115.995 -0.548 . . . . 1.0 109.952 -179.729 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . 0.5 ' C ' ' OG ' ' A' ' 123' ' ' SER . 13.5 ptm180 -118.95 5.99 11.37 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.838 0.351 . . . . 1.0 110.199 179.584 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.683 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.4 ptm180 -163.76 160.02 22.03 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-O 121.463 0.649 . . . . 1.0 110.319 179.161 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.465 ' HA ' ' CZ2' ' A' ' 157' ' ' TRP . 8.4 p90 -75.99 -19.63 58.54 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 114.697 -1.138 . . . . 1.0 112.613 -177.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.683 ' NE2' HH21 ' A' ' 153' ' ' ARG . 40.3 mt-30 -70.52 -17.81 62.95 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.843 0.354 . . . . 1.0 111.228 -179.601 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -54.68 -46.81 74.12 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.038 -0.528 . . . . 1.0 110.388 -178.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.698 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 14.3 p90 -97.45 20.47 11.62 Favored 'General case' 0 N--CA 1.464 0.251 0 CA-C-N 116.266 -0.425 . . . . 1.0 110.738 179.769 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.82 75.32 0.23 Allowed Glycine 0 CA--C 1.521 0.439 0 N-CA-C 111.21 -0.756 . . . . 1.0 111.21 179.288 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.698 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -119.32 147.9 43.78 Favored 'General case' 0 C--O 1.224 -0.25 0 CA-C-O 121.088 0.47 . . . . 1.0 110.336 179.615 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . 0.411 ' O ' ' CG ' ' A' ' 161' ' ' ASN . 15.1 t -76.02 -20.46 57.78 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 114.894 -1.048 . . . . 1.0 110.106 177.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.411 ' CG ' ' O ' ' A' ' 160' ' ' THR . 13.1 m120 -163.56 -170.65 2.28 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.019 0.437 . . . . 1.0 110.503 179.683 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.722 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.27 -22.33 12.39 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.993 -0.548 . . . . 1.0 110.557 -179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 27.5 ptt180 -36.98 120.27 0.72 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-O 121.252 0.549 . . . . 1.0 111.651 -179.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.696 HG23 ' O ' ' A' ' 162' ' ' ALA . 21.3 t -124.23 162.12 26.14 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.714 -0.675 . . . . 1.0 109.794 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.529 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -141.94 -33.67 0.11 Allowed Glycine 0 N--CA 1.464 0.537 0 N-CA-C 111.305 -0.718 . . . . 1.0 111.305 179.519 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 14.5 p -159.67 169.35 23.91 Favored 'General case' 0 C--N 1.324 -0.524 0 C-N-CA 120.656 -0.417 . . . . 1.0 110.853 -179.626 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.649 ' H ' HD23 ' A' ' 167' ' ' LEU . 1.3 pt? -153.67 146.82 24.64 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.849 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.511 ' NH2' ' CG ' ' A' ' 139' ' ' TYR . 11.3 ptp180 -135.81 147.99 48.54 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 121.403 0.62 . . . . 1.0 110.01 178.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.426 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -83.12 150.69 26.12 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 115.144 -0.934 . . . . 1.0 108.902 178.204 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.743 ' C ' HD12 ' A' ' 171' ' ' ILE . 35.6 t -83.71 85.25 1.98 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 N-CA-C 111.837 0.31 . . . . 1.0 111.837 -177.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.743 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.7 mp -135.13 116.77 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.426 0 N-CA-C 109.491 -0.559 . . . . 1.0 109.491 179.384 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.401 ' O ' ' CZ ' ' A' ' 60' ' ' ARG . 20.5 t0 -68.45 -36.58 79.23 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.514 -0.766 . . . . 1.0 110.208 179.624 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -67.12 179.76 1.11 Allowed 'General case' 0 C--N 1.332 -0.191 0 CA-C-N 115.906 -0.588 . . . . 1.0 110.81 -179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 14.4 p . . . . . 0 C--O 1.22 -0.461 0 CA-C-O 118.001 -0.999 . . . . 1.0 110.425 -179.895 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 58.9 tt0 . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.094 -0.706 . . . . 1.0 109.094 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.605 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -179.31 -177.37 47.67 Favored Glycine 0 CA--C 1.525 0.712 0 N-CA-C 110.418 -1.073 . . . . 1.0 110.418 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -168.22 140.93 3.03 Favored 'General case' 0 C--N 1.326 -0.433 0 N-CA-C 110.25 -0.278 . . . . 1.0 110.25 179.638 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.429 HG23 ' CE2' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -148.46 167.43 3.98 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.241 0 CA-C-N 116.448 -0.342 . . . . 1.0 110.912 179.327 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.479 HG22 ' CE1' ' A' ' 7' ' ' TYR . 29.2 m -127.09 121.09 30.51 Favored 'General case' 0 CA--C 1.519 -0.226 0 N-CA-C 108.278 -1.008 . . . . 1.0 108.278 176.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 38.3 mt -105.77 133.09 51.06 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 114.871 -1.059 . . . . 1.0 110.097 -179.425 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.479 ' CE1' HG22 ' A' ' 5' ' ' THR . 68.1 m-85 -115.92 126.52 54.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.264 -0.88 . . . . 1.0 111.361 -178.7 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -53.75 -29.31 39.2 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 115.607 -0.724 . . . . 1.0 110.561 179.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 99.8 m-20 -118.19 153.29 34.1 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-O 121.206 0.527 . . . . 1.0 110.365 179.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -58.38 -174.51 0.02 OUTLIER 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.348 -0.842 . . . . 1.0 110.348 -179.671 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 43.13 26.45 0.53 Allowed Glycine 0 N--CA 1.461 0.32 0 N-CA-C 110.798 -0.921 . . . . 1.0 110.798 178.596 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 10.0 m-85 50.29 68.98 0.67 Allowed 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.395 -0.403 . . . . 1.0 110.304 -179.712 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 90.5 mm-40 -129.35 -156.48 0.76 Allowed 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 120.958 0.409 . . . . 1.0 110.485 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.41 -151.68 0.1 Allowed Glycine 0 CA--C 1.526 0.747 0 N-CA-C 111.088 -0.805 . . . . 1.0 111.088 179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -69.1 147.16 51.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.769 0.319 . . . . 1.0 110.689 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 16.8 p-80 -135.84 150.57 49.45 Favored 'General case' 0 CA--C 1.519 -0.235 0 CA-C-O 121.363 0.601 . . . . 1.0 110.25 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.54 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.1 t80 -145.22 142.13 29.27 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 115.22 -0.9 . . . . 1.0 110.203 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.54 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 31.0 tt0 -110.62 122.53 48.0 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 115.967 -0.561 . . . . 1.0 110.174 -179.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . 0.453 ' SG ' ' ND1' ' A' ' 23' ' ' HIS . 1.5 t -110.41 127.05 54.91 Favored 'General case' 0 N--CA 1.468 0.426 0 CA-C-N 116.108 -0.496 . . . . 1.0 110.535 -179.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 9.0 t -119.41 13.6 12.71 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.661 -0.7 . . . . 1.0 110.392 -179.853 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 50.8 m -158.29 172.31 18.59 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.139 -0.482 . . . . 1.0 110.692 -178.549 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.448 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 50.0 p-10 -62.49 137.33 58.24 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.505 -0.771 . . . . 1.0 112.051 -179.453 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.453 ' ND1' ' SG ' ' A' ' 19' ' ' CYS . 0.2 OUTLIER -133.08 143.49 49.36 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 115.463 -0.789 . . . . 1.0 110.404 179.296 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.403 HG22 ' CE2' ' A' ' 51' ' ' TYR . 18.4 p -112.36 -16.11 13.0 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.527 -0.76 . . . . 1.0 111.724 -179.145 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -149.88 115.19 5.46 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.074 0.464 . . . . 1.0 110.32 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 14.7 mt -117.89 0.51 11.93 Favored 'General case' 0 N--CA 1.468 0.443 0 CA-C-N 115.627 -0.715 . . . . 1.0 110.334 -179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.617 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 0.9 OUTLIER -52.92 -42.16 88.79 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-N 116.077 -0.51 . . . . 1.0 110.043 179.987 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.617 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 39.1 Cg_exo -59.26 -33.66 97.98 Favored 'Trans proline' 0 C--N 1.31 -1.473 0 C-N-CA 122.078 1.852 . . . . 1.0 111.556 -179.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 6.5 m-85 -95.94 -53.13 3.78 Favored 'General case' 0 N--CA 1.463 0.186 0 CA-C-O 120.828 0.347 . . . . 1.0 111.012 -179.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 6.8 mt -117.3 126.27 52.45 Favored 'General case' 0 N--CA 1.464 0.231 0 CA-C-N 116.008 -0.542 . . . . 1.0 110.463 -178.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.6 t -93.93 -7.68 42.31 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.61 -179.536 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.424 ' CG ' HD21 ' A' ' 34' ' ' ASN . 15.5 tpp180 -146.97 -60.65 0.29 Allowed 'General case' 0 C--N 1.33 -0.239 0 CA-C-N 116.436 -0.347 . . . . 1.0 111.923 -178.134 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 42.3 t 64.98 75.81 0.36 Allowed 'General case' 0 C--N 1.323 -0.556 0 O-C-N 123.269 0.356 . . . . 1.0 110.128 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . 0.424 HD21 ' CG ' ' A' ' 32' ' ' ARG . 15.6 m120 -93.1 3.34 55.89 Favored 'General case' 0 C--O 1.222 -0.385 0 CA-C-N 116.33 -0.396 . . . . 1.0 111.32 -178.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 11.9 p -155.41 157.35 36.91 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.959 -0.386 . . . . 1.0 109.959 179.374 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.75 155.32 34.31 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.006 -0.543 . . . . 1.0 111.059 -178.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.478 ' NH1' ' OD2' ' A' ' 62' ' ' ASP . 24.3 mtp85 -133.81 122.02 22.65 Favored 'General case' 0 C--O 1.21 -0.98 0 N-CA-C 108.371 -0.974 . . . . 1.0 108.371 178.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 64.7 t -107.94 114.63 46.96 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.365 0 CA-C-O 121.259 0.552 . . . . 1.0 110.05 179.731 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -74.22 -44.89 51.38 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.002 -0.999 . . . . 1.0 110.695 179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 29.1 t -162.68 155.13 19.01 Favored 'General case' 0 N--CA 1.447 -0.594 0 N-CA-C 109.643 -0.503 . . . . 1.0 109.643 -179.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 85.89 175.97 50.06 Favored Glycine 0 C--N 1.317 -0.513 0 N-CA-C 110.566 -1.014 . . . . 1.0 110.566 179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.1 m -111.94 138.1 49.04 Favored 'General case' 0 C--N 1.326 -0.429 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.671 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 54.9 m95 -126.04 146.29 49.97 Favored 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 115.875 -0.602 . . . . 1.0 110.619 -179.447 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.515 ' C ' HD23 ' A' ' 45' ' ' LEU . 18.5 tpp -121.4 130.78 53.79 Favored 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 108.684 -0.858 . . . . 1.0 108.684 178.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.515 HD23 ' C ' ' A' ' 44' ' ' MET . 1.3 mt -110.1 132.08 54.48 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.026 -0.731 . . . . 1.0 109.026 -179.374 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.453 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 64.2 m-85 -108.12 130.96 55.08 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.634 0.731 . . . . 1.0 110.306 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.621 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.8 pt-20 -58.7 -34.61 71.5 Favored 'General case' 0 N--CA 1.441 -0.916 0 CA-C-N 115.006 -0.997 . . . . 1.0 110.596 -178.379 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.426 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 4.0 mt-30 -109.5 153.04 43.04 Favored Pre-proline 0 C--N 1.333 -0.119 0 CA-C-N 116.148 -0.478 . . . . 1.0 110.339 -178.758 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 37.0 Cg_endo -63.29 160.24 35.93 Favored 'Trans proline' 0 C--N 1.31 -1.487 0 C-N-CA 122.308 2.005 . . . . 1.0 112.497 178.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.655 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.13 38.21 13.93 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.364 -0.835 . . . . 1.0 111.106 -179.969 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.453 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 3.9 m-85 48.99 75.24 0.15 Allowed 'General case' 0 C--N 1.317 -0.814 0 CA-C-N 114.899 -1.046 . . . . 1.0 111.02 -179.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 2.6 m -143.91 154.2 43.09 Favored 'General case' 0 CA--C 1.518 -0.271 0 CA-C-O 121.021 0.439 . . . . 1.0 110.276 -178.812 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 87.65 -150.02 22.15 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.978 -0.63 . . . . 1.0 111.947 179.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.621 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 45.8 tp -74.92 144.5 43.25 Favored 'General case' 0 N--CA 1.448 -0.55 0 CA-C-N 115.043 -0.579 . . . . 1.0 110.265 -179.411 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -122.42 151.52 41.16 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.671 0.272 . . . . 1.0 110.433 179.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.462 ' C ' ' SD ' ' A' ' 44' ' ' MET . 8.4 m-85 -128.23 126.19 40.44 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.742 179.86 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.421 ' C ' HD12 ' A' ' 58' ' ' LEU . 46.8 t80 -83.43 123.81 30.06 Favored 'General case' 0 CA--C 1.519 -0.214 0 CA-C-O 121.019 0.437 . . . . 1.0 109.886 -179.604 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.421 HD12 ' C ' ' A' ' 57' ' ' PHE . 8.8 mp -117.3 145.61 43.88 Favored 'General case' 0 N--CA 1.463 0.21 0 CA-C-N 115.528 -0.76 . . . . 1.0 110.079 179.626 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.416 ' O ' ' C ' ' A' ' 60' ' ' ARG . 33.4 mtm-85 -131.98 157.11 44.93 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 115.401 -0.818 . . . . 1.0 109.767 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.416 ' C ' ' O ' ' A' ' 59' ' ' ARG . 71.8 ttt180 -36.32 126.52 0.79 Allowed 'General case' 0 N--CA 1.462 0.163 0 CA-C-N 116.307 -0.406 . . . . 1.0 110.69 -179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.94 -177.89 32.78 Favored Glycine 0 CA--C 1.523 0.593 0 N-CA-C 110.348 -1.101 . . . . 1.0 110.348 -179.526 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.478 ' OD2' ' NH1' ' A' ' 37' ' ' ARG . 68.6 m-20 -115.99 129.56 56.43 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 120.86 0.362 . . . . 1.0 110.209 179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -123.27 112.86 18.14 Favored 'General case' 0 CA--C 1.517 -0.32 0 N-CA-C 109.439 -0.578 . . . . 1.0 109.439 179.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.408 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.6 -4.23 55.53 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 115.882 -0.599 . . . . 1.0 111.456 -179.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.408 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 76.7 m-20 -147.72 139.33 23.87 Favored 'General case' 0 C--N 1.325 -0.481 0 N-CA-C 109.18 -0.674 . . . . 1.0 109.18 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.483 ' CB ' ' CZ2' ' A' ' 69' ' ' TRP . 15.2 p-80 -59.98 -41.14 91.34 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 121.093 0.473 . . . . 1.0 110.971 -179.072 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . 0.493 ' NE2' ' O ' ' A' ' 71' ' ' GLY . 97.3 mm-40 -53.84 -7.6 0.13 Allowed 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.753 -0.658 . . . . 1.0 110.67 179.345 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.479 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.0 mm-40 -83.96 -35.29 24.08 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 120.58 -0.448 . . . . 1.0 111.506 -178.152 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.483 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 1.8 p90 -91.81 15.45 12.91 Favored 'General case' 0 C--N 1.315 -0.907 0 CA-C-O 119.286 -0.388 . . . . 1.0 110.938 179.837 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.585 ' SD ' ' NE2' ' A' ' 143' ' ' GLN . 77.0 mtp 83.77 16.35 0.26 Allowed 'General case' 0 N--CA 1.463 0.215 0 O-C-N 123.922 0.764 . . . . 1.0 109.932 -177.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.493 ' O ' ' NE2' ' A' ' 67' ' ' GLN . . . -62.73 101.57 0.42 Allowed Glycine 0 C--N 1.344 1.007 0 C-N-CA 120.068 -1.063 . . . . 1.0 110.68 178.748 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 64.6 mt -77.9 -35.84 50.25 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 109.976 -0.379 . . . . 1.0 109.976 177.185 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.508 ' C ' ' H ' ' A' ' 75' ' ' SER . 27.5 t -124.52 121.01 33.63 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 120.844 0.354 . . . . 1.0 110.151 178.858 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 55.5 p-10 -71.16 35.91 0.05 Allowed 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 116.21 -0.45 . . . . 1.0 110.697 -179.242 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.508 ' H ' ' C ' ' A' ' 73' ' ' SER . 27.2 m -111.17 72.39 0.78 Allowed 'General case' 0 C--O 1.213 -0.853 0 CA-C-N 116.221 -0.445 . . . . 1.0 110.539 -179.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.8 t -99.87 118.57 46.69 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.705 0 N-CA-C 109.317 -0.623 . . . . 1.0 109.317 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -124.41 3.14 8.42 Favored 'General case' 0 N--CA 1.463 0.18 0 CA-C-N 116.192 -0.458 . . . . 1.0 111.393 -178.546 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 14.2 p -163.47 162.54 24.73 Favored 'General case' 0 CA--C 1.515 -0.395 0 CA-C-O 121.062 0.458 . . . . 1.0 110.647 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.4 p -155.49 147.09 23.01 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.553 -0.748 . . . . 1.0 110.105 -178.341 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.45 ' CZ ' ' CE ' ' A' ' 147' ' ' MET . 2.9 ptm180 -128.02 152.44 47.93 Favored 'General case' 0 CA--C 1.511 -0.543 0 N-CA-C 109.769 -0.456 . . . . 1.0 109.769 179.581 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.796 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.1 tt -104.65 128.54 52.73 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 107.957 -1.127 . . . . 1.0 107.957 178.262 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.796 ' N ' HD23 ' A' ' 81' ' ' LEU . 2.3 mt -90.56 115.71 64.76 Favored Pre-proline 0 CA--C 1.547 0.849 0 CA-C-N 116.063 -0.517 . . . . 1.0 110.295 -178.88 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo -53.0 153.94 14.41 Favored 'Trans proline' 0 N--CA 1.502 2.013 0 C-N-CA 122.468 2.112 . . . . 1.0 112.97 179.03 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 15.6 m170 -73.44 -174.51 1.69 Allowed 'General case' 0 C--N 1.332 -0.168 0 CA-C-N 115.646 -0.706 . . . . 1.0 110.191 179.126 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . 0.422 ' OG ' ' CA ' ' A' ' 129' ' ' GLY . 3.1 t -167.88 137.46 2.61 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 116.075 -0.511 . . . . 1.0 111.028 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -82.22 -73.27 1.22 Allowed Glycine 0 CA--C 1.521 0.425 0 N-CA-C 109.843 -1.303 . . . . 1.0 109.843 178.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.3 m -87.15 152.1 22.63 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 109.396 -0.594 . . . . 1.0 109.396 178.905 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 36.4 m80 -132.2 120.22 21.92 Favored 'General case' 0 CA--C 1.519 -0.245 0 CA-C-N 116.624 -0.262 . . . . 1.0 111.179 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 9.9 ptt180 -146.92 134.7 21.19 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 109.957 -0.386 . . . . 1.0 109.957 178.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.496 HD12 HG22 ' A' ' 126' ' ' VAL . 18.0 tt -147.81 138.61 17.46 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 CA-C-N 116.71 -0.223 . . . . 1.0 110.83 -179.885 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 98.7 mtt180 -118.03 102.2 8.86 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 116.037 -0.528 . . . . 1.0 111.457 -179.563 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 1.2 mp -83.78 147.32 27.66 Favored 'General case' 0 CA--C 1.514 -0.416 0 CA-C-N 116.315 -0.402 . . . . 1.0 111.288 179.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.464 ' CD2' ' O ' ' A' ' 97' ' ' ASP . 65.3 m-85 -118.28 133.66 55.7 Favored 'General case' 0 C--O 1.245 0.852 0 CA-C-N 115.554 -0.748 . . . . 1.0 111.508 -179.543 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.648 ' OE1' ' O ' ' A' ' 101' ' ' GLN . 0.5 OUTLIER -55.21 -36.49 66.01 Favored 'General case' 0 C--N 1.331 -0.224 0 CA-C-N 114.965 -1.016 . . . . 1.0 111.291 179.428 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.612 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 36.8 mtp85 -130.98 170.05 14.99 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.419 -0.355 . . . . 1.0 110.131 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 96.8 mt-10 -43.15 152.25 0.12 Allowed 'General case' 0 C--N 1.332 -0.176 0 CA-C-N 115.837 -0.62 . . . . 1.0 110.723 179.443 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.464 ' O ' ' CD2' ' A' ' 93' ' ' TYR . 69.7 m-20 57.13 -102.47 0.15 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 115.266 -0.879 . . . . 1.0 110.369 -178.694 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 2.9 p90 -166.64 37.77 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.713 0 C-N-CA 120.092 -0.643 . . . . 1.0 109.536 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 73.7 mtp85 -95.38 70.82 3.17 Favored 'General case' 0 CA--C 1.518 -0.284 0 CA-C-O 121.416 0.627 . . . . 1.0 111.56 -178.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 161.78 -155.28 26.48 Favored Glycine 0 CA--C 1.533 1.173 0 CA-C-N 114.931 -1.031 . . . . 1.0 111.413 179.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.648 ' O ' ' OE1' ' A' ' 94' ' ' GLU . 67.4 tp60 -63.81 134.46 55.29 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-O 120.992 0.425 . . . . 1.0 111.728 -178.355 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.402 ' SD ' ' C ' ' A' ' 102' ' ' MET . 0.5 OUTLIER -122.41 138.6 54.48 Favored 'General case' 0 N--CA 1.471 0.625 0 CA-C-N 116.36 -0.382 . . . . 1.0 110.499 179.567 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 9.8 tt -139.99 138.57 37.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.476 0 N-CA-C 109.246 -0.65 . . . . 1.0 109.246 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -112.95 147.25 37.5 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.203 0.525 . . . . 1.0 110.359 -179.41 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.531 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 74.8 m-85 -130.56 154.45 47.81 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 114.684 -1.144 . . . . 1.0 110.285 -179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 18.2 p -143.28 9.3 1.64 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 115.547 -0.751 . . . . 1.0 111.17 179.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.956 ' O ' ' O ' ' A' ' 108' ' ' ASP . 5.1 pt-20 -158.51 81.08 0.82 Allowed 'General case' 0 C--O 1.216 -0.664 0 CA-C-O 118.488 -0.768 . . . . 1.0 109.884 179.245 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.956 ' O ' ' O ' ' A' ' 107' ' ' GLU . 14.0 p-10 18.46 164.99 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 122.514 1.149 . . . . 1.0 113.482 178.676 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . 0.443 ' SG ' ' O ' ' A' ' 108' ' ' ASP . 98.3 m -148.43 107.58 3.89 Favored 'General case' 0 C--N 1.317 -0.828 0 O-C-N 120.133 -1.604 . . . . 1.0 109.896 179.378 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.442 ' O ' ' OG ' ' A' ' 166' ' ' SER . 78.0 p -66.28 -19.59 65.86 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 116.154 -0.476 . . . . 1.0 110.667 -179.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 4.1 m -146.61 95.09 2.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 121.269 0.557 . . . . 1.0 109.974 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.531 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -62.39 -42.33 99.33 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.54 -0.754 . . . . 1.0 110.285 -179.201 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 29.5 mm-40 -45.72 -14.65 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.566 0 CA-C-N 116.345 -0.388 . . . . 1.0 111.47 179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.446 ' N ' ' O ' ' A' ' 112' ' ' LEU . 81.3 m-20 -93.05 7.15 45.33 Favored 'General case' 0 N--CA 1.475 0.796 0 CA-C-O 121.582 0.706 . . . . 1.0 110.481 -179.448 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.474 ' N ' ' O ' ' A' ' 112' ' ' LEU . 39.4 mmt180 -136.67 -42.78 0.6 Allowed 'General case' 0 C--N 1.322 -0.611 0 CA-C-N 114.508 -1.224 . . . . 1.0 113.719 -177.232 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.625 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -125.26 143.4 50.97 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.646 0.736 . . . . 1.0 110.667 -178.509 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.435 ' O ' ' C ' ' A' ' 118' ' ' PHE . 87.1 mtt180 -72.63 -73.7 0.19 Allowed 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 119.748 -0.781 . . . . 1.0 110.616 -177.673 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.606 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 93.2 m-85 -30.46 142.18 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.815 0 O-C-N 123.821 0.701 . . . . 1.0 110.391 179.798 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 82.3 m-20 -104.3 12.44 33.6 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-O 120.851 0.358 . . . . 1.0 110.905 -178.467 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 68.5 mt-10 -142.02 138.48 31.87 Favored 'General case' 0 C--O 1.233 0.197 0 CA-C-O 121.536 0.684 . . . . 1.0 111.012 -179.132 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 42.9 mm -120.43 118.09 55.51 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.461 0 CA-C-N 115.067 -0.97 . . . . 1.0 109.088 178.464 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 46.7 m-70 -109.9 24.09 13.5 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 115.629 -0.714 . . . . 1.0 111.497 -178.783 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.53 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 2.3 p 170.17 150.0 0.04 OUTLIER 'General case' 0 CA--C 1.514 -0.408 0 CA-C-O 121.046 0.451 . . . . 1.0 109.825 179.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.403 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.8 pp -163.48 157.97 20.38 Favored 'General case' 0 C--N 1.32 -0.7 0 CA-C-N 115.353 -0.84 . . . . 1.0 110.232 -178.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -125.16 120.27 30.88 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.386 -0.37 . . . . 1.0 110.529 -179.515 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.496 HG22 HD12 ' A' ' 90' ' ' ILE . 43.5 t -103.83 104.21 16.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 109.335 -0.617 . . . . 1.0 109.335 178.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.916 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.5 OUTLIER -79.13 -40.32 31.32 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 115.564 -0.744 . . . . 1.0 111.22 -179.741 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 37.7 tp10 -139.88 148.21 41.74 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 121.106 0.479 . . . . 1.0 110.766 -178.581 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.422 ' CA ' ' OG ' ' A' ' 85' ' ' SER . . . 59.11 -176.86 2.46 Favored Glycine 0 N--CA 1.45 -0.426 0 N-CA-C 111.029 -0.828 . . . . 1.0 111.029 179.625 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.427 ' OG ' HG21 ' A' ' 170' ' ' VAL . 22.0 p -117.46 151.71 36.52 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 109.698 -0.482 . . . . 1.0 109.698 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . . . . . . . . . 53.6 m95 -127.56 168.21 15.27 Favored 'General case' 0 CA--C 1.513 -0.471 0 CA-C-N 115.53 -0.759 . . . . 1.0 110.526 -178.632 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 2.4 p -141.54 144.84 25.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.488 0 N-CA-C 109.027 -0.731 . . . . 1.0 109.027 178.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.516 ' HG ' HD11 ' A' ' 146' ' ' LEU . 48.3 mt -111.48 142.83 43.24 Favored 'General case' 0 CA--C 1.509 -0.617 0 N-CA-C 110.073 -0.343 . . . . 1.0 110.073 -179.873 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . 0.419 ' CE2' ' HG2' ' A' ' 143' ' ' GLN . 39.1 m-85 -117.55 131.61 56.66 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.801 0.334 . . . . 1.0 110.247 178.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 80.1 tt0 -43.82 -44.74 7.01 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.076 -0.511 . . . . 1.0 111.283 179.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.596 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -130.77 169.25 15.96 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 120.999 0.428 . . . . 1.0 110.001 -179.345 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.441 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 3.1 t -73.64 168.81 18.57 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.794 -0.639 . . . . 1.0 110.849 179.769 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . 0.493 ' ND2' ' HE ' ' A' ' 140' ' ' ARG . 57.8 t30 69.32 14.82 8.53 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.142 -0.935 . . . . 1.0 109.911 -179.019 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 41.42 78.43 0.05 OUTLIER 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 116.241 -0.436 . . . . 1.0 111.997 179.84 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.562 ' C ' HD11 ' A' ' 136' ' ' LEU . 89.0 mtt-85 -147.46 35.36 0.87 Allowed 'General case' 0 N--CA 1.476 0.827 0 CA-C-O 120.926 0.393 . . . . 1.0 110.462 179.123 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -145.81 -150.14 5.14 Favored Glycine 0 N--CA 1.464 0.516 0 N-CA-C 111.763 -0.535 . . . . 1.0 111.763 -177.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.437 ' NH1' HG21 ' A' ' 160' ' ' THR . 95.2 mtt180 -69.51 165.35 21.16 Favored 'General case' 0 CA--C 1.516 -0.346 0 N-CA-C 109.904 -0.406 . . . . 1.0 109.904 179.528 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.585 ' NE2' ' SD ' ' A' ' 70' ' ' MET . 42.3 mt-30 -142.8 135.01 27.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.237 -0.438 . . . . 1.0 111.552 -179.109 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 7.9 m-85 -126.86 124.75 40.32 Favored 'General case' 0 N--CA 1.47 0.562 0 N-CA-C 108.807 -0.812 . . . . 1.0 108.807 178.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.651 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.9 OUTLIER -82.2 126.63 32.3 Favored 'General case' 0 CA--C 1.518 -0.27 0 CA-C-N 115.705 -0.679 . . . . 1.0 110.048 -179.0 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.651 ' N ' HD23 ' A' ' 145' ' ' LEU . 23.7 mt -114.79 100.01 7.92 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.206 -0.907 . . . . 1.0 109.391 179.491 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.568 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -82.28 158.69 66.27 Favored Pre-proline 0 C--N 1.326 -0.439 0 CA-C-N 116.346 -0.388 . . . . 1.0 110.319 -179.199 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -47.36 121.76 5.8 Favored 'Trans proline' 0 N--CA 1.491 1.375 0 C-N-CA 121.632 1.555 . . . . 1.0 111.518 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 168.53 -154.83 24.93 Favored Glycine 0 CA--C 1.527 0.837 0 N-CA-C 110.38 -1.088 . . . . 1.0 110.38 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 67.6 t0 -129.49 129.27 44.35 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-O 120.874 0.368 . . . . 1.0 110.226 -179.827 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.51 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 17.0 m-85 -119.24 130.12 55.29 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.054 -0.521 . . . . 1.0 109.996 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 93.0 mtt-85 -118.01 -3.8 11.1 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-O 120.843 0.354 . . . . 1.0 110.569 -179.572 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 32.9 ptt180 -155.41 157.73 37.5 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-O 121.26 0.552 . . . . 1.0 109.964 179.377 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.544 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -70.3 -21.32 62.95 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-N 114.879 -1.055 . . . . 1.0 111.459 -178.452 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.533 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.4 mt-30 -66.06 -21.3 66.37 Favored 'General case' 0 N--CA 1.465 0.31 0 CA-C-O 121.234 0.54 . . . . 1.0 110.971 -179.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 99.3 m-20 -50.21 -47.96 54.59 Favored 'General case' 0 C--N 1.312 -1.033 0 CA-C-N 115.946 -0.57 . . . . 1.0 110.793 -178.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.665 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 19.1 p90 -101.9 18.45 20.57 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.16 0.505 . . . . 1.0 110.167 179.718 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.36 75.7 0.21 Allowed Glycine 0 C--N 1.331 0.269 0 N-CA-C 111.103 -0.799 . . . . 1.0 111.103 179.547 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.665 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -95.07 -171.05 2.32 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-O 121.053 0.454 . . . . 1.0 110.264 179.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . 0.437 HG21 ' NH1' ' A' ' 142' ' ' ARG . 0.0 OUTLIER -121.74 -35.94 3.12 Favored 'General case' 0 C--N 1.327 -0.41 0 CA-C-N 115.342 -0.844 . . . . 1.0 111.588 -178.681 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.638 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.5 OUTLIER -146.31 -18.98 0.44 Allowed 'General case' 0 N--CA 1.47 0.575 0 N-CA-C 111.948 0.351 . . . . 1.0 111.948 -178.376 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.676 ' O ' HG23 ' A' ' 164' ' ' VAL . . . 90.66 -21.95 0.11 Allowed 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.519 -0.764 . . . . 1.0 110.658 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 33.3 ptt180 -42.39 122.57 2.27 Favored 'General case' 0 CA--C 1.511 -0.524 0 CA-C-N 115.565 -0.743 . . . . 1.0 110.72 -179.183 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.676 HG23 ' O ' ' A' ' 162' ' ' ALA . 26.0 t -123.21 133.24 69.69 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 CA-C-N 115.275 -0.875 . . . . 1.0 110.106 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . . . . . . . . . . . -109.33 -29.5 3.94 Favored Glycine 0 CA--C 1.523 0.54 0 N-CA-C 111.879 -0.489 . . . . 1.0 111.879 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.442 ' OG ' ' O ' ' A' ' 110' ' ' SER . 16.0 m -163.56 176.69 9.45 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.829 0.347 . . . . 1.0 110.188 -178.959 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 1.7 pp -160.2 142.6 13.19 Favored 'General case' 0 C--N 1.32 -0.678 0 CA-C-N 115.841 -0.618 . . . . 1.0 110.52 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . . . . . . . . . 1.6 ptm180 -131.84 157.28 44.32 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 109.498 -0.556 . . . . 1.0 109.498 179.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 75.2 mtm180 -88.85 153.11 21.32 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 115.832 -0.622 . . . . 1.0 109.411 179.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.427 HG21 ' OG ' ' A' ' 130' ' ' SER . 59.0 t -88.56 88.43 2.93 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.495 0 C-N-CA 120.588 -0.445 . . . . 1.0 111.659 -179.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . . . . . . . . . 3.7 mp -139.28 138.34 40.62 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.253 0 CA-C-N 116.235 -0.439 . . . . 1.0 110.439 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 48.1 t0 -96.73 -33.77 11.59 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 115.777 -0.647 . . . . 1.0 110.643 179.716 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.691 ' CG ' ' N ' ' A' ' 174' ' ' SER . 0.0 OUTLIER -69.82 -64.77 0.82 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 121.461 0.648 . . . . 1.0 109.954 -179.973 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . 0.691 ' N ' ' CG ' ' A' ' 173' ' ' PHE . 86.1 p . . . . . 0 C--N 1.321 -0.658 0 CA-C-O 117.725 -1.131 . . . . 1.0 111.191 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 99.2 mm-40 . . . . . 0 N--CA 1.489 1.519 0 N-CA-C 109.078 -0.712 . . . . 1.0 109.078 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.503 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -172.66 172.82 45.23 Favored Glycine 0 CA--C 1.525 0.682 0 N-CA-C 110.429 -1.068 . . . . 1.0 110.429 -179.626 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -171.38 111.32 0.33 Allowed 'General case' 0 C--N 1.329 -0.291 0 C-N-CA 121.034 -0.266 . . . . 1.0 110.692 179.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -119.83 169.37 11.02 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 120.928 0.394 . . . . 1.0 111.049 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.49 HG22 ' CE1' ' A' ' 7' ' ' TYR . 27.3 m -127.33 120.23 28.09 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 107.842 -1.17 . . . . 1.0 107.842 177.142 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.4 mt -104.72 132.7 50.65 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 114.937 -1.029 . . . . 1.0 110.057 -179.272 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.49 ' CE1' HG22 ' A' ' 5' ' ' THR . 54.8 m-85 -115.15 125.87 53.95 Favored 'General case' 0 N--CA 1.47 0.574 0 CA-C-N 115.394 -0.821 . . . . 1.0 111.022 -178.711 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 80.8 tt0 -51.63 -34.28 37.07 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.671 -0.695 . . . . 1.0 110.634 179.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -114.84 151.54 33.72 Favored 'General case' 0 N--CA 1.468 0.431 0 CA-C-O 121.205 0.526 . . . . 1.0 110.423 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.451 ' O ' ' N ' ' A' ' 12' ' ' PHE . 12.0 ptm180 -56.42 -171.96 0.01 OUTLIER 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 115.444 -0.798 . . . . 1.0 110.588 -179.3 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 42.28 23.76 0.17 Allowed Glycine 0 C--N 1.332 0.334 0 N-CA-C 110.937 -0.865 . . . . 1.0 110.937 178.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.451 ' N ' ' O ' ' A' ' 10' ' ' ARG . 9.6 m-85 52.54 69.59 0.67 Allowed 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 115.568 -0.316 . . . . 1.0 110.172 -179.797 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 57.3 mt-30 -131.69 -161.37 1.12 Allowed 'General case' 0 N--CA 1.469 0.496 0 CA-C-O 120.944 0.402 . . . . 1.0 110.482 179.485 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 45.76 -148.68 1.86 Allowed Glycine 0 CA--C 1.525 0.687 0 N-CA-C 110.951 -0.86 . . . . 1.0 110.951 179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -72.48 148.1 45.42 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.786 0.327 . . . . 1.0 110.735 -179.671 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 17.4 p-80 -137.04 151.98 49.56 Favored 'General case' 0 C--N 1.331 -0.209 0 CA-C-O 121.259 0.552 . . . . 1.0 110.409 -179.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.519 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 6.5 t80 -145.23 141.61 28.8 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 115.297 -0.865 . . . . 1.0 110.148 -179.845 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.519 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 71.5 tt0 -110.42 123.04 49.14 Favored 'General case' 0 N--CA 1.464 0.27 0 CA-C-N 115.895 -0.593 . . . . 1.0 110.183 -179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.6 t -111.69 126.95 55.58 Favored 'General case' 0 N--CA 1.47 0.54 0 CA-C-N 116.288 -0.415 . . . . 1.0 110.994 -179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 72.0 p -118.78 11.24 12.62 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-N 115.809 -0.632 . . . . 1.0 110.566 -179.737 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 44.5 p -156.02 168.81 26.06 Favored 'General case' 0 C--N 1.331 -0.234 0 CA-C-N 116.059 -0.519 . . . . 1.0 110.477 -179.006 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.432 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 50.2 p-10 -58.86 136.75 57.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.784 -0.644 . . . . 1.0 111.638 -179.341 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . 0.419 ' CG ' HD21 ' A' ' 26' ' ' LEU . 0.1 OUTLIER -131.74 142.99 49.92 Favored 'General case' 0 N--CA 1.469 0.502 0 CA-C-N 115.443 -0.798 . . . . 1.0 110.533 179.782 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . 0.504 ' O ' ' OG ' ' A' ' 78' ' ' SER . 65.4 p -115.73 -11.96 11.57 Favored 'General case' 0 CA--C 1.508 -0.659 0 CA-C-N 115.401 -0.818 . . . . 1.0 111.887 -178.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 11.6 t30 -149.95 110.96 4.35 Favored 'General case' 0 C--N 1.316 -0.849 0 CA-C-O 121.274 0.559 . . . . 1.0 109.777 -179.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.419 HD21 ' CG ' ' A' ' 23' ' ' HIS . 36.4 mt -118.01 -3.55 11.12 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 115.511 -0.768 . . . . 1.0 110.428 -179.386 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.591 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 0.0 OUTLIER -47.17 -52.67 33.15 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-N 116.041 -0.527 . . . . 1.0 110.488 179.345 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.591 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 18.5 Cg_endo -55.88 -32.45 85.21 Favored 'Trans proline' 0 C--N 1.313 -1.331 0 C-N-CA 121.556 1.504 . . . . 1.0 112.295 -179.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.403 ' N ' ' CD1' ' A' ' 29' ' ' TYR . 1.1 m-85 -91.98 -49.5 6.19 Favored 'General case' 0 N--CA 1.464 0.271 0 C-N-CA 120.362 -0.535 . . . . 1.0 110.38 -178.515 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 9.3 mt -121.41 126.95 50.6 Favored 'General case' 0 CA--C 1.521 -0.165 0 CA-C-N 115.636 -0.711 . . . . 1.0 110.44 -179.194 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.9 t -94.7 -14.59 24.67 Favored 'General case' 0 C--N 1.32 -0.708 0 CA-C-N 115.725 -0.671 . . . . 1.0 111.942 -179.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 88.5 mtm180 -144.59 -55.84 0.34 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.363 -0.381 . . . . 1.0 111.685 -178.067 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 39.0 t 60.75 79.5 0.24 Allowed 'General case' 0 C--N 1.326 -0.419 0 N-CA-C 110.096 -0.335 . . . . 1.0 110.096 -178.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -94.25 4.83 53.35 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 116.261 -0.427 . . . . 1.0 111.243 -178.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 8.1 p -156.83 158.03 36.03 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.958 0.409 . . . . 1.0 110.372 179.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.68 154.45 32.95 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.826 -0.624 . . . . 1.0 110.893 -178.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 27.5 mtp85 -133.16 122.46 24.06 Favored 'General case' 0 C--O 1.213 -0.861 0 N-CA-C 108.688 -0.856 . . . . 1.0 108.688 178.856 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 58.7 t -107.82 115.93 50.08 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.402 0 CA-C-O 121.149 0.5 . . . . 1.0 109.873 179.652 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 22.4 t0 -78.44 -43.6 26.82 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-N 115.465 -0.788 . . . . 1.0 110.914 179.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 57.7 m -160.42 159.81 31.43 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.375 -0.602 . . . . 1.0 109.375 -179.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 79.93 176.02 48.98 Favored Glycine 0 C--N 1.316 -0.565 0 N-CA-C 110.844 -0.902 . . . . 1.0 110.844 179.598 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 73.9 m -112.49 138.02 49.84 Favored 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 109.091 -0.707 . . . . 1.0 109.091 178.408 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.598 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 52.4 m95 -127.94 148.82 50.52 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.288 0.566 . . . . 1.0 110.916 -179.061 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.687 ' C ' HD23 ' A' ' 45' ' ' LEU . 1.9 ttt -128.06 137.04 52.01 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.413 -0.812 . . . . 1.0 110.021 178.289 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.687 HD23 ' C ' ' A' ' 44' ' ' MET . 0.2 OUTLIER -113.27 139.73 48.57 Favored 'General case' 0 N--CA 1.469 0.482 0 CA-C-N 115.838 -0.619 . . . . 1.0 110.374 -178.884 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 56.9 m-85 -109.64 134.93 51.39 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.461 0.648 . . . . 1.0 111.711 179.669 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.571 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 15.4 pt-20 -57.86 -32.41 67.64 Favored 'General case' 0 CA--C 1.512 -0.517 0 CA-C-N 114.863 -1.062 . . . . 1.0 111.133 -178.243 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.51 ' NE2' ' O ' ' A' ' 52' ' ' SER . 10.9 pt20 -115.93 155.16 48.17 Favored Pre-proline 0 C--N 1.317 -0.844 0 N-CA-C 109.31 -0.626 . . . . 1.0 109.31 179.918 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.434 ' C ' HD22 ' A' ' 50' ' ' ASN . 15.9 Cg_endo -52.82 149.0 26.97 Favored 'Trans proline' 0 C--N 1.305 -1.755 0 C-N-CA 121.089 1.193 . . . . 1.0 111.87 179.56 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.844 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.4 OUTLIER 75.78 -123.46 0.03 OUTLIER 'General case' 0 C--N 1.327 -0.384 0 CA-C-N 114.566 -1.197 . . . . 1.0 109.403 -178.662 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.543 ' CD1' ' O ' ' A' ' 50' ' ' ASN . 0.5 OUTLIER -150.96 73.29 1.1 Allowed 'General case' 0 C--N 1.317 -0.807 0 CA-C-O 121.18 0.514 . . . . 1.0 110.218 179.034 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.51 ' O ' ' NE2' ' A' ' 48' ' ' GLN . 3.4 m -140.08 18.19 2.45 Favored 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.776 -0.647 . . . . 1.0 112.037 -177.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -137.7 -164.74 10.13 Favored Glycine 0 N--CA 1.467 0.73 0 N-CA-C 111.127 -0.789 . . . . 1.0 111.127 178.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.571 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 38.9 tp -59.39 146.76 38.8 Favored 'General case' 0 N--CA 1.438 -1.052 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.516 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 4.9 pt20 -121.97 150.09 42.53 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-O 120.696 0.284 . . . . 1.0 110.692 -179.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.3 m-85 -125.61 123.64 39.47 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 115.926 -0.579 . . . . 1.0 110.009 179.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 49.6 t80 -83.58 122.32 28.41 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-O 121.112 0.482 . . . . 1.0 110.59 -179.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.5 mp -118.36 145.25 45.29 Favored 'General case' 0 N--CA 1.466 0.332 0 CA-C-N 115.724 -0.671 . . . . 1.0 110.144 179.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.635 ' NH2' ' NH1' ' A' ' 168' ' ' ARG . 64.1 mtm180 -132.11 157.71 43.51 Favored 'General case' 0 N--CA 1.464 0.244 0 CA-C-N 115.468 -0.787 . . . . 1.0 110.025 179.58 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.418 ' C ' ' O ' ' A' ' 59' ' ' ARG . 14.2 ptm180 -34.32 125.23 0.49 Allowed 'General case' 0 C--O 1.233 0.197 0 CA-C-N 116.035 -0.529 . . . . 1.0 110.941 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 155.65 -178.3 32.32 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 110.799 -0.92 . . . . 1.0 110.799 -179.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 47.0 p-10 -116.35 129.02 56.03 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 121.059 0.457 . . . . 1.0 110.644 179.874 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 42.5 m-85 -122.22 113.2 19.12 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 115.867 -0.606 . . . . 1.0 109.507 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -92.81 -3.66 54.33 Favored 'General case' 0 C--N 1.317 -0.822 0 CA-C-N 115.982 -0.554 . . . . 1.0 111.537 -179.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 79.9 m-20 -147.64 137.26 22.64 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 109.001 -0.74 . . . . 1.0 109.001 179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.574 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 6.1 p80 -58.93 -37.87 77.66 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-O 121.059 0.457 . . . . 1.0 111.035 -179.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -55.73 -7.83 0.33 Allowed 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.917 -0.583 . . . . 1.0 110.494 179.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.437 ' H ' ' C ' ' A' ' 66' ' ' HIS . 23.7 mm-40 -83.14 -33.9 26.15 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 120.675 -0.41 . . . . 1.0 111.694 -178.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.445 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.0 p90 -94.41 15.57 17.36 Favored 'General case' 0 C--N 1.323 -0.581 0 C-N-CA 120.812 -0.355 . . . . 1.0 110.813 179.631 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.437 ' C ' ' H ' ' A' ' 72' ' ' LEU . 53.3 mtt 75.4 27.92 1.02 Allowed 'General case' 0 C--N 1.329 -0.311 0 O-C-N 123.912 0.757 . . . . 1.0 109.942 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.588 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.04 39.82 0.82 Allowed Glycine 0 C--N 1.339 0.727 0 C-N-CA 120.135 -1.031 . . . . 1.0 111.999 -179.46 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.494 ' C ' ' O ' ' A' ' 71' ' ' GLY . 10.3 mt -17.38 -47.75 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.352 0.661 . . . . 1.0 110.823 -178.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.588 ' N ' ' O ' ' A' ' 71' ' ' GLY . 83.2 p -102.64 117.34 34.46 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 115.628 -0.715 . . . . 1.0 109.113 177.503 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -66.26 37.28 0.02 OUTLIER 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.335 -0.393 . . . . 1.0 111.172 -179.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.546 ' H ' ' C ' ' A' ' 73' ' ' SER . 35.6 t -117.36 127.14 53.75 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 109.742 -0.466 . . . . 1.0 109.742 -179.829 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.1 p -163.57 118.1 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.642 0 N-CA-C 109.03 -0.73 . . . . 1.0 109.03 -179.291 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 84.0 mtm180 -131.21 12.99 5.12 Favored 'General case' 0 CA--C 1.521 -0.163 0 CA-C-N 116.3 -0.409 . . . . 1.0 110.976 -178.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . 0.504 ' OG ' ' O ' ' A' ' 24' ' ' THR . 3.5 m -160.84 159.55 29.99 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.306 0.574 . . . . 1.0 111.104 178.181 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 16.5 p -155.56 146.55 22.42 Favored 'General case' 0 CA--C 1.511 -0.534 0 CA-C-N 115.229 -0.896 . . . . 1.0 110.984 -178.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.602 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 7.9 ptm180 -125.49 150.8 47.05 Favored 'General case' 0 CA--C 1.514 -0.439 0 N-CA-C 109.281 -0.637 . . . . 1.0 109.281 178.72 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.706 HD23 ' N ' ' A' ' 82' ' ' ILE . 3.8 tt -102.6 121.84 43.21 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 107.347 -1.353 . . . . 1.0 107.347 178.405 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.706 ' N ' HD23 ' A' ' 81' ' ' LEU . 5.3 mt -84.12 116.64 65.87 Favored Pre-proline 0 C--N 1.321 -0.667 0 CA-C-N 116.115 -0.493 . . . . 1.0 109.903 -178.274 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -53.81 150.53 29.27 Favored 'Trans proline' 0 N--CA 1.5 1.884 0 C-N-CA 121.912 1.741 . . . . 1.0 113.219 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 28.2 p80 -71.77 177.7 4.04 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.251 -0.886 . . . . 1.0 110.614 179.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 11.7 t -168.24 147.4 4.54 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 116.167 -0.47 . . . . 1.0 110.971 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . -99.31 -56.04 1.01 Allowed Glycine 0 N--CA 1.465 0.615 0 N-CA-C 110.397 -1.081 . . . . 1.0 110.397 179.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 2.6 m -90.19 144.69 25.63 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.85 0.357 . . . . 1.0 110.093 179.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 7.2 m80 -133.48 110.11 9.74 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 116.081 -0.509 . . . . 1.0 110.856 -179.627 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 55.3 ttm-85 -137.99 131.69 31.14 Favored 'General case' 0 N--CA 1.468 0.429 0 C-N-CA 120.839 -0.344 . . . . 1.0 110.084 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.428 HG22 ' CZ2' ' A' ' 131' ' ' TRP . 19.5 tt -147.84 148.26 16.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-O 120.84 0.352 . . . . 1.0 111.114 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 83.6 mtp180 -125.73 98.07 5.41 Favored 'General case' 0 N--CA 1.465 0.28 0 CA-C-N 115.565 -0.743 . . . . 1.0 111.699 -179.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . 0.428 HD11 HD22 ' A' ' 167' ' ' LEU . 17.4 mt -75.57 135.95 40.54 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 115.88 -0.6 . . . . 1.0 110.071 179.075 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.413 ' CG ' ' HA ' ' A' ' 98' ' ' TYR . 63.7 m-85 -117.78 138.28 52.16 Favored 'General case' 0 C--O 1.242 0.667 0 CA-C-O 121.566 0.698 . . . . 1.0 111.481 -179.439 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.526 ' OE1' ' CD1' ' A' ' 118' ' ' PHE . 0.8 OUTLIER -56.56 -65.04 0.68 Allowed 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 115.348 -0.842 . . . . 1.0 111.79 179.731 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -96.68 173.25 7.42 Favored 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.352 0.596 . . . . 1.0 111.446 -178.674 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 76.7 mt-10 -64.05 167.53 6.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 114.845 -1.071 . . . . 1.0 111.697 179.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . 0.498 ' C ' ' CG ' ' A' ' 98' ' ' TYR . 66.5 t0 49.35 36.51 9.77 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 114.83 -1.077 . . . . 1.0 111.093 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.57 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.0 OUTLIER 56.13 35.75 26.21 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.313 -0.858 . . . . 1.0 110.639 178.344 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 78.7 mtp85 -99.25 148.91 23.65 Favored 'General case' 0 N--CA 1.467 0.38 0 CA-C-O 121.129 0.49 . . . . 1.0 110.812 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 90.08 -164.62 31.17 Favored Glycine 0 CA--C 1.525 0.67 0 N-CA-C 111.27 -0.732 . . . . 1.0 111.27 -179.746 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 68.1 tp60 -63.07 146.13 53.92 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 120.958 0.408 . . . . 1.0 110.798 -179.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.497 ' C ' ' SD ' ' A' ' 102' ' ' MET . 4.1 ppp? -132.49 158.67 41.5 Favored 'General case' 0 CA--C 1.519 -0.241 0 CA-C-N 115.805 -0.634 . . . . 1.0 110.743 179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 10.8 tt -148.85 142.07 18.36 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.551 0 N-CA-C 109.833 -0.432 . . . . 1.0 109.833 178.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 73.4 tt0 -113.53 141.94 46.55 Favored 'General case' 0 N--CA 1.468 0.462 0 CA-C-O 121.619 0.723 . . . . 1.0 110.804 -178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.783 ' CZ ' HD11 ' A' ' 112' ' ' LEU . 83.7 m-85 -129.32 151.68 49.71 Favored 'General case' 0 CA--C 1.518 -0.256 0 CA-C-N 114.669 -1.15 . . . . 1.0 110.267 -179.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 12.4 p -143.63 16.95 1.82 Allowed 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.177 -0.465 . . . . 1.0 111.082 179.889 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.97 ' O ' ' O ' ' A' ' 108' ' ' ASP . 4.9 pt-20 -166.31 86.14 0.32 Allowed 'General case' 0 C--O 1.213 -0.867 0 CA-C-O 118.328 -0.844 . . . . 1.0 111.013 179.647 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.97 ' O ' ' O ' ' A' ' 107' ' ' GLU . 7.8 t70 16.68 154.34 0.0 OUTLIER 'General case' 0 N--CA 1.483 1.222 0 CA-C-O 122.231 1.015 . . . . 1.0 113.16 178.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 4.1 t -140.99 104.82 4.74 Favored 'General case' 0 C--N 1.32 -0.675 0 O-C-N 121.098 -1.001 . . . . 1.0 110.531 178.45 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . . . . . . . . . 1.3 m -64.52 -31.72 73.05 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-N 116.246 -0.434 . . . . 1.0 110.726 179.848 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 14.2 t -137.09 90.14 2.5 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.073 -0.512 . . . . 1.0 110.099 -179.607 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.783 HD11 ' CZ ' ' A' ' 105' ' ' PHE . 12.2 tp -62.03 -42.86 99.62 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-N 115.736 -0.666 . . . . 1.0 110.423 -178.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.615 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 25.8 mp0 -43.08 -9.7 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 112.417 0.525 . . . . 1.0 112.417 -179.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.553 ' N ' ' O ' ' A' ' 112' ' ' LEU . 84.0 m-20 -95.31 -20.83 18.83 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.176 0.512 . . . . 1.0 110.472 179.671 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.441 ' N ' ' O ' ' A' ' 112' ' ' LEU . 24.9 mmt85 -109.96 -35.72 6.07 Favored 'General case' 0 N--CA 1.466 0.374 0 CA-C-N 115.405 -0.816 . . . . 1.0 113.149 -178.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.676 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -121.71 137.24 54.83 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-O 121.765 0.793 . . . . 1.0 110.151 -179.899 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.431 ' O ' ' C ' ' A' ' 118' ' ' PHE . 85.8 mtt180 -75.27 -70.66 0.41 Allowed 'General case' 0 C--N 1.318 -0.8 0 O-C-N 120.914 -1.116 . . . . 1.0 110.653 -177.739 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.632 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 87.4 m-85 -33.0 145.47 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.406 0 CA-C-N 115.513 -0.767 . . . . 1.0 110.307 179.741 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -104.32 10.49 35.48 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 120.779 0.323 . . . . 1.0 111.115 -178.237 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . 0.438 ' O ' ' OE2' ' A' ' 94' ' ' GLU . 76.7 mt-10 -141.07 141.72 34.23 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 121.087 0.47 . . . . 1.0 111.228 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 35.4 mm -122.68 116.44 48.89 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.475 0 CA-C-N 115.564 -0.744 . . . . 1.0 109.116 178.273 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.463 ' O ' ' CB ' ' A' ' 123' ' ' SER . 41.7 m-70 -109.34 31.13 5.99 Favored 'General case' 0 CA--C 1.514 -0.433 0 CA-C-N 116.016 -0.538 . . . . 1.0 111.333 -178.373 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.463 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.6 t 161.59 150.82 0.01 OUTLIER 'General case' 0 CA--C 1.515 -0.381 0 CA-C-O 121.14 0.495 . . . . 1.0 110.661 179.368 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.437 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 0.9 OUTLIER -159.63 156.05 27.23 Favored 'General case' 0 N--CA 1.451 -0.387 0 CA-C-N 115.524 -0.762 . . . . 1.0 110.529 -178.734 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -126.87 107.26 9.95 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.702 -0.481 . . . . 1.0 109.702 -179.239 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.598 HG13 ' H ' ' A' ' 149' ' ' GLY . 1.1 p -104.57 108.18 24.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 108.666 -0.864 . . . . 1.0 108.666 179.245 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.965 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.3 OUTLIER -78.4 -33.25 48.86 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 114.875 -1.057 . . . . 1.0 110.83 -179.04 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 -148.61 164.76 33.34 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-O 121.277 0.561 . . . . 1.0 110.859 -178.389 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 55.81 170.0 0.09 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 N-CA-C 110.416 -1.074 . . . . 1.0 110.416 -179.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.514 ' OG ' HD11 ' A' ' 145' ' ' LEU . 4.1 t -115.67 146.76 41.55 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.436 ' CD1' ' N ' ' A' ' 131' ' ' TRP . 41.1 m95 -120.79 161.16 21.95 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.926 -0.579 . . . . 1.0 111.076 -177.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 21.7 t -135.84 98.56 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 112.027 0.381 . . . . 1.0 112.027 179.887 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.622 HD13 HD11 ' A' ' 146' ' ' LEU . 5.5 mp -69.71 138.51 52.93 Favored 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.527 -0.306 . . . . 1.0 110.26 -179.012 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . 0.63 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 43.3 m-85 -118.31 133.4 55.92 Favored 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.825 -0.625 . . . . 1.0 110.802 179.205 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . 0.448 ' OE2' ' CD ' ' A' ' 163' ' ' ARG . 42.9 tp10 -39.94 -56.14 1.88 Allowed 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.858 -0.61 . . . . 1.0 111.199 179.591 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.59 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.5 OUTLIER -123.92 170.45 10.58 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 116.051 -0.522 . . . . 1.0 110.487 -178.494 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 22.0 p -74.7 169.16 18.39 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.372 -0.831 . . . . 1.0 110.744 179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 59.6 t30 67.24 17.27 10.27 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.268 -0.878 . . . . 1.0 109.667 -178.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . 0.402 ' OH ' ' OD1' ' A' ' 108' ' ' ASP . 12.0 m-85 38.1 80.11 0.03 OUTLIER 'General case' 0 N--CA 1.465 0.304 0 CA-C-N 115.873 -0.603 . . . . 1.0 112.215 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.534 ' C ' HD11 ' A' ' 136' ' ' LEU . 15.9 tpp180 -148.98 39.79 0.86 Allowed 'General case' 0 N--CA 1.472 0.661 0 CA-C-O 120.815 0.34 . . . . 1.0 110.326 179.302 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . . . . . . . . . . . -151.15 -136.28 2.47 Favored Glycine 0 CA--C 1.523 0.576 0 N-CA-C 111.197 -0.761 . . . . 1.0 111.197 -177.882 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . 0.451 ' NH2' HD13 ' A' ' 54' ' ' LEU . 77.1 mtp85 -81.22 172.34 13.75 Favored 'General case' 0 CA--C 1.518 -0.274 0 N-CA-C 110.209 -0.293 . . . . 1.0 110.209 179.937 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -149.35 134.85 18.49 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.075 -0.512 . . . . 1.0 111.188 -179.433 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.2 m-85 -130.05 120.0 24.0 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-O 120.924 0.392 . . . . 1.0 110.212 179.122 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.514 HD11 ' OG ' ' A' ' 130' ' ' SER . 53.2 tp -79.97 131.24 35.78 Favored 'General case' 0 CA--C 1.513 -0.473 0 CA-C-O 121.614 0.721 . . . . 1.0 110.8 179.611 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.622 HD11 HD13 ' A' ' 133' ' ' LEU . 22.9 mt -117.27 105.03 11.76 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 114.619 -1.173 . . . . 1.0 109.023 179.34 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.602 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 4.7 mtm -77.52 159.56 76.89 Favored Pre-proline 0 C--N 1.325 -0.462 0 N-CA-C 109.823 -0.436 . . . . 1.0 109.823 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.7 Cg_endo -56.45 114.81 2.08 Favored 'Trans proline' 0 C--N 1.307 -1.612 0 C-N-CA 122.207 1.938 . . . . 1.0 111.999 179.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . 0.598 ' H ' HG13 ' A' ' 126' ' ' VAL . . . 175.21 -154.98 19.46 Favored Glycine 0 CA--C 1.531 1.038 0 N-CA-C 110.661 -0.976 . . . . 1.0 110.661 -179.299 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.446 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 50.5 p-10 -121.23 136.11 55.02 Favored 'General case' 0 N--CA 1.464 0.23 0 CA-C-O 121.061 0.458 . . . . 1.0 110.715 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.542 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 9.8 m-85 -127.29 126.76 43.21 Favored 'General case' 0 C--N 1.33 -0.266 0 N-CA-C 109.369 -0.604 . . . . 1.0 109.369 -179.758 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 32.1 ptt-85 -117.22 3.67 12.63 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 120.874 0.369 . . . . 1.0 110.305 -179.662 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -162.37 160.72 26.87 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.532 0.682 . . . . 1.0 110.482 178.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.581 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -74.68 -17.96 60.6 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 114.869 -1.06 . . . . 1.0 111.93 -178.476 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.534 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.5 mt-30 -66.4 -20.55 66.1 Favored 'General case' 0 N--CA 1.465 0.284 0 CA-C-N 116.115 -0.493 . . . . 1.0 111.214 -179.189 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . 0.542 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 41.6 t0 -50.39 -49.47 54.39 Favored 'General case' 0 C--N 1.312 -1.035 0 CA-C-N 115.962 -0.563 . . . . 1.0 111.067 -178.686 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.553 ' NE1' ' HB2' ' A' ' 159' ' ' ALA . 36.1 p90 -101.55 19.2 18.42 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-O 121.033 0.444 . . . . 1.0 110.323 179.963 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 53.0 75.14 0.24 Allowed Glycine 0 CA--C 1.518 0.253 0 CA-C-N 115.617 -0.719 . . . . 1.0 111.433 179.212 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.581 ' HB3' ' CD2' ' A' ' 154' ' ' TYR . . . -95.4 -171.14 2.32 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.106 0.479 . . . . 1.0 110.71 179.566 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -121.31 -40.85 2.55 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.295 -0.866 . . . . 1.0 111.955 -178.099 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.631 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.7 OUTLIER -143.01 -16.52 0.68 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 116.313 -0.403 . . . . 1.0 111.974 -177.744 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.631 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 90.32 -21.24 0.12 Allowed 'General case' 0 N--CA 1.467 0.399 0 CA-C-N 115.504 -0.771 . . . . 1.0 110.832 179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.448 ' CD ' ' OE2' ' A' ' 135' ' ' GLU . 17.4 ptp180 -44.35 123.56 3.57 Favored 'General case' 0 N--CA 1.447 -0.599 0 CA-C-O 121.593 0.711 . . . . 1.0 110.939 -178.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 162' ' ' ALA . 11.8 t -119.54 156.08 22.03 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.631 0 CA-C-N 115.159 -0.928 . . . . 1.0 110.343 179.876 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.532 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -128.11 -34.47 0.54 Allowed Glycine 0 CA--C 1.518 0.28 0 CA-C-N 115.711 -0.677 . . . . 1.0 111.512 -179.882 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 4.9 p -159.17 -167.72 2.15 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 110.051 -0.351 . . . . 1.0 110.051 -178.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.589 HD21 HD13 ' A' ' 112' ' ' LEU . 1.8 pp -174.49 137.06 0.48 Allowed 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.283 -0.417 . . . . 1.0 110.357 -179.376 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.635 ' NH1' ' NH2' ' A' ' 59' ' ' ARG . 8.1 ptp180 -131.94 150.18 52.23 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.27 0.557 . . . . 1.0 109.845 179.278 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 59.2 mtm180 -81.49 153.25 26.94 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 115.454 -0.793 . . . . 1.0 108.956 178.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . . . . . . . . . 54.7 t -87.78 88.19 2.86 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.377 0 CA-C-O 120.921 0.391 . . . . 1.0 111.309 -179.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.438 ' CG2' ' H ' ' A' ' 174' ' ' SER . 3.5 mp -137.69 134.45 45.89 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.837 -0.619 . . . . 1.0 110.084 179.335 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 19.6 p-10 -103.56 -6.36 21.8 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.977 -0.556 . . . . 1.0 110.737 -179.677 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.694 ' CG ' ' N ' ' A' ' 174' ' ' SER . 0.0 OUTLIER -95.99 -65.27 0.98 Allowed 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.501 -0.555 . . . . 1.0 109.501 179.763 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . 0.694 ' N ' ' CG ' ' A' ' 173' ' ' PHE . 68.5 m . . . . . 0 C--O 1.221 -0.416 0 CA-C-O 117.678 -1.153 . . . . 1.0 111.143 -178.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 66.1 tp60 . . . . . 0 N--CA 1.489 1.505 0 N-CA-C 109.16 -0.681 . . . . 1.0 109.16 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.612 ' H ' HD21 ' A' ' 81' ' ' LEU . . . -80.37 174.2 54.94 Favored Glycine 0 CA--C 1.525 0.704 0 N-CA-C 110.629 -0.988 . . . . 1.0 110.629 -179.933 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.0 mttm 179.21 103.84 0.03 OUTLIER 'General case' 0 C--O 1.233 0.211 0 O-C-N 122.676 -0.308 . . . . 1.0 110.289 179.115 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -119.77 170.94 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.316 0 CA-C-N 116.358 -0.383 . . . . 1.0 110.838 -178.935 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.543 HG22 ' CE1' ' A' ' 7' ' ' TYR . 31.4 m -129.53 121.24 26.8 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 108.256 -1.016 . . . . 1.0 108.256 177.112 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.3 mt -106.6 132.79 52.2 Favored 'General case' 0 CA--C 1.519 -0.242 0 CA-C-N 114.939 -1.028 . . . . 1.0 110.238 -179.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.543 ' CE1' HG22 ' A' ' 5' ' ' THR . 50.9 m-85 -114.42 130.47 56.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-N 115.355 -0.839 . . . . 1.0 111.127 -178.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.451 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 83.8 tt0 -55.8 -24.15 34.31 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 115.464 -0.789 . . . . 1.0 110.403 -179.349 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 98.0 m-20 -126.91 153.48 45.71 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-O 121.173 0.511 . . . . 1.0 110.221 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 30.6 ptt85 -56.63 -173.11 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.545 -0.752 . . . . 1.0 110.51 -179.241 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 40.69 30.24 0.32 Allowed Glycine 0 C--N 1.333 0.408 0 N-CA-C 110.994 -0.842 . . . . 1.0 110.994 178.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . 0.557 ' CE1' ' OG ' ' A' ' 35' ' ' SER . 4.7 m-85 46.38 68.94 0.53 Allowed 'General case' 0 C--N 1.32 -0.709 0 CA-C-N 115.472 -0.364 . . . . 1.0 110.405 -179.665 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 61.3 mt-30 -126.88 -157.49 0.81 Allowed 'General case' 0 N--CA 1.467 0.413 0 CA-C-N 116.362 -0.381 . . . . 1.0 110.487 179.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 40.15 -146.9 0.26 Allowed Glycine 0 CA--C 1.526 0.753 0 N-CA-C 110.972 -0.851 . . . . 1.0 110.972 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 30.2 mmt180 -74.54 150.13 39.91 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 120.905 0.383 . . . . 1.0 110.695 -179.848 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 13.9 p-80 -136.98 145.38 44.08 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-O 121.334 0.588 . . . . 1.0 110.24 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.511 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 7.1 t80 -139.89 142.78 36.47 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.069 -0.969 . . . . 1.0 109.893 179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.511 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.1 tt0 -111.24 122.99 49.3 Favored 'General case' 0 C--N 1.331 -0.208 0 CA-C-N 115.746 -0.661 . . . . 1.0 110.293 -179.616 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 t -109.51 126.58 53.69 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 116.17 -0.468 . . . . 1.0 109.947 179.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 35.0 m -117.38 7.32 12.78 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 116.032 -0.531 . . . . 1.0 110.308 -179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 89.5 p -153.84 167.9 28.13 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.989 -0.55 . . . . 1.0 110.816 -179.091 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . 0.443 ' OD1' ' O ' ' A' ' 22' ' ' ASP . 51.9 p-10 -57.72 137.46 56.48 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-N 115.708 -0.678 . . . . 1.0 111.493 -179.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -135.03 149.25 50.11 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 115.619 -0.718 . . . . 1.0 110.649 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 16.1 p -116.75 -18.9 10.14 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-N 115.799 -0.637 . . . . 1.0 112.083 -179.617 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.451 ' OD1' ' CG ' ' A' ' 28' ' ' PRO . 2.3 t-20 -132.1 115.64 16.01 Favored 'General case' 0 C--N 1.318 -0.798 0 CA-C-O 121.246 0.546 . . . . 1.0 110.503 -178.633 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.8 mp -115.39 -8.14 12.26 Favored 'General case' 0 N--CA 1.466 0.373 0 CA-C-N 115.458 -0.792 . . . . 1.0 110.027 179.409 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.621 ' N ' ' CD ' ' A' ' 28' ' ' PRO . 12.6 mt-30 -60.13 -41.41 84.41 Favored Pre-proline 0 CA--C 1.516 -0.358 0 C-N-CA 120.454 -0.498 . . . . 1.0 110.43 -179.444 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.621 ' CD ' ' N ' ' A' ' 27' ' ' GLN . 36.6 Cg_exo -58.61 -41.28 65.85 Favored 'Trans proline' 0 C--N 1.304 -1.77 0 C-N-CA 122.084 1.856 . . . . 1.0 112.112 -179.835 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . . . . . . . . . 9.1 m-85 -92.96 -47.41 7.02 Favored 'General case' 0 N--CA 1.463 0.203 0 CA-C-O 121.164 0.507 . . . . 1.0 111.103 -178.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . . . . . . . . . 15.8 mt -117.56 128.02 54.54 Favored 'General case' 0 CA--C 1.517 -0.327 0 CA-C-N 115.46 -0.791 . . . . 1.0 111.307 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 3.5 t -90.88 -16.31 28.41 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.095 -0.502 . . . . 1.0 111.133 179.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.451 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 43.9 ttm180 -174.5 119.84 0.24 Allowed 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 108.955 -0.757 . . . . 1.0 108.955 -179.495 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 46.6 t -99.2 112.08 24.32 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-O 120.678 0.275 . . . . 1.0 110.644 179.283 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 98.3 m-20 -106.25 -3.97 20.67 Favored 'General case' 0 C--O 1.218 -0.591 0 CA-C-N 116.343 -0.39 . . . . 1.0 110.229 179.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.557 ' OG ' ' CE1' ' A' ' 12' ' ' PHE . 4.6 t -156.16 155.64 32.83 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.881 0.372 . . . . 1.0 110.309 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -152.74 155.5 37.32 Favored 'General case' 0 CA--C 1.519 -0.224 0 CA-C-N 116.092 -0.503 . . . . 1.0 110.786 -179.059 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 20.0 mtt-85 -135.15 122.76 22.11 Favored 'General case' 0 C--O 1.212 -0.872 0 N-CA-C 108.953 -0.758 . . . . 1.0 108.953 179.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 62.3 t -107.99 130.08 61.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.442 0 CA-C-O 121.156 0.503 . . . . 1.0 109.66 179.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 33.1 t0 -90.07 -43.21 10.65 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.276 -0.875 . . . . 1.0 110.635 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 34.2 p -161.8 164.45 28.84 Favored 'General case' 0 N--CA 1.447 -0.595 0 N-CA-C 109.725 -0.472 . . . . 1.0 109.725 -179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . 0.422 ' H ' ' CG ' ' A' ' 172' ' ' ASP . . . 76.49 175.87 41.29 Favored Glycine 0 C--N 1.316 -0.549 0 N-CA-C 111.278 -0.729 . . . . 1.0 111.278 179.1 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 97.7 m -111.69 129.63 56.04 Favored 'General case' 0 C--N 1.33 -0.242 0 N-CA-C 109.484 -0.562 . . . . 1.0 109.484 178.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.47 145.81 43.02 Favored 'General case' 0 N--CA 1.465 0.293 0 CA-C-N 116.027 -0.533 . . . . 1.0 110.751 -179.551 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.567 ' C ' HD12 ' A' ' 45' ' ' LEU . 17.3 tpp -122.05 130.55 53.37 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.282 -0.872 . . . . 1.0 109.496 179.005 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.567 HD12 ' C ' ' A' ' 44' ' ' MET . 10.1 mp -108.69 131.82 54.54 Favored 'General case' 0 C--N 1.331 -0.22 0 CA-C-N 115.544 -0.753 . . . . 1.0 109.429 -179.598 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . 0.402 ' CG ' ' HA ' ' A' ' 51' ' ' TYR . 85.3 m-85 -111.17 132.28 54.43 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 121.383 0.611 . . . . 1.0 111.814 -179.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.625 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 5.7 pt-20 -57.08 -36.14 70.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.271 -0.877 . . . . 1.0 111.261 -179.177 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . 0.421 ' N ' ' HG3' ' A' ' 47' ' ' GLU . 3.9 mt-30 -107.31 153.37 41.21 Favored Pre-proline 0 C--N 1.332 -0.167 0 CA-C-N 115.939 -0.573 . . . . 1.0 110.598 -178.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 39.8 Cg_endo -65.13 159.59 46.04 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 C-N-CA 122.419 2.079 . . . . 1.0 112.045 178.529 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.688 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.7 OUTLIER 62.92 34.66 14.02 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 115.545 -0.752 . . . . 1.0 111.388 -179.967 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.402 ' HA ' ' CG ' ' A' ' 46' ' ' TYR . 4.6 m-85 54.1 76.45 0.23 Allowed 'General case' 0 C--N 1.318 -0.773 0 CA-C-N 115.267 -0.878 . . . . 1.0 111.439 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 1.1 m -146.04 154.15 41.54 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.077 0.465 . . . . 1.0 110.442 -178.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 86.64 -148.41 21.85 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 121.031 -0.604 . . . . 1.0 111.805 179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.625 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 46.7 tp -75.61 144.11 41.94 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.358 -0.421 . . . . 1.0 110.475 -179.392 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.55 ' NE2' ' O ' ' A' ' 143' ' ' GLN . 2.0 pt20 -119.31 153.57 34.87 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.549 0.214 . . . . 1.0 110.496 179.169 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.448 ' C ' ' SD ' ' A' ' 44' ' ' MET . 39.9 m-85 -125.93 123.63 38.99 Favored 'General case' 0 C--N 1.345 0.396 0 CA-C-O 120.821 0.344 . . . . 1.0 110.457 179.502 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.465 ' N ' ' OE1' ' A' ' 143' ' ' GLN . 43.2 t80 -82.87 123.25 29.21 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-N 115.982 -0.554 . . . . 1.0 110.128 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 7.3 mp -120.27 145.06 47.42 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.248 -0.887 . . . . 1.0 110.5 -179.648 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.401 ' O ' ' C ' ' A' ' 60' ' ' ARG . 44.8 mtp180 -132.13 157.52 44.04 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.103 -0.953 . . . . 1.0 110.433 179.464 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.401 ' C ' ' O ' ' A' ' 59' ' ' ARG . 73.1 ttp85 -37.54 126.67 1.11 Allowed 'General case' 0 N--CA 1.455 -0.204 0 CA-C-N 115.856 -0.611 . . . . 1.0 110.765 -179.135 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 156.56 179.9 31.9 Favored Glycine 0 CA--C 1.523 0.583 0 N-CA-C 110.471 -1.051 . . . . 1.0 110.471 -179.496 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.43 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 43.7 p-10 -114.34 127.68 55.98 Favored 'General case' 0 N--CA 1.464 0.255 0 CA-C-O 120.984 0.421 . . . . 1.0 110.399 179.868 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . 0.456 ' O ' ' OG ' ' A' ' 35' ' ' SER . 41.3 m-85 -122.3 113.53 19.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.85 -0.614 . . . . 1.0 109.761 179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.419 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -91.94 -4.04 55.17 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-N 116.199 -0.455 . . . . 1.0 111.282 -179.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.419 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 78.7 m-20 -146.79 139.21 24.9 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.413 -0.588 . . . . 1.0 109.413 179.744 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.495 ' C ' ' H ' ' A' ' 68' ' ' GLN . 16.2 p-80 -60.18 -42.17 94.43 Favored 'General case' 0 CA--C 1.519 -0.236 0 CA-C-O 120.987 0.423 . . . . 1.0 111.121 -178.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -53.18 -7.47 0.09 Allowed 'General case' 0 C--N 1.315 -0.899 0 CA-C-N 116.01 -0.541 . . . . 1.0 110.498 179.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.495 ' H ' ' C ' ' A' ' 66' ' ' HIS . 20.9 mm-40 -82.17 -32.25 30.05 Favored 'General case' 0 N--CA 1.468 0.437 0 C-N-CA 120.493 -0.483 . . . . 1.0 111.269 -178.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.439 ' CZ2' ' CB ' ' A' ' 66' ' ' HIS . 2.1 p90 -97.09 16.85 18.47 Favored 'General case' 0 C--N 1.318 -0.775 0 C-N-CA 120.807 -0.357 . . . . 1.0 110.743 179.264 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.46 ' C ' ' H ' ' A' ' 72' ' ' LEU . 78.6 mtp 73.34 29.84 1.6 Allowed 'General case' 0 C--O 1.226 -0.175 0 O-C-N 123.838 0.711 . . . . 1.0 109.857 -179.143 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . 0.591 ' O ' ' N ' ' A' ' 73' ' ' SER . . . -73.55 38.46 0.87 Allowed Glycine 0 C--N 1.338 0.663 0 C-N-CA 120.122 -1.037 . . . . 1.0 111.606 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . 0.505 ' C ' ' O ' ' A' ' 71' ' ' GLY . 11.7 mt -16.45 -49.13 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 123.357 0.663 . . . . 1.0 110.937 -178.713 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.591 ' N ' ' O ' ' A' ' 71' ' ' GLY . 39.5 t -102.49 117.58 35.0 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 115.428 -0.805 . . . . 1.0 109.003 177.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 48.5 p-10 -68.05 37.07 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.036 -0.529 . . . . 1.0 110.84 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.529 ' H ' ' C ' ' A' ' 73' ' ' SER . 73.3 m -116.29 125.49 52.25 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.828 -0.434 . . . . 1.0 109.828 -179.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 2.4 p -163.67 111.58 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.586 0 N-CA-C 109.021 -0.733 . . . . 1.0 109.021 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 89.7 mtm180 -120.76 14.38 11.69 Favored 'General case' 0 N--CA 1.465 0.296 0 CA-C-N 116.353 -0.385 . . . . 1.0 110.941 -178.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 21.6 p -164.91 163.07 21.04 Favored 'General case' 0 CA--C 1.514 -0.413 0 CA-C-O 121.05 0.452 . . . . 1.0 110.975 178.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 12.3 p -154.87 146.24 22.99 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 115.795 -0.638 . . . . 1.0 110.248 -178.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.428 ' NH2' ' SD ' ' A' ' 147' ' ' MET . 1.6 ptm180 -127.68 148.01 50.39 Favored 'General case' 0 CA--C 1.518 -0.286 0 CA-C-O 120.637 0.256 . . . . 1.0 110.514 -179.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.612 HD21 ' H ' ' A' ' 2' ' ' GLY . 9.4 tp -96.0 111.37 23.4 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 107.846 -1.168 . . . . 1.0 107.846 177.656 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 18.9 mt -57.2 110.47 2.47 Favored Pre-proline 0 C--N 1.322 -0.591 0 C-N-CA 120.247 -0.581 . . . . 1.0 110.629 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.462 ' C ' ' CG ' ' A' ' 84' ' ' HIS . 37.9 Cg_endo -79.64 174.12 12.16 Favored 'Trans proline' 0 N--CA 1.49 1.316 0 C-N-CA 121.989 1.792 . . . . 1.0 111.556 -179.803 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . 0.474 ' CD2' ' CD ' ' A' ' 148' ' ' PRO . 29.2 m-70 83.27 132.45 0.05 Allowed 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 112.665 0.617 . . . . 1.0 112.665 177.375 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 10.1 p -160.05 163.02 34.28 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.345 -0.389 . . . . 1.0 110.774 178.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.518 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . 118.25 -112.46 2.39 Favored Glycine 0 N--CA 1.465 0.568 0 N-CA-C 110.877 -0.889 . . . . 1.0 110.877 -179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 5.2 m -83.18 155.61 23.65 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 109.663 -0.495 . . . . 1.0 109.663 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.518 ' NE2' ' O ' ' A' ' 86' ' ' GLY . 2.5 m80 -131.64 115.28 15.86 Favored 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 121.115 -0.234 . . . . 1.0 110.811 -179.361 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . . . . . . . . . 46.3 mtm-85 -143.38 134.64 25.9 Favored 'General case' 0 C--N 1.33 -0.265 0 C-N-CA 120.623 -0.431 . . . . 1.0 110.017 178.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.516 HD12 HG22 ' A' ' 126' ' ' VAL . 15.7 tt -146.58 143.81 20.55 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 CA-C-O 120.719 0.295 . . . . 1.0 110.967 -179.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 88.3 mtm180 -121.33 97.7 5.63 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.872 -0.604 . . . . 1.0 111.427 -179.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.9 mt -76.56 138.29 40.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.971 -0.559 . . . . 1.0 110.184 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 55.5 m-85 -117.0 136.47 52.92 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-N 115.432 -0.803 . . . . 1.0 111.093 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.561 ' N ' ' OE1' ' A' ' 94' ' ' GLU . 0.0 OUTLIER -57.99 -70.28 0.14 Allowed 'General case' 0 N--CA 1.45 -0.454 0 CA-C-N 115.674 -0.694 . . . . 1.0 111.135 179.628 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 1.9 mpt_? -96.17 174.51 6.86 Favored 'General case' 0 N--CA 1.465 0.278 0 CA-C-O 121.29 0.567 . . . . 1.0 110.639 -178.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -65.51 165.05 12.82 Favored 'General case' 0 CA--C 1.517 -0.326 0 CA-C-N 115.188 -0.914 . . . . 1.0 110.58 -179.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 98.1 m-20 42.6 26.54 0.07 Allowed 'General case' 0 C--N 1.323 -0.556 0 CA-C-N 115.502 -0.772 . . . . 1.0 110.855 179.865 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.521 ' CD1' ' N ' ' A' ' 98' ' ' TYR . 0.7 OUTLIER 64.66 26.44 13.17 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.064 -0.517 . . . . 1.0 111.349 178.897 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 41.9 mmm-85 -81.55 41.99 0.66 Allowed 'General case' 0 C--N 1.326 -0.453 0 CA-C-O 121.193 0.52 . . . . 1.0 111.373 -177.664 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -169.72 -175.22 38.63 Favored Glycine 0 CA--C 1.525 0.677 0 N-CA-C 111.025 -0.83 . . . . 1.0 111.025 -179.477 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . . . . . . . . . 5.2 tp-100 -58.01 151.22 18.99 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.85 0.357 . . . . 1.0 110.332 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . . . . . . . . . 2.6 ptm -130.79 156.37 45.1 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 115.853 -0.612 . . . . 1.0 111.358 -179.74 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 7.9 tt -150.56 142.53 16.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.517 0 N-CA-C 109.632 -0.507 . . . . 1.0 109.632 177.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 80.9 tt0 -113.56 144.09 43.46 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.435 0.636 . . . . 1.0 110.81 -178.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.647 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 78.0 m-85 -131.01 152.73 50.0 Favored 'General case' 0 CA--C 1.52 -0.209 0 CA-C-N 114.59 -1.186 . . . . 1.0 110.265 -179.618 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 19.4 p -143.2 10.85 1.73 Allowed 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.091 -0.504 . . . . 1.0 110.893 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.969 ' O ' ' O ' ' A' ' 108' ' ' ASP . 7.3 pt-20 -158.85 81.49 0.79 Allowed 'General case' 0 C--O 1.214 -0.766 0 CA-C-O 118.697 -0.668 . . . . 1.0 109.788 179.297 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.969 ' O ' ' O ' ' A' ' 107' ' ' GLU . 54.6 p30 19.86 162.02 0.0 OUTLIER 'General case' 0 C--O 1.216 -0.681 0 CA-C-O 122.336 1.065 . . . . 1.0 113.236 178.824 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 5.9 t -144.0 106.09 4.36 Favored 'General case' 0 C--N 1.315 -0.9 0 O-C-N 120.483 -1.386 . . . . 1.0 109.712 179.508 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.469 ' O ' ' OG ' ' A' ' 166' ' ' SER . 15.6 m -68.58 -28.02 66.58 Favored 'General case' 0 C--N 1.32 -0.675 0 CA-C-N 115.953 -0.567 . . . . 1.0 110.667 -179.25 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 37.1 t -139.38 89.19 2.32 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 121.183 0.516 . . . . 1.0 110.087 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.647 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 1.8 mt -62.29 -42.34 99.27 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 115.411 -0.813 . . . . 1.0 110.696 -179.456 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 30.2 mm-40 -45.98 -8.07 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.349 0 CA-C-N 116.19 -0.459 . . . . 1.0 111.288 179.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.55 ' N ' ' O ' ' A' ' 112' ' ' LEU . 63.8 t0 -96.73 -23.9 16.21 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-O 121.175 0.512 . . . . 1.0 110.526 179.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' A' ' 112' ' ' LEU . 28.2 mmt180 -104.49 -40.47 6.04 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 115.495 -0.775 . . . . 1.0 112.966 -178.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.692 ' CZ ' ' O ' ' A' ' 118' ' ' PHE . 0.1 OUTLIER -123.62 138.72 54.49 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-O 121.362 0.601 . . . . 1.0 109.8 -179.781 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . 0.453 ' O ' ' O ' ' A' ' 118' ' ' PHE . 90.6 mtt180 -71.86 -74.06 0.17 Allowed 'General case' 0 C--N 1.32 -0.714 0 O-C-N 121.594 -0.691 . . . . 1.0 111.308 -177.17 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.692 ' O ' ' CZ ' ' A' ' 116' ' ' PHE . 72.4 m-85 -29.56 146.23 0.01 OUTLIER 'General case' 0 C--O 1.213 -0.853 0 O-C-N 123.975 0.797 . . . . 1.0 110.413 179.899 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 39.1 t30 -106.47 13.18 28.79 Favored 'General case' 0 N--CA 1.471 0.588 0 CA-C-O 121.041 0.448 . . . . 1.0 111.155 -178.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -141.73 140.53 33.14 Favored 'General case' 0 C--N 1.332 -0.187 0 CA-C-N 115.912 -0.585 . . . . 1.0 111.113 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . . . . . . . . . 44.7 mm -120.74 117.12 52.07 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.287 0 CA-C-N 115.38 -0.827 . . . . 1.0 109.036 178.343 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . 0.471 ' O ' ' CB ' ' A' ' 123' ' ' SER . 38.3 m-70 -108.53 30.16 6.73 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 115.914 -0.584 . . . . 1.0 111.395 -178.357 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.471 ' CB ' ' O ' ' A' ' 122' ' ' HIS . 1.5 p 162.06 152.49 0.01 OUTLIER 'General case' 0 CA--C 1.518 -0.288 0 CA-C-O 121.034 0.445 . . . . 1.0 110.103 179.39 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.465 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.1 pp -163.32 157.71 20.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.686 -0.688 . . . . 1.0 110.149 -178.449 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.75 116.21 21.96 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 120.965 0.412 . . . . 1.0 109.999 179.612 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.516 HG22 HD12 ' A' ' 90' ' ' ILE . 24.0 t -102.78 104.82 17.13 Favored 'Isoleucine or valine' 0 C--O 1.234 0.28 0 CA-C-N 115.818 -0.628 . . . . 1.0 109.704 179.321 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.921 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.4 OUTLIER -78.33 -38.66 41.66 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.633 -0.712 . . . . 1.0 111.433 -179.945 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . . . . . . . . . 33.0 tp10 -141.59 155.95 45.72 Favored 'General case' 0 CA--C 1.521 -0.171 0 C-N-CA 120.536 -0.465 . . . . 1.0 110.757 -178.328 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . 51.96 -175.03 0.14 Allowed Glycine 0 N--CA 1.449 -0.446 0 N-CA-C 110.475 -1.05 . . . . 1.0 110.475 179.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . 0.526 ' C ' ' CD1' ' A' ' 131' ' ' TRP . 0.9 OUTLIER -116.32 178.53 4.29 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 109.099 -0.704 . . . . 1.0 109.099 178.856 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.526 ' CD1' ' C ' ' A' ' 130' ' ' SER . 69.7 m95 -148.86 162.87 38.96 Favored 'General case' 0 C--N 1.32 -0.684 0 CA-C-N 116.301 -0.409 . . . . 1.0 110.286 -177.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 24.0 t -136.25 105.53 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.351 0 CA-C-N 116.577 -0.283 . . . . 1.0 111.105 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.466 ' HG ' HD11 ' A' ' 146' ' ' LEU . 26.5 mt -77.06 143.0 39.59 Favored 'General case' 0 C--O 1.218 -0.581 0 C-N-CA 120.947 -0.301 . . . . 1.0 110.266 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . 0.52 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 37.8 m-85 -119.29 133.24 55.84 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-O 120.68 0.276 . . . . 1.0 110.538 178.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -43.47 -46.86 7.01 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.531 -0.304 . . . . 1.0 111.359 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.818 HD11 ' C ' ' A' ' 140' ' ' ARG . 0.6 OUTLIER -129.9 165.91 21.09 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.062 0.458 . . . . 1.0 110.011 -178.355 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . 0.491 ' OG ' ' N ' ' A' ' 138' ' ' ASN . 4.1 t -69.71 174.78 4.75 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 115.537 -0.756 . . . . 1.0 110.768 179.416 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . 0.491 ' N ' ' OG ' ' A' ' 137' ' ' SER . 63.7 t30 63.39 18.78 11.28 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-N 115.046 -0.979 . . . . 1.0 109.752 -178.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 37.42 74.87 0.07 Allowed 'General case' 0 N--CA 1.467 0.422 0 CA-C-N 116.163 -0.471 . . . . 1.0 111.318 179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.818 ' C ' HD11 ' A' ' 136' ' ' LEU . 45.3 mmt-85 -144.2 40.38 1.35 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-O 120.872 0.368 . . . . 1.0 110.09 179.498 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.423 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -151.69 -146.82 4.42 Favored Glycine 0 N--CA 1.462 0.399 0 N-CA-C 111.294 -0.722 . . . . 1.0 111.294 -178.477 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 92.9 mtt180 -70.74 171.16 10.97 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 110.182 -0.303 . . . . 1.0 110.182 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.55 ' O ' ' NE2' ' A' ' 55' ' ' GLN . 5.7 pt20 -149.29 135.48 19.1 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.877 -0.601 . . . . 1.0 111.203 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 8.6 m-85 -130.15 124.03 31.71 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 109.757 -0.461 . . . . 1.0 109.757 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . . . . . . . . . 42.7 tp -79.9 127.47 32.29 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 115.716 -0.675 . . . . 1.0 111.025 -179.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.466 HD11 ' HG ' ' A' ' 133' ' ' LEU . 30.0 mt -117.47 107.86 14.82 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.42 -0.809 . . . . 1.0 110.5 179.785 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.428 ' SD ' ' NH2' ' A' ' 80' ' ' ARG . 0.3 OUTLIER -80.67 171.52 12.11 Favored Pre-proline 0 C--N 1.325 -0.459 0 CA-C-N 116.185 -0.461 . . . . 1.0 110.794 -179.589 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . 0.474 ' CD ' ' CD2' ' A' ' 84' ' ' HIS . 13.7 Cg_exo -67.45 115.7 3.84 Favored 'Trans proline' 0 N--CA 1.492 1.389 0 C-N-CA 122.225 1.95 . . . . 1.0 111.422 179.132 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 177.85 -152.26 11.61 Favored Glycine 0 CA--C 1.527 0.821 0 N-CA-C 110.621 -0.992 . . . . 1.0 110.621 -179.735 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.459 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 46.3 p-10 -127.75 125.2 39.48 Favored 'General case' 0 N--CA 1.466 0.337 0 CA-C-O 121.193 0.521 . . . . 1.0 110.603 -179.766 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 151' ' ' TYR . 12.2 m-85 -115.91 127.69 55.19 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 115.862 -0.608 . . . . 1.0 109.823 -179.757 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 -114.15 -3.07 13.27 Favored 'General case' 0 N--CA 1.465 0.323 0 CA-C-O 120.827 0.346 . . . . 1.0 110.762 -179.262 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . . . . . . . . . 34.4 ptt180 -157.23 164.45 37.71 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 115.679 -0.691 . . . . 1.0 110.732 179.357 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.572 ' CD2' ' HB3' ' A' ' 159' ' ' ALA . 0.1 OUTLIER -75.57 -20.76 58.4 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.031 -0.986 . . . . 1.0 111.978 -178.547 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.551 ' N ' ' CD1' ' A' ' 154' ' ' TYR . 1.2 mt-30 -65.55 -21.82 66.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.226 -0.443 . . . . 1.0 111.041 -179.111 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . . . . . . . . . 96.9 m-20 -48.14 -51.24 25.69 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 116.259 -0.428 . . . . 1.0 111.029 -178.936 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.595 ' HE1' ' HB2' ' A' ' 159' ' ' ALA . 27.4 p90 -99.61 19.71 15.3 Favored 'General case' 0 N--CA 1.464 0.227 0 CA-C-O 120.938 0.399 . . . . 1.0 110.258 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.0 74.36 0.3 Allowed Glycine 0 CA--C 1.518 0.243 0 N-CA-C 111.249 -0.741 . . . . 1.0 111.249 179.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.595 ' HB2' ' HE1' ' A' ' 157' ' ' TRP . . . -92.22 -171.13 2.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 121.245 0.545 . . . . 1.0 110.233 179.408 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 12.6 t -123.15 -33.67 3.27 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 115.144 -0.935 . . . . 1.0 111.573 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.629 ' O ' ' HB3' ' A' ' 162' ' ' ALA . 0.8 OUTLIER -149.43 -15.89 0.28 Allowed 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 120.757 0.313 . . . . 1.0 111.646 -178.953 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.629 ' HB3' ' O ' ' A' ' 161' ' ' ASN . . . 89.49 -21.71 0.13 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.614 -0.721 . . . . 1.0 110.48 179.854 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . . . . . . . . . 18.9 ptp180 -42.02 124.49 2.7 Favored 'General case' 0 N--CA 1.449 -0.516 0 CA-C-N 115.674 -0.694 . . . . 1.0 110.748 -179.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.6 HG23 ' O ' ' A' ' 162' ' ' ALA . 24.8 t -120.73 160.17 21.73 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.634 0 CA-C-N 115.216 -0.902 . . . . 1.0 109.713 179.334 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.52 ' N ' HG12 ' A' ' 164' ' ' VAL . . . -138.17 -35.08 0.17 Allowed Glycine 0 CA--C 1.519 0.29 0 N-CA-C 111.282 -0.727 . . . . 1.0 111.282 -179.339 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 110' ' ' SER . 15.0 m -162.06 172.06 16.52 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-O 121.01 0.433 . . . . 1.0 110.577 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . 0.407 ' CD2' HD11 ' A' ' 112' ' ' LEU . 0.4 OUTLIER -154.4 144.17 21.66 Favored 'General case' 0 CA--C 1.513 -0.46 0 CA-C-N 115.833 -0.621 . . . . 1.0 111.325 179.929 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.52 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 12.5 ptp180 -134.6 150.3 50.68 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.268 0.556 . . . . 1.0 110.27 179.091 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.522 ' NH2' ' OG ' ' A' ' 174' ' ' SER . 0.0 OUTLIER -76.88 147.69 36.91 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.146 -0.934 . . . . 1.0 108.698 177.143 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.462 HG21 ' CB ' ' A' ' 130' ' ' SER . 27.6 m -86.33 68.44 0.61 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.522 0 CA-C-N 115.934 -0.575 . . . . 1.0 112.384 -178.102 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.438 HD11 ' CD2' ' A' ' 88' ' ' HIS . 1.3 mp -127.18 128.25 70.18 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.424 0 CA-C-O 121.173 0.511 . . . . 1.0 109.913 179.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . 0.542 ' OD1' ' N ' ' A' ' 173' ' ' PHE . 46.2 p-10 -65.08 -34.98 79.7 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.676 -0.693 . . . . 1.0 110.386 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . 0.542 ' N ' ' OD1' ' A' ' 172' ' ' ASP . 88.6 m-85 -66.41 176.26 1.92 Allowed 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.128 -0.487 . . . . 1.0 110.598 -179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . 0.522 ' OG ' ' NH2' ' A' ' 169' ' ' ARG . 4.7 p . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.01 -0.995 . . . . 1.0 110.462 -179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.456 0 N-CA-C 109.441 -0.577 . . . . 1.0 109.441 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.573 ' N ' HD11 ' A' ' 81' ' ' LEU . . . -176.74 178.93 47.95 Favored Glycine 0 CA--C 1.527 0.818 0 N-CA-C 110.435 -1.066 . . . . 1.0 110.435 -179.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 12.2 tttt -172.99 106.82 0.15 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 120.778 -0.369 . . . . 1.0 110.141 -179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.452 ' CG2' ' CD1' ' A' ' 43' ' ' TRP . 0.1 OUTLIER -117.91 169.16 8.85 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.551 0 CA-C-O 121.346 0.594 . . . . 1.0 111.647 -179.771 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.448 HG22 ' CE1' ' A' ' 7' ' ' TYR . 62.3 m -125.07 121.73 35.15 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 108.35 -0.982 . . . . 1.0 108.35 177.398 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 55.4 mt -107.2 134.2 50.66 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.176 -0.92 . . . . 1.0 109.615 -179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TYR . . . . . 0.448 ' CE1' HG22 ' A' ' 5' ' ' THR . 86.0 m-85 -114.53 129.73 56.69 Favored 'General case' 0 C--N 1.325 -0.464 0 CA-C-N 115.8 -0.636 . . . . 1.0 111.036 -178.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.456 ' HA ' ' O ' ' A' ' 32' ' ' ARG . 80.5 tt0 -55.62 -20.78 14.91 Favored 'General case' 0 N--CA 1.443 -0.783 0 CA-C-N 115.571 -0.741 . . . . 1.0 109.894 -179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -126.93 163.2 24.19 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-O 121.399 0.618 . . . . 1.0 111.0 179.145 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -67.82 179.02 1.53 Allowed 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.083 -0.962 . . . . 1.0 111.37 -178.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 49.59 25.98 7.11 Favored Glycine 0 C--N 1.335 0.518 0 N-CA-C 110.677 -0.969 . . . . 1.0 110.677 178.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 51.7 66.02 1.32 Allowed 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 109.94 -0.393 . . . . 1.0 109.94 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 93.2 mm-40 -128.51 -155.06 0.68 Allowed 'General case' 0 N--CA 1.467 0.382 0 CA-C-O 120.945 0.402 . . . . 1.0 110.535 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 41.07 -153.62 0.08 OUTLIER Glycine 0 CA--C 1.528 0.853 0 N-CA-C 111.012 -0.835 . . . . 1.0 111.012 179.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -68.62 148.08 50.98 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.688 0.28 . . . . 1.0 110.75 -179.781 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' HIS . . . . . . . . . . . . . 14.1 p-80 -135.46 151.32 50.29 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.418 0.628 . . . . 1.0 110.683 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' TYR . . . . . 0.509 ' CD1' ' N ' ' A' ' 18' ' ' GLU . 3.3 t80 -147.29 141.64 26.32 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-N 114.975 -1.011 . . . . 1.0 109.682 -179.344 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.509 ' N ' ' CD1' ' A' ' 17' ' ' TYR . 72.8 tt0 -110.07 121.4 45.17 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.24 -0.436 . . . . 1.0 110.517 -179.649 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.5 t -107.18 126.0 51.83 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-O 120.954 0.407 . . . . 1.0 110.891 -179.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' SER . . . . . . . . . . . . . 6.5 m -118.72 13.22 13.24 Favored 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 115.699 -0.682 . . . . 1.0 110.755 -179.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 49.8 m -158.03 169.49 24.45 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.441 . . . . 1.0 110.421 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 85.8 m-20 -61.03 136.41 58.08 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-N 116.029 -0.532 . . . . 1.0 111.457 -179.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -133.34 150.22 51.86 Favored 'General case' 0 N--CA 1.468 0.454 0 CA-C-N 116.015 -0.539 . . . . 1.0 110.576 -179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.7 p -117.05 -13.85 10.58 Favored 'General case' 0 N--CA 1.469 0.489 0 N-CA-C 113.084 0.772 . . . . 1.0 113.084 -178.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -152.01 109.43 3.59 Favored 'General case' 0 C--N 1.324 -0.523 0 C-N-CA 120.127 -0.629 . . . . 1.0 111.618 -178.409 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.417 ' O ' ' N ' ' A' ' 30' ' ' LEU . 3.3 mp -100.39 -1.76 35.18 Favored 'General case' 0 N--CA 1.466 0.367 0 CA-C-N 115.052 -0.976 . . . . 1.0 110.336 179.381 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.611 ' N ' ' HD2' ' A' ' 28' ' ' PRO . 28.5 mt-30 -51.85 -49.96 80.64 Favored Pre-proline 0 C--N 1.327 -0.409 0 C-N-CA 120.368 -0.533 . . . . 1.0 111.04 -179.35 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' PRO . . . . . 0.611 ' HD2' ' N ' ' A' ' 27' ' ' GLN . 19.6 Cg_endo -57.88 -33.55 97.18 Favored 'Trans proline' 0 C--N 1.311 -1.419 0 C-N-CA 121.52 1.48 . . . . 1.0 112.414 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TYR . . . . . 0.413 ' CD1' ' N ' ' A' ' 29' ' ' TYR . 0.9 OUTLIER -95.39 -51.48 4.56 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-O 120.969 0.414 . . . . 1.0 111.131 -178.09 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LEU . . . . . 0.417 ' N ' ' O ' ' A' ' 26' ' ' LEU . 11.1 mt -121.32 129.94 53.37 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 116.032 -0.531 . . . . 1.0 111.327 -178.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 5.6 t -93.7 -9.23 38.46 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.698 -0.683 . . . . 1.0 111.177 179.816 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.456 ' O ' ' HA ' ' A' ' 8' ' ' GLU . 62.3 ttp180 -179.1 119.29 0.07 Allowed 'General case' 0 C--O 1.216 -0.681 0 N-CA-C 108.637 -0.875 . . . . 1.0 108.637 -179.089 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' CYS . . . . . . . . . . . . . 21.6 t -100.95 113.41 26.37 Favored 'General case' 0 N--CA 1.465 0.3 0 CA-C-O 120.739 0.304 . . . . 1.0 110.289 178.536 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 10.0 m120 -105.5 -5.3 20.38 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.196 -0.456 . . . . 1.0 110.888 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 20.1 p -156.61 158.26 36.75 Favored 'General case' 0 N--CA 1.467 0.391 0 C-N-CA 120.686 -0.406 . . . . 1.0 110.863 179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -154.6 155.05 34.02 Favored 'General case' 0 N--CA 1.463 0.211 0 CA-C-O 121.347 0.594 . . . . 1.0 112.036 -178.818 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 37.7 mtt180 -136.47 122.45 20.15 Favored 'General case' 0 C--O 1.218 -0.571 0 CA-C-N 115.207 -0.906 . . . . 1.0 108.838 178.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.499 HG13 ' H ' ' A' ' 61' ' ' GLY . 1.2 p -110.29 123.17 65.96 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.463 0 CA-C-O 120.973 0.416 . . . . 1.0 110.016 178.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 23.4 t0 -77.19 -45.06 27.92 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 115.737 -0.665 . . . . 1.0 110.985 -179.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 90.5 p -159.8 162.87 34.88 Favored 'General case' 0 N--CA 1.444 -0.773 0 N-CA-C 108.74 -0.837 . . . . 1.0 108.74 179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 80.42 173.1 46.01 Favored Glycine 0 C--N 1.314 -0.671 0 N-CA-C 110.253 -1.139 . . . . 1.0 110.253 -179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 66.6 m -111.78 142.98 43.45 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.714 -0.847 . . . . 1.0 108.714 178.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' TRP . . . . . 0.626 ' CZ2' HD12 ' A' ' 81' ' ' LEU . 56.4 m95 -130.88 155.56 46.54 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-O 121.455 0.645 . . . . 1.0 111.206 -178.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' MET . . . . . 0.64 ' C ' HD23 ' A' ' 45' ' ' LEU . 9.2 ttm -130.68 131.48 44.87 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 115.35 -0.841 . . . . 1.0 109.036 177.664 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.64 HD23 ' C ' ' A' ' 44' ' ' MET . 0.3 OUTLIER -107.97 137.45 45.94 Favored 'General case' 0 N--CA 1.463 0.214 0 N-CA-C 109.114 -0.699 . . . . 1.0 109.114 179.997 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' TYR . . . . . . . . . . . . . 84.1 m-85 -113.68 132.18 55.88 Favored 'General case' 0 N--CA 1.467 0.403 0 CA-C-O 121.178 0.513 . . . . 1.0 110.925 -179.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.645 ' CD ' ' H ' ' A' ' 54' ' ' LEU . 7.3 pt-20 -60.9 -35.67 77.26 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 115.643 -0.708 . . . . 1.0 111.237 -179.228 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLN . . . . . . . . . . . . . 6.3 mt-30 -109.77 151.66 42.46 Favored Pre-proline 0 CA--C 1.532 0.265 0 CA-C-N 115.819 -0.628 . . . . 1.0 110.445 -179.002 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . 0.448 ' HD3' ' HE ' ' A' ' 77' ' ' ARG . 42.1 Cg_endo -64.01 158.21 48.83 Favored 'Trans proline' 0 N--CA 1.497 1.704 0 C-N-CA 122.69 2.26 . . . . 1.0 113.533 178.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.683 HD22 ' N ' ' A' ' 50' ' ' ASN . 0.8 OUTLIER 63.82 36.24 10.56 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-N 115.091 -0.959 . . . . 1.0 111.626 179.764 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 4.1 m-85 52.5 72.67 0.39 Allowed 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 114.995 -1.002 . . . . 1.0 110.852 179.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 5.1 p -142.41 159.64 41.83 Favored 'General case' 0 N--CA 1.44 -0.959 0 CA-C-N 116.004 -0.544 . . . . 1.0 109.679 -178.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 84.6 -149.15 24.32 Favored Glycine 0 N--CA 1.447 -0.585 0 C-N-CA 120.728 -0.749 . . . . 1.0 112.261 179.714 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LEU . . . . . 0.645 ' H ' ' CD ' ' A' ' 47' ' ' GLU . 42.5 tp -77.8 140.95 39.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 114.807 -0.697 . . . . 1.0 110.244 -179.516 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . 0.491 ' OE1' ' SD ' ' A' ' 44' ' ' MET . 13.9 pt20 -120.53 149.31 42.62 Favored 'General case' 0 N--CA 1.474 0.743 0 CA-C-N 117.803 0.274 . . . . 1.0 110.663 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 3.2 m-85 -128.49 129.88 46.71 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 116.622 -0.263 . . . . 1.0 111.276 179.571 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' PHE . . . . . 0.496 ' H ' ' NE2' ' A' ' 143' ' ' GLN . 67.6 t80 -82.66 123.52 29.34 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-O 121.506 0.67 . . . . 1.0 110.597 -179.744 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -110.08 134.5 52.09 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-N 114.809 -1.087 . . . . 1.0 108.5 179.009 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.418 ' O ' ' C ' ' A' ' 60' ' ' ARG . 37.8 ttp180 -130.03 151.68 50.31 Favored 'General case' 0 N--CA 1.466 0.33 0 N-CA-C 109.365 -0.606 . . . . 1.0 109.365 179.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ARG . . . . . 0.456 ' HA ' HG13 ' A' ' 38' ' ' VAL . 78.0 ttt-85 -34.66 125.47 0.52 Allowed 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.167 -0.47 . . . . 1.0 111.769 -178.113 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLY . . . . . 0.499 ' H ' HG13 ' A' ' 38' ' ' VAL . . . 152.48 -175.29 31.16 Favored Glycine 0 CA--C 1.527 0.79 0 N-CA-C 110.221 -1.152 . . . . 1.0 110.221 -179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 62' ' ' ASP . 49.5 p-10 -117.32 131.29 56.83 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-O 121.182 0.515 . . . . 1.0 111.106 -179.651 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 53.2 m-85 -125.27 115.14 19.91 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 109.102 -0.703 . . . . 1.0 109.102 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . 0.439 ' O ' ' OD1' ' A' ' 65' ' ' ASP . . . -95.51 -5.06 43.72 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 116.148 -0.478 . . . . 1.0 111.764 -178.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.439 ' OD1' ' O ' ' A' ' 64' ' ' ALA . 90.6 m-20 -145.76 136.04 23.91 Favored 'General case' 0 C--N 1.327 -0.396 0 N-CA-C 108.674 -0.861 . . . . 1.0 108.674 179.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' HIS . . . . . 0.483 ' CD2' ' H ' ' A' ' 66' ' ' HIS . 6.0 p80 -56.06 -42.64 76.95 Favored 'General case' 0 C--N 1.326 -0.419 0 C-N-CA 120.074 -0.65 . . . . 1.0 110.918 -178.817 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -50.17 -8.89 0.04 OUTLIER 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 115.72 -0.673 . . . . 1.0 111.566 -179.769 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.446 ' H ' ' C ' ' A' ' 66' ' ' HIS . 18.7 mm-40 -85.05 -34.06 22.36 Favored 'General case' 0 N--CA 1.467 0.404 0 C-N-CA 120.336 -0.546 . . . . 1.0 110.983 -179.243 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' TRP . . . . . 0.425 ' O ' ' HB2' ' A' ' 70' ' ' MET . 1.9 p90 -91.91 20.5 5.66 Favored 'General case' 0 C--N 1.325 -0.476 0 C-N-CA 120.32 -0.552 . . . . 1.0 110.873 179.41 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' MET . . . . . 0.425 ' HB2' ' O ' ' A' ' 69' ' ' TRP . 43.0 mtt 81.22 12.25 0.76 Allowed 'General case' 0 CA--C 1.515 -0.386 0 O-C-N 123.772 0.67 . . . . 1.0 109.665 -178.81 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . -55.67 97.02 0.04 OUTLIER Glycine 0 N--CA 1.445 -0.703 0 N-CA-C 110.962 -0.855 . . . . 1.0 110.962 179.174 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 26.2 mt -69.88 -36.23 75.29 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.22 -0.659 . . . . 1.0 109.22 176.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.489 ' C ' ' H ' ' A' ' 75' ' ' SER . 46.6 t -130.33 128.46 41.53 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-N 116.388 -0.369 . . . . 1.0 110.017 178.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASP . . . . . . . . . . . . . 54.4 p30 -69.15 40.68 0.04 OUTLIER 'General case' 0 C--N 1.331 -0.216 0 CA-C-N 116.221 -0.445 . . . . 1.0 111.21 -179.173 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.489 ' H ' ' C ' ' A' ' 73' ' ' SER . 66.2 m -115.2 123.31 48.55 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 109.154 -0.684 . . . . 1.0 109.154 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 61.8 t -152.43 104.61 0.23 Allowed 'Isoleucine or valine' 0 C--N 1.324 -0.508 0 N-CA-C 109.435 -0.58 . . . . 1.0 109.435 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.448 ' HE ' ' HD3' ' A' ' 49' ' ' PRO . 85.3 mtm-85 -114.73 6.68 15.67 Favored 'General case' 0 C--O 1.223 -0.302 0 N-CA-C 111.685 0.254 . . . . 1.0 111.685 -179.09 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 25.7 p -164.44 163.42 22.24 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 120.153 -0.619 . . . . 1.0 111.127 178.734 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' CYS . . . . . . . . . . . . . 28.1 p -158.4 149.11 20.39 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-N 115.709 -0.678 . . . . 1.0 111.037 -177.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 5.1 ptm180 -128.2 150.52 49.98 Favored 'General case' 0 CA--C 1.519 -0.228 0 CA-C-O 120.742 0.306 . . . . 1.0 110.208 179.212 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.717 HD23 ' N ' ' A' ' 82' ' ' ILE . 4.3 tt -101.2 124.76 47.41 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 108.339 -0.986 . . . . 1.0 108.339 179.175 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.717 ' N ' HD23 ' A' ' 81' ' ' LEU . 3.2 mt -86.03 114.33 56.56 Favored Pre-proline 0 CA--C 1.544 0.715 0 CA-C-N 116.1 -0.5 . . . . 1.0 110.577 -178.246 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo -51.89 150.1 18.67 Favored 'Trans proline' 0 N--CA 1.498 1.772 0 C-N-CA 121.844 1.696 . . . . 1.0 112.274 179.687 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' HIS . . . . . . . . . . . . . 55.6 p-80 -50.44 157.08 0.76 Allowed 'General case' 0 C--N 1.331 -0.2 0 CA-C-N 115.849 -0.614 . . . . 1.0 109.545 -179.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -97.19 -61.76 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 112.105 0.409 . . . . 1.0 112.105 -179.053 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLY . . . . . 0.546 ' O ' ' NE2' ' A' ' 88' ' ' HIS . . . 74.64 -96.47 0.94 Allowed Glycine 0 CA--C 1.525 0.69 0 N-CA-C 109.176 -1.57 . . . . 1.0 109.176 -178.264 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' SER . . . . . . . . . . . . . 4.8 m -83.85 140.76 31.8 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 109.379 -0.601 . . . . 1.0 109.379 177.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.572 ' ND1' ' NH1' ' A' ' 169' ' ' ARG . 1.9 m170 -129.69 107.69 9.62 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.068 0.395 . . . . 1.0 112.068 -178.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.412 HH21 ' HG ' ' A' ' 127' ' ' LEU . 57.3 ttp180 -138.21 127.61 24.69 Favored 'General case' 0 N--CA 1.471 0.61 0 N-CA-C 109.468 -0.567 . . . . 1.0 109.468 177.271 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' ILE . . . . . 0.514 HG22 ' CH2' ' A' ' 131' ' ' TRP . 18.3 tt -145.85 145.11 20.52 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 CA-C-O 120.758 0.313 . . . . 1.0 111.286 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.667 ' HE ' ' CE ' ' A' ' 102' ' ' MET . 83.2 mtp180 -122.69 98.69 6.03 Favored 'General case' 0 N--CA 1.472 0.673 0 CA-C-N 115.808 -0.633 . . . . 1.0 111.773 -179.371 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 24.3 mt -80.27 139.06 36.83 Favored 'General case' 0 N--CA 1.462 0.162 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.522 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' TYR . . . . . 0.441 ' CE1' ' CB ' ' A' ' 98' ' ' TYR . 78.7 m-85 -115.0 134.05 55.52 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 116.121 -0.491 . . . . 1.0 111.141 179.504 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.567 ' CD ' ' H ' ' A' ' 101' ' ' GLN . 20.1 pt-20 -54.33 -41.3 68.88 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 116.072 -0.513 . . . . 1.0 111.496 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.49 ' O ' ' OG ' ' A' ' 123' ' ' SER . 9.9 mtt-85 -121.88 168.24 12.1 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-N 116.011 -0.541 . . . . 1.0 110.846 -178.063 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 94.9 mt-10 -45.75 154.56 0.21 Allowed 'General case' 0 N--CA 1.463 0.217 0 CA-C-O 121.448 0.642 . . . . 1.0 111.034 179.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 54.9 -96.83 0.06 Allowed 'General case' 0 C--N 1.327 -0.397 0 CA-C-N 114.984 -1.007 . . . . 1.0 109.432 -178.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.441 ' CB ' ' CE1' ' A' ' 93' ' ' TYR . 4.9 p90 -172.11 31.48 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 119.854 -0.739 . . . . 1.0 109.471 179.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 -83.41 39.02 0.64 Allowed 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 115.158 -0.928 . . . . 1.0 112.173 -177.022 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -166.97 -161.16 15.45 Favored Glycine 0 CA--C 1.527 0.808 0 CA-C-N 115.585 -0.734 . . . . 1.0 111.403 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLN . . . . . 0.567 ' H ' ' CD ' ' A' ' 94' ' ' GLU . 67.4 tp60 -65.01 146.78 54.57 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 121.071 0.463 . . . . 1.0 110.987 -179.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' MET . . . . . 0.667 ' CE ' ' HE ' ' A' ' 91' ' ' ARG . 10.8 ttp -129.92 152.53 49.29 Favored 'General case' 0 N--CA 1.464 0.241 0 CA-C-N 115.49 -0.777 . . . . 1.0 110.439 179.518 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.465 ' N ' ' HG2' ' A' ' 102' ' ' MET . 9.7 tt -145.01 137.54 21.38 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.516 0 N-CA-C 108.459 -0.941 . . . . 1.0 108.459 177.49 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 78.0 tt0 -111.78 141.75 45.0 Favored 'General case' 0 N--CA 1.471 0.594 0 CA-C-O 121.449 0.642 . . . . 1.0 110.737 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' PHE . . . . . 0.619 ' CZ ' HD21 ' A' ' 112' ' ' LEU . 92.2 m-85 -127.44 148.88 50.3 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-N 114.868 -1.06 . . . . 1.0 110.533 -179.632 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . . . . . . . . . 17.6 p -139.81 16.67 2.5 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.144 -0.48 . . . . 1.0 110.704 179.489 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLU . . . . . 0.489 ' N ' ' CD ' ' A' ' 107' ' ' GLU . 1.0 OUTLIER -149.41 -174.95 4.81 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 120.526 -0.47 . . . . 1.0 110.293 178.961 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASP . . . . . 0.439 ' O ' ' OD1' ' A' ' 108' ' ' ASP . 52.0 p-10 -74.33 141.49 45.2 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.335 -0.393 . . . . 1.0 111.165 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -133.07 116.52 16.44 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-N 116.355 -0.384 . . . . 1.0 110.324 179.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' SER . . . . . 0.424 ' O ' ' OG ' ' A' ' 166' ' ' SER . 83.5 p -90.97 -21.64 21.21 Favored 'General case' 0 N--CA 1.466 0.372 0 CA-C-O 120.921 0.391 . . . . 1.0 110.911 179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' CYS . . . . . . . . . . . . . 38.5 m -146.4 94.54 2.47 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 121.406 0.622 . . . . 1.0 109.867 -179.85 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.619 HD21 ' CZ ' ' A' ' 105' ' ' PHE . 0.4 OUTLIER -60.59 -39.54 88.45 Favored 'General case' 0 C--N 1.322 -0.627 0 CA-C-N 114.821 -1.081 . . . . 1.0 110.673 -178.467 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . 0.614 ' H ' ' CD ' ' A' ' 113' ' ' GLN . 11.4 mp0 -49.09 -12.75 0.05 Allowed 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 112.736 0.643 . . . . 1.0 112.736 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' ASP . . . . . 0.412 ' OD1' ' O ' ' A' ' 114' ' ' ASP . 61.6 t0 -88.87 -10.42 48.03 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.909 -0.774 . . . . 1.0 108.909 179.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 26.3 mmt180 -118.85 -39.52 2.95 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 114.22 1.193 . . . . 1.0 114.22 -177.124 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' PHE . . . . . 0.623 ' O ' ' CD1' ' A' ' 116' ' ' PHE . 0.1 OUTLIER -124.08 135.2 53.4 Favored 'General case' 0 N--CA 1.481 1.079 0 CA-C-O 122.523 1.154 . . . . 1.0 112.467 -178.898 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 95.6 mtt180 -65.13 -68.27 0.37 Allowed 'General case' 0 C--N 1.327 -0.412 0 CA-C-N 115.111 -0.949 . . . . 1.0 111.022 -177.788 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.59 ' O ' ' CE2' ' A' ' 116' ' ' PHE . 65.9 m-85 -42.91 141.62 1.07 Allowed 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.406 -0.816 . . . . 1.0 109.61 -179.788 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 119' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -101.15 5.7 42.86 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 120.928 0.394 . . . . 1.0 110.269 -179.353 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 120' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -134.46 139.13 45.29 Favored 'General case' 0 C--N 1.334 -0.101 0 CA-C-O 121.461 0.648 . . . . 1.0 111.344 -179.001 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 121' ' ' ILE . . . . . 0.715 ' O ' ' HB1' ' A' ' 162' ' ' ALA . 45.9 mm -119.5 123.39 71.05 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 114.853 -1.067 . . . . 1.0 108.895 178.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 122' ' ' HIS . . . . . . . . . . . . . 29.5 m-70 -115.08 15.72 17.11 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 111.9 0.333 . . . . 1.0 111.9 -178.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 123' ' ' SER . . . . . 0.49 ' OG ' ' O ' ' A' ' 95' ' ' ARG . 5.7 p 176.93 149.97 0.15 Allowed 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.212 -0.662 . . . . 1.0 109.212 179.328 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 124' ' ' LEU . . . . . 0.46 HD21 ' CZ3' ' A' ' 157' ' ' TRP . 1.1 pp -159.97 156.54 27.3 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 115.569 -0.742 . . . . 1.0 109.856 -178.16 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 125' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -124.21 109.31 13.25 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-N 116.367 -0.379 . . . . 1.0 110.194 -179.582 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 126' ' ' VAL . . . . . 0.43 HG22 HD12 ' A' ' 90' ' ' ILE . 4.1 t -96.4 103.95 15.28 Favored 'Isoleucine or valine' 0 C--O 1.233 0.192 0 N-CA-C 109.171 -0.677 . . . . 1.0 109.171 178.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 127' ' ' LEU . . . . . 0.826 ' H ' HD22 ' A' ' 127' ' ' LEU . 0.7 OUTLIER -74.03 -36.87 64.45 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.156 -0.475 . . . . 1.0 110.562 179.578 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 128' ' ' GLU . . . . . 0.409 ' O ' ' O ' ' A' ' 129' ' ' GLY . 21.4 pt-20 -151.55 168.58 24.48 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 115.734 -0.666 . . . . 1.0 111.007 -178.115 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 129' ' ' GLY . . . . . 0.409 ' O ' ' O ' ' A' ' 128' ' ' GLU . . . 54.41 167.79 0.03 OUTLIER Glycine 0 CA--C 1.521 0.407 0 CA-C-N 115.073 -0.967 . . . . 1.0 110.746 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 70.5 m -113.99 145.06 42.08 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 109.15 -0.685 . . . . 1.0 109.15 178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 131' ' ' TRP . . . . . 0.514 ' CH2' HG22 ' A' ' 90' ' ' ILE . 30.3 m95 -120.52 162.24 19.92 Favored 'General case' 0 C--N 1.326 -0.439 0 CA-C-N 115.474 -0.785 . . . . 1.0 110.64 -178.031 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 16.3 t -137.03 93.04 0.97 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.359 0 CA-C-N 116.128 -0.487 . . . . 1.0 111.749 179.806 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 133' ' ' LEU . . . . . 0.447 ' CD1' HD11 ' A' ' 146' ' ' LEU . 26.5 mt -66.09 146.15 55.0 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 120.558 -0.457 . . . . 1.0 111.21 -178.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 134' ' ' TYR . . . . . 0.583 ' CZ ' ' NH2' ' A' ' 168' ' ' ARG . 60.1 m-85 -121.54 136.43 54.95 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-O 120.793 0.33 . . . . 1.0 111.071 178.779 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 135' ' ' GLU . . . . . . . . . . . . . 47.1 tp10 -48.39 -40.69 26.59 Favored 'General case' 0 N--CA 1.465 0.305 0 CA-C-N 116.33 -0.395 . . . . 1.0 111.037 -179.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 136' ' ' LEU . . . . . 0.498 ' O ' HD12 ' A' ' 136' ' ' LEU . 0.4 OUTLIER -133.13 176.57 8.39 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-O 121.273 0.559 . . . . 1.0 111.069 -179.46 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 23.8 p -80.62 169.7 17.3 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 115.488 -0.778 . . . . 1.0 111.628 -179.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 42.9 t30 64.98 15.51 10.01 Favored 'General case' 0 C--N 1.331 -0.222 0 CA-C-N 114.888 -1.051 . . . . 1.0 110.614 -179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 139' ' ' TYR . . . . . . . . . . . . . 7.3 m-85 42.26 79.32 0.04 OUTLIER 'General case' 0 C--N 1.327 -0.386 0 CA-C-N 115.606 -0.725 . . . . 1.0 112.536 179.111 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 140' ' ' ARG . . . . . 0.415 ' H ' ' CD1' ' A' ' 136' ' ' LEU . 94.1 mtt-85 -147.39 35.45 0.88 Allowed 'General case' 0 N--CA 1.477 0.882 0 CA-C-O 120.768 0.318 . . . . 1.0 110.934 178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 141' ' ' GLY . . . . . 0.418 ' N ' HD11 ' A' ' 136' ' ' LEU . . . -147.11 -142.52 3.71 Favored Glycine 0 CA--C 1.525 0.661 0 N-CA-C 111.559 -0.616 . . . . 1.0 111.559 -178.72 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -77.1 167.1 22.37 Favored 'General case' 0 C--N 1.334 -0.088 0 N-CA-C 110.119 -0.326 . . . . 1.0 110.119 179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 143' ' ' GLN . . . . . 0.496 ' NE2' ' H ' ' A' ' 57' ' ' PHE . 1.8 pt20 -143.31 138.1 29.28 Favored 'General case' 0 N--CA 1.465 0.289 0 CA-C-N 116.228 -0.442 . . . . 1.0 111.126 -178.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 144' ' ' TYR . . . . . . . . . . . . . 20.6 m-85 -128.99 123.05 31.39 Favored 'General case' 0 N--CA 1.478 0.926 0 CA-C-N 118.065 0.393 . . . . 1.0 110.304 179.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 145' ' ' LEU . . . . . 0.591 HD23 ' N ' ' A' ' 146' ' ' LEU . 0.7 OUTLIER -78.74 126.97 31.44 Favored 'General case' 0 CA--C 1.515 -0.383 0 CA-C-N 115.435 -0.802 . . . . 1.0 112.345 -178.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 146' ' ' LEU . . . . . 0.591 ' N ' HD23 ' A' ' 145' ' ' LEU . 40.0 mt -116.69 102.45 9.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-N 115.269 -0.878 . . . . 1.0 109.418 178.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 147' ' ' MET . . . . . 0.624 ' N ' ' SD ' ' A' ' 147' ' ' MET . 0.0 OUTLIER -79.36 160.69 69.83 Favored Pre-proline 0 C--N 1.328 -0.342 0 N-CA-C 109.121 -0.696 . . . . 1.0 109.121 -179.603 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 148' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_endo -56.97 113.83 1.65 Allowed 'Trans proline' 0 C--N 1.306 -1.703 0 C-N-CA 121.888 1.726 . . . . 1.0 111.209 -179.763 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 149' ' ' GLY . . . . . . . . . . . . . . . 175.92 -153.91 15.95 Favored Glycine 0 CA--C 1.528 0.872 0 N-CA-C 110.539 -1.024 . . . . 1.0 110.539 -179.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 150' ' ' ASP . . . . . 0.436 ' O ' ' OD1' ' A' ' 150' ' ' ASP . 53.6 p-10 -123.42 141.72 51.71 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 120.999 0.428 . . . . 1.0 110.614 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.531 ' CD2' ' OD2' ' A' ' 156' ' ' ASP . 20.5 m-85 -133.17 129.32 37.65 Favored 'General case' 0 N--CA 1.464 0.237 0 CA-C-N 115.952 -0.567 . . . . 1.0 109.837 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 25.3 mmt180 -118.27 -0.58 11.49 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-O 120.649 0.262 . . . . 1.0 110.331 -179.646 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 153' ' ' ARG . . . . . 0.702 HH21 ' NE2' ' A' ' 155' ' ' GLN . 12.3 ptm180 -157.42 158.58 36.12 Favored 'General case' 0 C--O 1.232 0.176 0 CA-C-O 121.279 0.561 . . . . 1.0 110.36 179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 14.2 p90 -74.16 -22.48 59.41 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.188 -0.915 . . . . 1.0 112.651 -177.552 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 155' ' ' GLN . . . . . 0.702 ' NE2' HH21 ' A' ' 153' ' ' ARG . 38.7 mt-30 -68.32 -18.84 64.6 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.544 -0.298 . . . . 1.0 111.48 -179.275 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 156' ' ' ASP . . . . . 0.531 ' OD2' ' CD2' ' A' ' 151' ' ' TYR . 58.6 t0 -54.17 -47.82 71.58 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 120.976 -0.289 . . . . 1.0 110.691 -179.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 157' ' ' TRP . . . . . 0.643 ' CD1' ' HB2' ' A' ' 159' ' ' ALA . 24.3 p90 -92.44 21.17 5.51 Favored 'General case' 0 N--CA 1.466 0.362 0 N-CA-C 109.729 -0.471 . . . . 1.0 109.729 178.206 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . 52.1 74.32 0.31 Allowed Glycine 0 CA--C 1.522 0.473 0 N-CA-C 110.931 -0.868 . . . . 1.0 110.931 179.506 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 159' ' ' ALA . . . . . 0.643 ' HB2' ' CD1' ' A' ' 157' ' ' TRP . . . -118.45 153.66 33.74 Favored 'General case' 0 N--CA 1.464 0.258 0 CA-C-O 121.922 0.868 . . . . 1.0 111.677 -179.261 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 15.0 t -81.8 -17.24 48.25 Favored 'General case' 0 C--N 1.32 -0.702 0 CA-C-N 113.749 -1.569 . . . . 1.0 110.141 177.83 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 161' ' ' ASN . . . . . 0.499 ' ND2' ' H ' ' A' ' 162' ' ' ALA . 2.9 t30 -168.51 -171.38 1.43 Allowed 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.821 -0.352 . . . . 1.0 110.351 -179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 162' ' ' ALA . . . . . 0.715 ' HB1' ' O ' ' A' ' 121' ' ' ILE . . . -108.58 -4.95 16.73 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.186 -0.461 . . . . 1.0 110.896 -179.891 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 163' ' ' ARG . . . . . 0.409 ' HG3' HD22 ' A' ' 161' ' ' ASN . 95.4 mtt-85 -50.93 116.15 1.85 Allowed 'General case' 0 CA--C 1.515 -0.373 0 CA-C-O 120.631 0.253 . . . . 1.0 111.317 -178.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 164' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 162' ' ' ALA . 77.6 t -128.35 133.69 66.31 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.495 -0.557 . . . . 1.0 109.495 178.067 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 165' ' ' GLY . . . . . 0.43 ' HA2' HE22 ' A' ' 113' ' ' GLN . . . -110.38 -28.41 4.07 Favored Glycine 0 CA--C 1.526 0.721 0 N-CA-C 112.017 -0.433 . . . . 1.0 112.017 -179.561 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 166' ' ' SER . . . . . 0.424 ' OG ' ' O ' ' A' ' 110' ' ' SER . 32.0 m -158.67 -168.56 2.45 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-O 120.731 0.3 . . . . 1.0 110.367 -179.702 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 167' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -174.33 139.58 0.61 Allowed 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.254 -0.43 . . . . 1.0 110.464 -179.635 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 168' ' ' ARG . . . . . 0.583 ' NH2' ' CZ ' ' A' ' 134' ' ' TYR . 8.8 ptp180 -129.68 154.2 47.38 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 109.675 -0.491 . . . . 1.0 109.675 179.131 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 169' ' ' ARG . . . . . 0.601 ' H ' ' HD2' ' A' ' 169' ' ' ARG . 0.0 OUTLIER -88.46 145.08 25.96 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 108.933 -0.766 . . . . 1.0 108.933 178.742 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 170' ' ' VAL . . . . . 0.501 ' C ' HD12 ' A' ' 171' ' ' ILE . 57.3 t -77.26 84.74 0.84 Allowed 'Isoleucine or valine' 0 C--N 1.321 -0.651 0 CA-C-O 121.069 0.462 . . . . 1.0 110.862 -178.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 171' ' ' ILE . . . . . 0.501 HD12 ' C ' ' A' ' 170' ' ' VAL . 1.3 mp -112.08 131.04 64.62 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 115.739 -0.664 . . . . 1.0 109.577 179.493 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 172' ' ' ASP . . . . . . . . . . . . . 14.8 p-10 -65.75 -35.09 79.74 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 115.809 -0.632 . . . . 1.0 110.917 179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 173' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 -61.19 -79.16 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 120.804 0.335 . . . . 1.0 110.539 -179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 174' ' ' SER . . . . . . . . . . . . . 67.1 m . . . . . 0 C--O 1.221 -0.436 0 CA-C-O 118.065 -0.969 . . . . 1.0 110.694 179.794 . . . . . . . . 0 0 . 1 stop_ save_